diff --git "a/train.txt" "b/train.txt" new file mode 100644--- /dev/null +++ "b/train.txt" @@ -0,0 +1,65670 @@ +Nuclear B-Task +theory I-Task +devoted O +major O +efforts O +since O +4 O +decades O +to O +describe O +thermalization B-Task +in O +nuclear B-Process +reactions I-Process +, O +predominantly O +using O +semi-classical B-Process +methods I-Process +[ O +13,14,10 O +] O +, O +in O +line O +with O +similar O +problems O +in O +quantum B-Material +liquids I-Material +[ O +15,16 O +] O +. O +There O +were O +attempts O +to O +develop O +improved B-Process +molecular I-Process +dynamics I-Process +methods I-Process +combining B-Task +quantum I-Task +features I-Task +with O +a O +semi B-Process +classical I-Process +treatment I-Process +of I-Process +dynamical I-Process +correlations I-Process +[ O +17,18 O +] O +. O +Still O +, O +no O +clear-cut O +quantum B-Process +approach I-Process +is O +readily O +available O +yet O +, O +in O +spite O +of O +numerous O +formal O +attempts O +[ O +19,20,10 O +] O +. O +The O +field B-Task +of I-Task +clusters I-Task +and I-Task +nano I-Task +structures I-Task +is O +far O +younger O +but O +fast O +developing O +in O +relation O +to O +the O +ongoing O +developments O +of O +lasers B-Process +and O +imaging B-Process +techniques I-Process +. O +Semiclassical O +approaches O +were O +also O +considered O +in O +the O +field O +to O +include O +some O +dynamical O +corrections O +[ O +21,22 O +] O +and O +could O +qualitatively B-Process +describe I-Process +dynamical I-Process +processes I-Process +. I-Process +But O +such O +approaches O +are O +bound O +to O +simple B-Material +metals I-Material +with O +sufficiently O +delocalized O +wave O +functions O +, O +and O +thus O +smooth O +potentials O +justifying O +semiclassical O +approximations O +. O +The O +case O +of O +organic B-Task +systems I-Task +, O +in O +particular O +the O +much O +celebrated O +C60 B-Material +[ O +4,23 O +] O +, O +cannot O +be O +treated O +this O +way O +. O +Semi O +classical O +, O +and O +even O +classical O +approaches O +, O +can O +be O +used O +at O +very O +high O +excitations O +such O +as O +delivered O +by O +very B-Process +intense I-Process +laser I-Process +pulses I-Process +[ O +2 O +] O +. O +In O +such O +cases O +the O +system O +is O +blown O +up O +and O +details O +of O +its O +quantum B-Task +mechanical I-Task +features I-Task +do O +not O +matter O +anymore O +. O +But O +for O +less O +violent O +scenarios O +, O +quantum B-Process +shell I-Process +effects I-Process +cannot O +be O +ignored O +. O + +The O +next O +important O +step O +might O +be O +the O +derivation O +of O +the O +Dirac B-Process +equation I-Process +. O +The B-Process +Creutz I-Process +model I-Process +[ O +32 O +] O +suggests O +that O +we O +should O +consider O +incorporating O +into O +the O +logical O +inference O +treatment O +, O +the O +additional O +knowledge O +that O +one O +has O +objects B-Process +hopping I-Process +on I-Process +a I-Process +lattice I-Process +instead I-Process +of I-Process +particles I-Process +moving O +in O +a O +space-time O +continuum O +. O +Recall O +that O +up O +to O +Section O +2.4 O +, O +the O +description O +of O +the O +measurement B-Task +scenario I-Task +, O +robustness O +etc. O +is O +explicitly O +discrete O +. O +In O +Section O +2.4 O +, O +the O +continuum O +limit O +was O +taken O +only O +because O +our O +aim O +was O +to O +derive O +the O +Pauli B-Process +equation I-Process +, O +which O +is O +formulated O +in O +continuum B-Material +space-time I-Material +. O +Of O +course O +, O +the O +description O +of O +the O +motion B-Task +of I-Task +the I-Task +particle I-Task +in O +Section O +2.6 O +is O +entirely O +within O +a O +continuum O +description O +but O +there O +is O +no O +fundamental O +obstacle O +to O +replace O +this O +treatment O +by O +a O +proper O +treatment O +of O +objects B-Material +hopping O +on O +a O +lattice B-Material +. O +Therefore O +it O +seems O +plausible O +that O +the O +logical O +inference O +approach O +can O +be O +extended O +to O +describe O +massless B-Material +spin-1 I-Material +/ I-Material +2 I-Material +particles I-Material +moving O +in O +continuum O +space-time O +by O +considering O +the O +continuum O +limit O +of O +the O +corresponding O +lattice B-Process +model I-Process +. O +An O +in-depth O +, O +general O +treatment O +of O +this O +problem O +is O +beyond O +the O +scope O +of O +the O +present O +paper O +and O +we O +therefore O +leave O +this O +interesting O +problem O +for O +future B-Task +research I-Task +. O + +A O +fluctuating B-Material +vacuum I-Material +is O +a O +general O +feature O +of O +quantum B-Process +fields I-Process +, O +of O +which O +the O +free B-Process +Maxwell I-Process +field I-Process +considered O +in O +[ O +1 O +– O +12 O +] O +is O +but O +one O +example O +. O +Fermionic B-Process +fields I-Process +such O +as O +that O +describing O +the O +electron O +, O +also O +undergo B-Process +vacuum I-Process +fluctuations I-Process +, O +consequently O +one O +expects O +to O +find O +Casimir B-Process +effects I-Process +associated O +with O +such B-Process +fields I-Process +whenever O +they O +are O +confined O +in O +some O +way O +. O +Such O +effects O +were O +first O +investigated O +in O +the O +context O +of O +nuclear B-Task +physics I-Task +, O +within O +the O +so-called O +“ B-Task +MIT I-Task +bag I-Task +model I-Task +” I-Task +of I-Task +the I-Task +nucleon I-Task +[ O +13 O +] O +. O +In O +the O +bag-model O +one O +envisages O +the O +nucleon O +as O +a B-Task +collection I-Task +of I-Task +fermionic I-Task +fields I-Task +describing I-Task +confined I-Task +quarks I-Task +. O +These O +quarks O +are O +subject O +to O +a O +boundary O +condition O +at O +the O +surface O +of O +the O +‘ O +bag’ O +that O +represents O +the O +nucleon O +’s O +surface O +. O +Just O +as O +in O +the O +electromagnetic O +case O +, O +the B-Process +bag I-Process +boundary I-Process +condition I-Process +modifies I-Process +the I-Process +vacuum I-Process +fluctuations I-Process +of I-Process +the I-Process +field I-Process +, O +which O +results O +in O +the O +appearance O +of O +a O +Casimir B-Task +force I-Task +[ O +14 O +– O +18 O +] O +. O +This O +force O +, O +although O +very O +weak O +at O +a O +macroscopic O +scale O +, O +can O +be O +significant O +on O +the O +small O +length O +scales O +encountered O +in O +nuclear B-Task +physics I-Task +. O +It O +therefore O +has O +important O +consequences O +for O +the O +physics O +of O +the O +bag-model B-Material +nucleon I-Material +[ O +19 O +] O +. O + +We O +have O +presented O +spectrally B-Process +resolved I-Process +femtosecond I-Process +three-pulse I-Process +photon I-Process +echo I-Process +measurements I-Process +on O +Zn B-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +, O +Ni B-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +and O +Co B-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +. O +Increased B-Task +degree I-Task +of I-Task +freedom I-Task +in O +scans O +of O +time O +delays O +allows O +one O +to O +separate B-Process +and I-Process +extract I-Process +specific I-Process +type I-Process +of I-Process +spectroscopic I-Process +information I-Process +in O +complex B-Material +molecules I-Material +by O +studying O +spectral B-Process +and I-Process +temporal I-Process +evolution I-Process +of I-Process +the I-Process +photon I-Process +echo I-Process +signals I-Process +. O +By O +varying B-Process +the I-Process +population I-Process +times I-Process +, O +population B-Task +relaxation I-Task +dynamics I-Task +and O +inhomogeneous B-Process +broadening I-Process +is O +revealed O +in O +the O +photon B-Material +echo I-Material +spectra I-Material +. O +Time-integrated B-Process +photon I-Process +echo I-Process +signals I-Process +show O +two O +different O +timescales B-Material +. O +The O +electronic B-Material +relaxation I-Material +timescale I-Material +is O +found O +to O +be O +sub B-Material +50fs I-Material +whereas O +the O +timescale B-Material +for O +intramolecular B-Process +vibrational I-Process +relaxation I-Process +, O +occurring O +in O +Q00 B-Material +band I-Material +, O +was O +found O +to O +be O +over O +a O +picosecond O +for O +Co B-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +and O +Ni B-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +and O +within B-Material +a I-Material +picosecond I-Material +for I-Material +Zn I-Material +( I-Material +II I-Material +)– I-Material +OEP I-Material +. O + +Water B-Material +is O +the O +most O +important O +liquid B-Material +, O +and O +the O +nature O +of O +its O +structure O +remains O +a O +topic O +of O +keen O +debate O +and O +an O +active O +area O +of O +research O +[ O +1 O +– O +9 O +] O +. O +Much O +of O +this O +debate O +centers O +around O +whether O +water B-Material +has O +a O +mainly O +tetrahedral O +structure O +with O +a O +continuum O +of O +distorted B-Material +hydrogen I-Material +bonds I-Material +, O +or O +if O +it O +contains O +a O +mixture O +of O +two O +distinct O +components O +. O +One O +major O +development O +in O +recent O +years O +is O +the O +application O +of O +inner-shell B-Process +spectroscopic I-Process +techniques I-Process +, O +such O +as O +X-ray B-Process +absorption I-Process +spectroscopy I-Process +( O +XAS B-Process +) O +and O +X-ray B-Process +emission I-Process +spectroscopy I-Process +( O +XES B-Process +) O +at O +the O +oxygen B-Material +K-edge I-Material +to O +investigate O +the O +structure O +of O +water B-Material +[ O +2,10 O +– O +12 O +] O +. O +These O +methods O +can O +provide O +a O +direct B-Process +structural I-Process +probe I-Process +of I-Process +water I-Process +, O +providing O +insight O +into O +the O +nature O +of O +its O +hydrogen B-Task +bonding I-Task +network I-Task +. O +Theoretical O +studies O +play O +a O +critical O +role O +in O +these O +studies O +, O +since O +the O +analysis O +of O +the O +experimental B-Material +data I-Material +requires O +calculations B-Material +to O +provide O +a O +link O +between O +the O +observed B-Process +spectral I-Process +features I-Process +and O +the O +underlying B-Task +structure I-Task +. O +However O +, O +the O +simulation O +of O +the O +XAS B-Process +or O +XES B-Process +for O +liquid B-Material +water I-Material +presents O +a O +difficult O +challenge O +because O +it O +requires O +accurate B-Process +molecular I-Process +dynamics I-Process +simulations I-Process +to O +provide O +a O +correct O +description O +of O +the O +molecular B-Task +structure I-Task +coupled O +with O +accurate O +calculations O +of O +the O +spectral B-Task +properties I-Task +, O +i.e. O +excitation B-Task +energies I-Task +and O +line B-Task +intensities I-Task +. O +Furthermore O +, O +adequate B-Material +sampling I-Material +over O +molecular B-Process +configurations I-Process +also O +needs O +to O +be O +accounted O +for O +. O + +Under O +these O +experimental O +conditions O +, O +the O +observed B-Process +dynamics I-Process +has O +to O +occur O +where O +the O +probe B-Process +laser I-Process +induces O +the O +reactions B-Task +resulting O +in O +further B-Process +ionization I-Process +[ O +30 O +] O +. O +The O +two-step B-Process +decay I-Process +model I-Process +[ O +26 O +] O +was O +applied O +to O +explain O +the O +above-mentioned O +fragmentation B-Process +of I-Process +DCPD I-Process +to I-Process +CPD I-Process +, O +shown O +in O +Figure O +8a O +. O +The O +fitting O +of O +the O +rise B-Material +and I-Material +decay I-Material +components I-Material +of O +the O +transients B-Material +were O +done O +by O +Matlab B-Process +® I-Process +programming I-Process +using O +the O +curve B-Process +fitting I-Process +Levenberg I-Process +– I-Process +Marquardt I-Process +algorithm I-Process +. O +The O +best B-Process +fit I-Process +decay I-Process +constants I-Process +for O +the O +biexponential B-Material +decay I-Material +components I-Material +of O +C10H12 B-Material ++ I-Material +ion I-Material +signal I-Material +is O +τ1 B-Process += I-Process +35fs I-Process +and O +τ2 B-Process += I-Process +240fs I-Process +, O +while O +that O +for O +C5H6 B-Material ++ I-Material +ion I-Material +signal I-Material +is O +τ1 B-Process += I-Process +36fs I-Process +and O +τ2 B-Process += I-Process +280fs I-Process +, O +respectively O +. O +These O +decay B-Task +constants I-Task +conform O +to O +the O +previously O +reported O +time O +constants O +of O +norbornene B-Material +and O +norbornadiene B-Material +[ O +22,23 O +] O +. O +The O +transients O +of O +the O +reaction O +fragment O +C5H6 O ++ O +are O +sufficiently O +different O +from O +that O +of O +the O +parent B-Material +ion I-Material +C10H12 B-Material ++ I-Material +indicating O +that O +we O +are O +studying O +the O +distinct B-Task +dynamics I-Task +of I-Task +the I-Task +neutrals I-Task +and O +not O +that O +of O +the O +parent B-Task +ion I-Task +fragmentation I-Task +[ O +24 O +] O +. O +Applying B-Process +laser I-Process +control I-Process +principles I-Process +under O +such O +experimental O +circumstances O +also O +confirms O +that O +we O +are O +controlling B-Process +the I-Process +product I-Process +yield I-Process +of I-Process +C5H6 I-Process ++ I-Process +, O +resulting O +from O +the O +photochemical B-Process +reaction I-Process +of I-Process +DCPD I-Process +. O + +Experimental O +studies O +of O +the O +dynamics O +of O +individual O +carbon B-Material +atoms I-Material +in O +graphene B-Material +have O +been O +empowered O +by O +the O +recent O +progress O +in O +aberration-corrected B-Process +transmission I-Process +electron I-Process +microscopy I-Process +( O +AC-TEM B-Process +) O +capable O +of O +sub-Ångstrom B-Process +resolution I-Process +. O +The O +examples O +include O +AC-TEM B-Process +observations I-Process +of I-Process +the I-Process +formation I-Process +and I-Process +annealing I-Process +of I-Process +Stone I-Process +– I-Process +Wales I-Process +defects I-Process +[ O +1 O +] O +, O +edge B-Process +reconstruction I-Process +[ O +2,3 O +] O +and O +formation B-Process +of I-Process +a I-Process +large I-Process +hole I-Process +in I-Process +graphene I-Process +sheet I-Process +from I-Process +a I-Process +single I-Process +vacancy I-Process +defect I-Process +[ O +3 O +] O +. O +The O +AC-TEM O +has O +been O +also O +exploited O +in O +visualization O +in O +real O +time O +of O +the O +process B-Process +of I-Process +self-assembly I-Process +of I-Process +graphene I-Process +nanoribbons I-Process +from O +molecular B-Material +precursors I-Material +[ O +4,5 O +] O +and O +formation B-Process +of I-Process +nanometre I-Process +size I-Process +hollow I-Process +protrusion I-Process +on I-Process +the I-Process +nanotube I-Process +sidewall I-Process +[ O +6 O +] O +. O +Based O +on O +AC-TEM B-Process +observations I-Process +of O +transformation O +of O +small B-Material +finite I-Material +graphene I-Material +flake I-Material +into O +fullerene B-Material +, O +a O +new O +‘ B-Task +top-down’ I-Task +mechanism I-Task +for I-Task +the I-Task +formation I-Task +of I-Task +fullerene I-Task +under O +the O +electron O +beam O +radiation O +has O +been O +proposed O +[ O +7 O +] O +. O +The O +critical O +step O +in O +the O +proposed B-Task +‘ I-Task +top-down’ I-Task +mechanism I-Task +of I-Task +the I-Task +fullerene I-Task +formation I-Task +is O +creation B-Process +of I-Process +vacancies I-Process +in I-Process +small I-Process +graphene I-Process +flake I-Process +as O +a O +result O +of O +knock-on B-Process +damage I-Process +by I-Process +electrons I-Process +of I-Process +the I-Process +imaging I-Process +electron I-Process +beam I-Process +( I-Process +e-beam I-Process +) I-Process +. O +The O +subsequent B-Task +formation I-Task +of I-Task +pentagons I-Task +at O +the O +vacancy O +sites O +near O +the O +edge O +reduces O +the O +number O +of O +dangling O +bonds O +and O +triggers O +the O +curving O +process O +of O +graphene O +flake O +into O +a O +closed O +fullerene O +structure O +[ O +7 O +] O +. O +Thus O +, O +dynamic O +behaviour O +of O +vacancies O +near O +graphene O +edge O +plays O +a O +crucial O +role O +in O +explaining O +mechanisms O +of O +the O +e-beam B-Task +assisted I-Task +self-assembly I-Task +and O +structural B-Task +transformations I-Task +in I-Task +graphene-like I-Task +structures I-Task +. O + +The O +PESs O +here O +employed O +have O +already O +been O +tested O +in O +order O +to O +verify B-Process +their I-Process +validity I-Process +for I-Process +dynamical I-Process +purposes I-Process +. O +Such O +tests O +include O +studies B-Task +of I-Task +the I-Task +nitrogen I-Task +exchange I-Task +reaction I-Task +[ O +14 O +] O +both O +adiabatic O +by O +running O +trajectories O +on O +the O +lowest O +surfaces O +and O +non-adiabatic O +by O +using O +the O +trajectory B-Process +surface I-Process +hoping I-Process +( O +TSH B-Process +) O +method O +[ O +22,23 O +] O +for O +transitions O +to O +the O +excited O +state O +of O +same O +symmetry O +. O +It O +was O +concluded O +that O +nonadiabatic O +transitions O +could O +not O +make O +a O +significant O +impact O +on O +the O +rate B-Material +coefficients I-Material +, O +and O +therefore O +all O +trajectories O +here O +reported O +are O +independently B-Process +integrated I-Process +for I-Process +each I-Process +symmetry I-Process +on O +the O +corresponding O +lowest O +adiabatic O +PES O +. O +In O +fact O +, O +we O +have O +tested O +the O +impact O +of O +running O +the O +trajectories O +starting O +on O +the O +upper O +sheets O +, O +and O +found O +no O +vibrational B-Process +transition I-Process +to O +take O +place O +, O +only O +small O +amounts O +of O +rotational B-Task +energy I-Task +is O +exchanged O +in O +this O +case O +. O +Also O +neglected O +are O +electronic B-Process +transitions I-Process +to I-Process +the I-Process +quartet I-Process +state I-Process +which O +are O +believed O +to O +be O +far O +less O +probable O +than O +the O +simple O +vibrational O +energy O +transfer O +here O +studied O +due O +to O +their O +spin-forbidden O +character O +. O +It O +should O +also O +be O +noted O +that O +the O +use B-Process +of I-Process +quasiclassical I-Process +trajectories I-Process +is O +justified O +by O +the O +large O +masses O +of O +the O +atoms B-Material +involved O +[ O +24 O +] O +. O + +The O +optical O +properties O +of O +charged O +excitations O +are O +important O +for O +understanding O +organic B-Task +semiconductor I-Task +photophysics I-Task +. O +The O +injection O +of O +electric B-Material +charge I-Material +into O +organic B-Material +materials I-Material +polarizes O +the O +surroundings O +and O +changes O +the O +bond O +lengths O +around O +it O +, O +such O +an O +excitation O +is O +defined O +as O +a O +charged B-Material +polaron I-Material +. O +Absorption O +of O +light O +and O +fluorescence O +quenching O +by O +polarons O +are O +important O +issues O +in O +the O +operation B-Task +of I-Task +organic I-Task +optoelectronic I-Task +devices I-Task +. O +It O +is O +particularly O +relevant O +to O +the O +development B-Task +of I-Task +electrically I-Task +pumped I-Task +lasers I-Task +. O +With O +recent O +advances O +in O +materials O +properties O +and O +optical O +design O +the O +lasing B-Task +threshold I-Task +of I-Task +organic I-Task +structures I-Task +under I-Task +optical I-Task +pumping I-Task +is O +now O +low O +enough O +to O +enable O +pumping O +by O +inorganic B-Material +laser I-Material +diodes I-Material +[ O +1 O +– O +3 O +] O +and O +LEDs O +[ O +4 O +] O +which O +is O +promising O +for O +fabrication O +of O +very B-Material +sensitive I-Material +low-cost I-Material +devices I-Material +for O +biosensing B-Process +and O +chemosensing B-Process +[ O +5,6 O +] O +. O +However O +, O +light B-Process +absorption I-Process +by O +injected O +charges O +has O +been O +reported O +to O +be O +the O +major O +obstacle O +to O +electrically B-Process +pumped I-Process +lasing I-Process +[ O +7 O +] O +. O +Injected O +charges O +can O +also O +quench O +luminescence O +as O +they O +accept B-Process +energy I-Process +from I-Process +excitons I-Process +by O +resonant B-Task +dipole I-Task +– I-Task +dipole I-Task +interactions I-Task +and O +this O +is O +an O +important O +loss O +mechanism O +in O +organic B-Material +LEDs I-Material +as O +well O +as O +in O +lasers B-Material +. O +Absorption O +cross-sections O +of O +polarons O +are O +not O +known O +to O +the O +desired O +accuracy O +because O +of O +the O +difficulty O +of O +quantifying O +the O +charge B-Process +density I-Process +injected O +into O +the O +film O +. O +Previous O +studies O +used O +controlled B-Process +electrical I-Process +injection I-Process +of I-Process +charges I-Process +in O +unipolar B-Material +devices I-Material +through O +contacting B-Material +electrodes I-Material +and O +field-dependent B-Material +charge I-Material +mobility I-Material +measurements I-Material +to O +estimate O +the O +charge O +densities O +which O +were O +compared O +with O +the O +values O +obtained O +by O +capacitance B-Process +– I-Process +voltage I-Process +analysis I-Process +and O +the O +two O +results O +differed O +by O +a O +factor O +of O +three O +[ O +8,9 O +] O +. O + +In O +this O +Letter O +we O +revisit O +the O +Chesnavich B-Process +model I-Process +Hamiltonian I-Process +[ O +37 O +] O +in O +the O +light O +of O +recent O +developments O +in O +TST B-Material +. O +For O +barrierless O +systems O +such O +as O +ion B-Process +– I-Process +molecule I-Process +reactions I-Process +, O +the O +concepts O +of O +OTS B-Material +and O +TTS B-Material +can O +be O +clearly O +formulated O +in O +terms O +of O +well O +defined O +phase O +space B-Material +geometrical I-Material +objects I-Material +. O +( O +For O +work O +on O +the O +phase O +space O +description O +of O +OTS B-Material +, O +see O +Refs. O +[ O +38 O +– O +40 O +].) O +The O +first O +goal O +of O +the O +present O +article O +is O +the O +identification B-Process +of O +these O +notions O +with O +well B-Material +defined I-Material +phase I-Material +space I-Material +dividing I-Material +surfaces I-Material +attached I-Material +to I-Material +NHIMs I-Material +. O +The O +second O +and O +main O +goal O +is O +an O +elucidation O +of O +the O +roaming O +phenomenon O +in O +the O +context O +of O +the O +Chesnavich B-Process +model I-Process +Hamiltonian I-Process +. O +The O +associated B-Process +potential I-Process +function I-Process +, O +possessing O +many O +features O +associated O +with O +a O +realistic O +molecular O +PES O +, O +leads O +to O +dynamics B-Task +which I-Task +clearly I-Task +reveal I-Task +the I-Task +origins I-Task +of I-Task +the I-Task +roaming I-Task +effect I-Task +. O +Based O +on O +our O +trajectory B-Material +simulations I-Material +, O +we O +show O +how O +the O +identification O +of O +the O +TTS O +and O +OTS O +DSs O +with O +periodic B-Material +orbit I-Material +dividing I-Material +surfaces I-Material +( O +PODS B-Material +) O +provides O +the O +natural O +framework O +for O +analysis O +of O +the O +roaming O +mechanism O +. O + +Within O +the O +range B-Material +of I-Material +temperatures I-Material +chosen I-Material +, O +alanine B-Material +dipeptide I-Material +exhibits O +very O +simple O +behaviour O +. O +This O +result O +is O +due O +to O +the O +relatively O +small O +number O +of O +physically B-Process +relevant I-Process +minima I-Process +( O +seven O +were O +characterised O +using O +this O +force B-Process +field I-Process +and I-Process +solvent I-Process +model I-Process +) O +and O +the O +larger B-Material +potential I-Material +energy I-Material +spacing I-Material +between O +the O +global O +minimum O +and O +higher O +energy O +minima O +. O +Indeed O +, O +cross-overs B-Process +in I-Process +the I-Process +approximate I-Process +global I-Process +free I-Process +energy I-Process +minimum O +for O +this O +system O +( O +where O +the O +free O +energy O +of O +the O +second-lowest O +potential O +energy O +minimum O +becomes O +lower O +than O +that O +of O +the O +global O +potential O +energy O +minimum O +) O +in O +the O +harmonic O +approximation O +would O +occur O +at O +1170K O +. O +In O +general O +, O +the O +harmonic O +prediction O +for O +the O +crossover O +temperature O +between O +two O +minima O +is O +( O +4 O +) O +kBTxo O += O +V1 O +− O +V2ln O +(( O +o2ν O +¯ O +2κ O +)/( O +o1ν O +¯ O +1κ O +)) O +, O +from O +Eq O +. O +( O +3 O +) O +, O +which O +clearly O +illustrates O +the O +balance B-Task +between I-Task +potential I-Task +energy I-Task +and I-Task +well I-Task +entropy I-Task +. O + +Both O +methods O +of O +structure B-Process +solution I-Process +reveal O +a O +bent B-Process +conformation I-Process +of O +the O +central B-Material +terthiophene I-Material +units I-Material +of O +the O +DOTT B-Material +molecule I-Material +as O +is O +clearly O +visible O +in O +all O +three O +cases O +in O +Figure O +5 O +. O +However O +, O +there O +is O +a O +fundamental O +difference O +in O +the O +conformation O +of O +the O +octyl B-Material +side I-Material +chains I-Material +. O +Whilst O +for O +the O +single O +crystal O +phase O +at O +T O += O +100K O +linearly B-Material +extended I-Material +chains I-Material +are O +observed O +( O +Figure O +5B O +) O +, O +a O +defined B-Process +rotation I-Process +of I-Process +the I-Process +octyl I-Process +chains I-Process +relative O +to O +the O +terthiophene B-Material +unit I-Material +is O +found O +for O +the O +three O +thin B-Material +film I-Material +phases O +( O +Figure O +5A O +) O +. O +The O +rotation O +angle O +of O +about O +± O +70 O +° O +results O +from O +a O +twist B-Process +of I-Process +the I-Process +first I-Process +CC I-Process +single I-Process +bond I-Process +at O +the O +link O +between O +the O +terthiophene B-Material +unit I-Material +and O +the O +octyl B-Material +chain I-Material +( O +see O +arrows O +Figure O +5A O +) O +. O +Two O +features O +of O +this O +rotated O +conformation O +are O +interesting O +. O +First O +, O +a O +molecule O +with O +rotated B-Material +side I-Material +chains I-Material +represents O +the O +equilibrium O +state O +of O +an O +isolated O +single O +DOTT B-Material +molecule I-Material +as O +obtained O +by O +combined B-Process +MD I-Process +and I-Process +VASP I-Process +calculations I-Process +[ O +33 O +] O +. O +Second O +, O +the O +rotated O +conformation O +of O +the O +octyl B-Material +chains I-Material +allows O +a O +dense B-Process +packing I-Process +of O +the O +octyl B-Material +side I-Material +chains I-Material +for O +both O +molecules O +. O +Interestingly O +, O +the O +single O +crystal B-Material +structure I-Material +at O +room O +temperature O +shows O +the O +twisted O +as O +well O +as O +the O +linear O +conformation O +of O +the O +octyl B-Material +side I-Material +chains I-Material +within O +one O +molecule O +( O +Figure O +5C O +) O +. O + +Previous O +studies O +have O +shown O +that O +there O +are O +two O +main O +mechanisms O +for O +the O +development B-Process +of I-Process +radiation-induced I-Process +DSBs I-Process +[ O +16,17 O +] O +. O +For O +γ-ray B-Process +radiation I-Process +, O +single B-Process +step I-Process +is O +the O +main O +process O +to O +cause O +DSBs B-Process +( O +see O +Figure O +3b O +) O +, O +which O +is O +attributed O +to O +the O +generation B-Process +of I-Process +number I-Process +of I-Process +ROS I-Process +upon O +the O +incident O +of O +individual O +photon B-Material +of I-Material +γ-ray I-Material +. O +Whereas O +photo-radiation B-Process +causes O +DSBs B-Process +through O +two B-Process +step I-Process +mechanism I-Process +( O +Figure O +3a O +) O +by O +reflecting O +that O +each O +single O +photon B-Material +causes O +mostly O +single O +ROS B-Material +and O +thus O +induces O +only O +single B-Process +strand I-Process +break I-Process +. O +Then O +, O +when O +a O +second O +single B-Process +strand I-Process +break I-Process +occurs O +where O +near O +the O +existing O +single B-Process +strand I-Process +break I-Process +, O +DBS B-Process +is O +caused O +, O +i.e. O +, O +the O +two B-Process +step I-Process +mechanism I-Process +. O +Summarizing O +the O +results O +and O +discussion O +we O +may O +conclude O +as O +that O +: O +( O +1 O +) O +The O +significant O +protective O +effect O +of O +AA B-Material +against O +photo-induced B-Process +damage I-Process +may O +reflect O +the O +effective O +diminish O +of O +ROS O +by O +AA O +. O +( O +2 O +) O +For O +the O +γ-ray O +induced O +DSB O +, O +the O +protective O +effect O +by O +AA O +is O +a O +little O +bit O +weaker O +than O +the O +case O +of O +photo B-Material +irradiation O +. O +This O +may O +be O +due O +to O +the O +generation O +of O +numbers O +of O +ROS B-Material +by O +single O +photon O +of O +γ-ray O +. O +Surviving O +oxygen O +species O +against O +the O +diminishment O +effect O +by O +AA B-Material +may O +cause O +DSBs O +. O +( O +3 O +) O +As O +for O +the O +DSBs O +by O +ultrasound O +, O +damage O +is O +caused O +by O +the O +shockwave O +through O +the O +generation O +of O +cavitations O +[ O +18 O +] O +. O +Thus O +, O +the O +chemical O +effect O +of O +AA O +to O +diminish O +ROS O +is O +considered O +to O +be O +negligibly O +small O +for O +the O +protection O +of O +DSBs O +. O + +In B-Process +situ I-Process +oxidation I-Process +, O +experiments O +were O +carried O +out O +using O +3mm B-Material +diameter I-Material +discs I-Material +with O +one O +surface O +ground B-Process +and I-Process +polished I-Process +to O +a O +1μm O +diamond O +finish O +. O +The O +3mm O +discs O +were O +then O +oxidised B-Process +in O +a O +Philips B-Material +XL-30 I-Material +FEG I-Material +ESEM I-Material +with O +a O +hot B-Material +stage I-Material +attachment I-Material +. O +The O +oxidising O +atmosphere O +used O +was O +laboratory O +air O +at O +a O +pressure O +of O +266Pa O +. O +During O +the O +experiment O +, O +the O +sample O +was O +observed O +and O +imaged O +using O +a O +primary O +beam O +energy O +of O +20kV O +and O +an O +Everhart O +– O +Thornley O +secondary O +electron O +detector O +. O +The O +sample O +was O +heated B-Process +at O +a O +rate O +of O +100 O +° O +C O +/ O +min O +to O +a O +temperature O +of O +700 O +° O +C O +and O +held O +at O +this O +temperature O +for O +8min O +to O +stabilise B-Process +the I-Process +stage I-Process +and I-Process +the I-Process +microscope I-Process +. O +The O +sample O +was O +then O +heated B-Process +to I-Process +a I-Process +final I-Process +temperature I-Process +of I-Process +900 I-Process +° I-Process +C I-Process +at O +the O +same O +heating O +rate O +. O +The O +total O +time O +of O +exposure O +of O +the O +sample O +was O +120min O +before O +cooling O +to O +room O +temperature O +by O +turning O +off O +the O +heating B-Material +coils I-Material +. O +The O +samples O +were O +then O +examined O +in O +the O +LEO B-Material +1530VP I-Material +FEGSEM I-Material +with O +chemical O +information O +gathered O +using O +EDS B-Material +. O +Cross-sections O +and O +Transmission B-Material +Electron I-Material +Microscope I-Material +( O +TEM B-Material +) O +samples O +were O +produced O +using O +a O +dual B-Material +beam I-Material +FEI I-Material +Nova I-Material +Nanolab I-Material +600 I-Material +for O +Focused B-Material +Ion I-Material +Beam I-Material +( O +FIB B-Material +) O +milling O +perpendicular O +to O +the O +phase O +boundaries O +to O +determine O +their O +influence O +on O +the O +oxide B-Material +development O +and O +imaged O +using O +a O +Jeol B-Material +2000FX I-Material +W-filament I-Material +TEM I-Material +. O +EDS B-Material +maps O +of O +the O +TEM B-Material +samples I-Material +were O +collected O +using O +the O +Nanolab B-Material +600 I-Material +with O +a O +Scanning B-Material +TEM I-Material +( O +STEM B-Material +) O +detector O +and O +an O +EDAX B-Material +Genesis I-Material +EDS I-Material +system I-Material +at O +an O +accelerating B-Process +voltage I-Process +of I-Process +30kV I-Process +. O + +The O +study O +outlines O +a O +trial O +of O +transient B-Task +response I-Task +analysis I-Task +on O +full-scale O +motorway B-Material +bridge I-Material +structures I-Material +to O +obtain O +information O +concerning O +the O +steel B-Task +– I-Task +concrete I-Task +interface I-Task +and O +is O +part O +of O +a O +larger O +study O +to O +assess O +the O +long-term B-Process +sustained I-Process +benefits I-Process +offered O +by O +Impressed B-Process +Current I-Process +Cathodic I-Process +Protection I-Process +( O +ICCP B-Process +) O +after O +the O +interruption B-Process +of I-Process +the I-Process +protective I-Process +current I-Process +[ O +1 O +] O +. O +These O +structures O +had O +previously O +been O +protected O +for O +5 O +– O +16years O +by O +an O +ICCP B-Process +system I-Process +prior O +to O +the O +start O +of O +the O +study O +. O +The O +protective B-Process +current I-Process +was I-Process +interrupted I-Process +, O +in O +order O +to O +assess B-Process +the I-Process +long-term I-Process +benefits I-Process +provided O +by O +ICCP B-Process +after O +it O +has O +been O +turned O +off O +. O +This O +paper O +develops B-Task +and I-Task +examines I-Task +a I-Task +simplified I-Task +approach I-Task +for O +the O +on-site O +use O +of O +transient B-Process +response I-Process +analysis I-Process +and O +discusses B-Process +the I-Process +potential I-Process +advantages I-Process +of O +the O +technique O +as O +a O +tool O +for O +the O +assessment B-Task +of I-Task +the I-Task +corrosion I-Task +condition I-Task +of O +steel B-Material +in O +reinforced B-Material +concrete I-Material +structures I-Material +. O + +The O +results O +from O +two O +types O +of O +oxidation B-Process +test I-Process +are O +combined O +in O +this O +study O +. O +Table O +1 O +shows O +the O +test B-Material +matrix I-Material +with O +the O +two O +approaches O +included O +. O +All O +the O +100h O +tests O +and O +the O +test O +conducted O +at O +650 O +° O +C O +were O +performed O +using O +a O +thermogravimetric B-Process +balance I-Process +( O +TGA B-Process +) O +. O +The O +weight B-Material +change I-Material +during I-Material +these I-Material +tests I-Material +was I-Material +monitored I-Material +continually I-Material +and O +adjusted B-Process +to I-Process +accommodate I-Process +buoyancy I-Process +effects I-Process +. O +All O +other O +tests O +were O +conducted O +in O +horizontal B-Material +tube I-Material +furnaces I-Material +. O +For O +these O +latter O +tests O +, O +batches O +of O +specimens O +were O +placed O +in O +alumina B-Material +boats I-Material +and O +inserted O +into O +the O +furnaces B-Material +at O +temperature O +. O +Intermittent O +weighing O +at O +room O +temperature O +was O +used O +to O +determine B-Task +the I-Task +oxidation I-Task +kinetics I-Task +. O +At O +selected O +time O +intervals O +, O +a O +specimen O +was O +removed O +from O +the O +batch O +for O +examination O +before O +the O +high O +temperature O +exposure O +continued O +for O +the O +remainder O +of O +the O +batch O +. O +Table B-Material +1 I-Material +shows I-Material +the I-Material +time I-Material +intervals I-Material +chosen I-Material +for I-Material +examination I-Material +. O +At O +600 O +° O +C O +one O +isothermal O +test O +, O +having O +an O +exposure O +time O +of O +1000h O +, O +has O +been O +performed O +to O +date O +. O + +The O +adhesion B-Process +/ I-Process +cohesion I-Process +of O +the O +coating O +was O +evaluated O +by O +the O +scratch B-Process +test I-Process +method I-Process +, O +using O +a O +Revetest B-Material +system I-Material +( I-Material +CSM I-Material +Instruments I-Material +SA I-Material +, I-Material +Switzerland I-Material +) I-Material +equipped I-Material +with I-Material +a I-Material +H-270 I-Material +diamond I-Material +indentor I-Material +( I-Material +200μm I-Material +diameter I-Material +) I-Material +. O +Six O +scratch B-Process +indentations I-Process +were I-Process +carried I-Process +out I-Process +under O +previously O +optimized O +conditions O +( O +linear O +progressive O +load O +mode O +1 O +– O +4N O +, O +4Nmin O +− O +1 O +) O +. O +In O +order O +to O +aid O +in O +determination B-Task +of I-Task +location I-Task +of I-Task +spallation I-Task +/ I-Task +delamination I-Task +, O +an O +extended O +scratch O +length O +of O +6mm O +was O +employed O +. O +The O +scratch O +tracks O +were O +subsequently O +observed O +by O +SEM O +to O +determine O +the O +locations O +of O +the O +first O +coating O +failure O +and O +to O +understand B-Task +the I-Task +nature I-Task +of I-Task +the I-Task +coating I-Task +failure I-Task +. O +During O +the O +scratch O +tests O +, O +the O +loading B-Material +force I-Material +and I-Material +penetration I-Material +depth I-Material +were I-Material +recorded I-Material +and O +their O +respective O +values O +were O +correlated O +with O +the O +observed O +failure O +locations O +. O +The O +surface B-Task +roughness I-Task +of I-Task +the I-Task +coating I-Task +was I-Task +evaluated I-Task +using O +a O +surface B-Material +roughness I-Material +tester I-Material +( O +TR200 O +, O +Timegroup O +Inc. O +) O +according O +to O +ISO O +standard O +[ O +29 O +] O +. O +Due O +to O +the O +presence O +of O +the O +open O +porosity O +in O +the O +outer B-Material +layer I-Material +of O +the O +coating B-Process +, O +a O +measurement O +length O +for O +determination O +of O +the O +roughness B-Process +( O +Ra B-Process +) O +of O +0.8mm O +was O +used O +. O +In O +total O +, O +eight B-Material +measurements I-Material +were O +carried O +out O +in O +different O +directions O +. O + +One O +surface O +was O +then O +polished O +and O +cleaned O +using O +a O +protocol O +designed O +to O +eliminate O +as O +much O +preparation-related O +contamination O +as O +possible O +. O +This O +is O +as O +follows O +: O +The O +lead O +surface O +was O +polished O +by O +hand O +using O +a O +damp B-Material +abrasive I-Material +disc I-Material +( O +BuehlerMet O +II O +®) O +to O +remove O +visible O +surface B-Material +defects O +and O +to O +expose O +a O +fresh O +metal B-Material +surface I-Material +. O +Coupons O +were O +then O +polished O +using O +a O +sequence O +of O +diamond B-Material +polishes I-Material +with O +decreasing O +particle O +sizes O +( O +6μm O +, O +3μm O +, O +1μm O +Buehler O +MetaDi O +® O +polycrystalline B-Material +diamond I-Material +suspension O +) O +. O +A O +polishing B-Material +cloth I-Material +( O +Buehler O +MicroCloth O +®) O +was O +saturated O +with O +the O +appropriate O +diamond B-Material +suspension O +. O +A O +custom-made B-Material +jig I-Material +fitted O +to O +an O +automatic O +polisher B-Material +( O +Buehler O +Minimet O +® O +1000 O +) O +was O +used O +to O +hold O +the O +coupons B-Material +in O +place O +during O +automated B-Process +polishing I-Process +. O +Coupons B-Material +were O +polished B-Process +for O +15min O +using O +each O +diamond B-Process +suspension I-Process +followed O +by O +rinsing O +with O +2-propanol B-Material +( O +99.5 O +% O +, O +reagent O +grade O +) O +and O +cleaning O +in O +2-propanol O +for O +5min O +in O +an O +ultrasonic B-Material +bath I-Material +. O +After O +polishing B-Process +with O +the O +1μm O +diamond B-Material +suspension I-Material +, O +the O +coupons B-Material +were O +ultrasonically O +cleaned O +in O +2-propanol B-Material +for O +3 O +× O +5min O +, O +with O +fresh O +propanol B-Material +for O +each O +cleaning B-Process +cycle O +. O +Polished O +coupons B-Material +were O +stored O +in O +2-propanol B-Material +until O +required O +. O + +Poor O +oxidation B-Process +behavior O +is O +the O +major O +barrier O +to O +the O +increased O +use O +of O +Ti-based B-Material +alloys I-Material +in O +high-temperature O +structural O +applications O +. O +The O +demand O +to O +increase O +the O +service O +temperature O +of O +these O +alloys O +beyond O +550 O +° O +C O +( O +the O +typical O +temperature O +limit O +) O +requires O +careful O +study O +to O +understand B-Task +the I-Task +role I-Task +that I-Task +composition I-Task +has I-Task +on I-Task +the I-Task +oxidation I-Task +behavior I-Task +of I-Task +Ti-based I-Task +alloys I-Task +[ O +1 O +– O +3 O +] O +. O +The O +attempt O +to O +overcome O +this O +limitation O +in O +Ti-based O +alloys O +has O +led O +to O +the O +production O +of O +alloys B-Material +with I-Material +substantially I-Material +improved I-Material +oxidation I-Material +resistance I-Material +such O +as O +β-21S B-Material +and O +also O +development B-Task +of I-Task +coatings I-Task +and I-Task +pre-oxidation I-Task +techniques I-Task +[ O +1,4 O +– O +6 O +] O +. O +While O +it O +is O +tempting O +to O +extrapolate O +the O +oxidation B-Process +behavior O +( O +e.g. O +oxidation O +rate O +law O +, O +depth O +of O +oxygen B-Material +ingress O +and O +scale O +thickness O +) O +observed O +for O +a O +limited O +number O +of O +compositions O +under O +a O +certain O +oxidation B-Process +condition O +to O +a O +broader O +compositional O +range O +, O +there O +are O +numerous O +examples O +in O +the O +literature O +where O +deviations O +from O +the O +expected O +relations O +are O +observed O +[ O +7,8 O +] O +. O + +The O +oxide B-Process +thickness O +is O +calculated O +using O +the O +weight O +gain O +and O +surface B-Material +area O +. O +Artificially O +changing O +the O +surface O +profile O +will O +modify O +the O +surface O +area O +and O +calculated O +oxide B-Material +thickness O +. O +SEM B-Material +images I-Material +of O +samples O +removed O +after O +111 O +days O +oxidation B-Process +were O +used O +to O +define O +the O +change O +in O +surface B-Material +profile I-Material +length O +with O +variation O +in O +applied O +roughness O +. O +The O +profile O +lengths O +extracted O +from O +the O +images B-Material +were O +then O +used O +to O +modify O +the O +length O +of O +the O +sample B-Material +and O +therefore O +the O +surface B-Material +area I-Material +. O +Table O +1 O +shows O +the O +original O +oxide B-Material +thicknesses O +after O +111 O +days O +oxidation O +, O +the O +modified O +oxide O +thicknesses O +based O +on O +the O +surface B-Material +profile O +length O +and O +the O +percentage O +difference O +. O +Results O +show O +a O +maximum O +decrease O +in O +the O +oxide B-Material +thickness O +of O +4 O +% O +when O +using O +a O +surface B-Material +which O +accounts O +for O +roughness O +. O +Comparing O +the O +change O +in O +oxide B-Material +thickness O +between O +different O +surface O +finishes O +indicates O +a O +variation O +of O +less O +than O +1 O +% O +. O +As O +such O +, O +the O +impact O +of O +the O +variation O +in O +the O +profile O +length O +on O +the O +calculated O +oxide O +thickness O +is O +considered O +to O +be O +insignificant O +. O +In O +addition O +, O +if O +the O +differences O +in O +weight O +gain O +were O +only O +due O +to O +differences O +in O +surface B-Material +area I-Material +, O +rougher O +samples B-Material +would O +be O +expected O +to O +demonstrate O +thicker O +oxides B-Material +at O +the O +earliest O +stages O +of O +oxidation B-Process +. O + +There O +have O +been O +relatively O +few O +attempts O +to O +observe O +and O +in O +some O +cases O +extract O +the O +average O +current O +density O +from O +video B-Material +images I-Material +taken O +of O +growing O +2D B-Material +pits I-Material +. O +Frankel O +presented O +a O +method O +to O +directly O +measure O +the O +average O +anodic B-Material +current I-Material +density O +from O +the O +growing O +pit B-Material +boundary O +velocity O +in O +Al B-Material +[ O +33 O +] O +, O +an O +Al B-Material +alloy I-Material +[ O +34 O +] O +and O +Ni B-Material +– I-Material +Fe I-Material +[ I-Material +35 I-Material +] I-Material +thin I-Material +films I-Material +. O +Subsequently O +, O +Ryan O +et O +al O +. O +[ O +27,36 O +] O +determined O +the O +anodic O +current O +density O +in O +pits B-Material +propagating O +as O +2D B-Material +disks I-Material +in O +stainless B-Material +steel I-Material +thin I-Material +films I-Material +by O +measuring O +the O +pit B-Material +edge I-Material +movement O +velocity O +. O +Ernst O +and O +Newman O +[ O +11,12,37 O +] O +studied O +stability O +of O +pit B-Process +growth I-Process +in O +detail O +and O +measured B-Process +the I-Process +kinetics I-Process +of I-Process +2D I-Process +pit I-Process +propagation I-Process +in O +depth O +and O +width O +and O +compared O +the O +results O +with O +kinetics O +in O +1D B-Material +pencil I-Material +electrodes I-Material +. O +They O +developed O +a O +semi-quantitative B-Process +model I-Process +for O +pit B-Task +propagation I-Task +which O +explained O +the O +lacy B-Process +pit I-Process +cover I-Process +formation I-Process +during O +the O +pit B-Process +growth I-Process +, O +although O +they O +did O +not O +measure O +current O +density O +within O +the O +pit O +. O +More O +recently O +, O +Tang O +and O +Davenport O +[ O +38 O +] O +tracked O +the O +pit O +boundary O +movement O +and O +computed O +the O +instantaneous O +but O +average O +current O +density O +in O +Fe-Co B-Material +thin I-Material +films I-Material +. O +However O +, O +there O +have O +been O +no O +previous O +attempts O +to O +quantify O +the O +local O +current O +density O +during O +inhomogeneous O +growth O +of O +pits B-Material +, O +although O +such O +local O +variation O +in O +current B-Process +density O +has O +long O +been O +recognised O +[ O +7 O +] O +. O + +Anodizing B-Process +processes I-Process +are O +widely O +used O +for O +protecting B-Task +aluminium I-Task +alloys I-Task +against O +corrosion B-Process +[ O +1 O +] O +. O +The O +resultant B-Material +films I-Material +are O +composed O +of O +amorphous B-Material +alumina I-Material +and O +consist O +of O +a O +relatively O +thick O +, O +porous O +, O +outer O +region O +and O +a O +thinner O +, O +non-porous O +, O +inner O +region O +[ O +2,3 O +] O +. O +The O +porous O +region O +contains O +the O +major B-Material +pores I-Material +of O +the O +film B-Material +, O +which O +extend B-Process +from I-Process +the I-Process +film I-Process +surface I-Process +to O +the O +barrier B-Material +layer I-Material +. O +Near O +the O +film B-Material +surface I-Material +, O +shorter O +, O +incipient B-Material +pores I-Material +are O +also O +present O +, O +whose O +growth B-Process +stopped I-Process +in I-Process +the I-Process +early I-Process +stages I-Process +of I-Process +anodizing I-Process +. O +The O +diameter O +of O +the O +major B-Material +pores I-Material +and O +the O +thickness O +of O +the O +inner O +, O +barrier O +region O +are O +dependent O +on O +the O +potential O +applied O +during O +anodizing B-Process +, O +with O +typical O +proportionalities O +of O +∼ O +1nmV O +− O +1 O +[ O +3,4 O +] O +. O +Studies O +of O +ionic B-Task +migration I-Task +in O +barrier-type O +and O +porous O +anodic B-Material +alumina I-Material +films I-Material +have O +usually O +found O +a O +transport O +number O +of O +O2 B-Material +− I-Material +ions I-Material +of O +∼ O +0.6 O +[ O +5,6 O +] O +. O +During O +the O +formation O +of O +porous B-Material +films I-Material +, O +the O +outward B-Material +migrating I-Material +Al3 I-Material ++ I-Material +ions I-Material +, O +constituting O +the O +remainder O +of O +the O +ionic B-Material +current I-Material +, O +are O +ejected B-Process +to O +the O +electrolyte B-Material +at O +the O +pore B-Material +bases I-Material +[ O +7 O +] O +. O +The O +electronic O +current O +in O +the O +barrier B-Material +region I-Material +is O +generally O +considered O +to O +be O +negligible O +. O +The O +thickness O +of O +the O +barrier O +region O +, O +which O +is O +relatively O +constant O +during O +the O +growth O +of O +a O +film B-Material +under O +either O +a O +constant O +potential O +or O +constant O +current O +density O +, O +is O +maintained O +by O +a O +balance O +between O +growth B-Process +of I-Process +the I-Process +barrier I-Process +layer I-Process +by I-Process +continued I-Process +oxidation I-Process +of O +the O +aluminium B-Material +substrate I-Material +and O +thinning B-Process +of I-Process +the I-Process +barrier I-Process +layer I-Process +by I-Process +either I-Process +field-assisted I-Process +dissolution I-Process +of O +the O +alumina B-Material +at O +the O +pore B-Material +bases I-Material +[ O +8 O +] O +or O +field-assisted B-Process +flow I-Process +of I-Process +alumina I-Process +from O +the O +barrier B-Material +layer I-Material +to O +the O +pore B-Material +walls I-Material +[ O +9 O +– O +13 O +] O +. O +The O +pores B-Material +may O +be O +widened O +toward O +the O +film B-Material +surface I-Material +by O +chemical B-Process +dissolution I-Process +to O +an O +extent O +dependent O +on O +the O +anodizing O +conditions O +. O + +Failure B-Process +of I-Process +structural I-Process +components I-Process +is O +a O +major O +concern O +in O +the O +nuclear O +power O +industry O +and O +represents O +not O +only O +a O +safety O +issue O +, O +but O +also O +a O +hazard O +to O +economic O +performance O +. O +Stress B-Process +corrosion I-Process +cracking I-Process +( O +SCC B-Process +) O +, O +and O +especially O +intergranular B-Process +stress I-Process +corrosion I-Process +cracking I-Process +( O +IGSCC B-Process +) O +, O +have O +proved O +to O +be O +a O +significant O +potential O +cause O +of O +failures O +in O +the O +nuclear O +industry O +in O +materials O +such O +as O +Alloy B-Material +600 I-Material +( O +74 B-Material +% I-Material +Ni I-Material +, I-Material +16 I-Material +% I-Material +Cr I-Material +and I-Material +8 I-Material +% I-Material +Fe I-Material +) O +and O +stainless B-Material +steels I-Material +, O +especially O +in O +Pressurised B-Material +Water I-Material +Reactors I-Material +( O +PWR B-Material +) O +[ O +1 O +– O +5 O +] O +. O +Stress B-Process +corrosion I-Process +cracking I-Process +in O +pressurized B-Material +water I-Material +reactors I-Material +( O +PWSCC B-Material +) O +occurs O +in O +Alloy B-Material +600 I-Material +in O +safety B-Material +critical I-Material +components I-Material +, O +such O +as O +steam B-Material +generator I-Material +tubes I-Material +, O +heater B-Material +sleeves I-Material +, O +pressurized B-Material +instrument I-Material +penetrations I-Material +and O +control B-Material +rod I-Material +drive I-Material +mechanisms I-Material +[ O +2,6,7 O +] O +. O +Understanding O +the O +mechanisms O +that O +control O +SCC B-Material +in O +this O +alloy B-Material +will O +allow O +for O +continued O +extensions O +of O +life O +in O +current O +plant B-Material +as O +well O +as O +safer B-Task +designs I-Task +of I-Task +future I-Task +nuclear I-Task +reactors I-Task +. O + +A O +key O +part O +of O +this O +problem O +is O +that O +an O +inspector O +only O +has O +access O +to O +data O +from O +a O +small O +inspected O +area O +. O +In O +this O +area O +, O +there O +is O +only O +one O +minimum O +thickness O +, O +which O +does O +not O +provide O +enough O +information O +to O +build B-Task +a I-Task +model I-Task +of I-Task +the I-Task +smallest I-Task +thicknesses I-Task +. O +An O +inspector O +can O +generate O +a O +sample B-Material +of O +the O +smallest O +thickness O +measurements O +by O +partitioning B-Process +the I-Process +inspection I-Process +data I-Process +into O +a O +number O +of O +equally B-Material +sized I-Material +blocks I-Material +. O +In O +each O +block B-Material +the O +minimum O +thickness O +is O +recorded O +. O +This O +set O +forms O +a O +sample B-Material +of O +the O +smallest O +thickness O +measurements O +. O +From O +this O +sample O +, O +one O +can O +build O +a O +model B-Process +which I-Process +takes I-Process +into I-Process +account I-Process +the I-Process +variations I-Process +of I-Process +the I-Process +smallest I-Process +thickness I-Process +measurements I-Process +. O +Extreme B-Process +value I-Process +analysis I-Process +( O +EVA B-Process +) O +provides O +a O +limiting O +form O +for O +this O +model O +. O +It O +states O +that O +, O +if O +the O +underlying O +thickness O +measurements O +in O +each O +block O +are O +taken O +from O +independent O +and O +identical O +distributions O +, O +then O +the O +sample O +of O +minimum O +thickness O +measurements O +will O +follow O +a O +generalized B-Process +extreme I-Process +value I-Process +distribution I-Process +( O +GEVD B-Process +) O +. O + +The O +thermodynamics B-Task +of I-Task +copper-zinc I-Task +alloys I-Task +( I-Task +brass I-Task +) I-Task +was O +subject O +of O +numerous O +investigations O +. O +Brass B-Material +is O +characterised O +by O +an O +excess B-Process +enthalpy I-Process +and I-Process +excess I-Process +entropy I-Process +of I-Process +mixing I-Process +, O +both O +of O +which O +are O +negative O +. O +The O +enthalpic B-Material +data I-Material +were O +measured O +by O +solution B-Process +calorimetry I-Process +e.g. O +, O +[ O +1 O +– O +3 O +] O +and O +based O +on O +chemical B-Material +potential I-Material +data I-Material +calculated O +from O +phase B-Process +equilibrium I-Process +experiments I-Process +e.g. O +, O +[ O +4 O +– O +6 O +] O +, O +the O +excess B-Task +entropy I-Task +of I-Task +mixing I-Task +could O +be O +evaluated O +e.g. O +, O +[ O +7 O +– O +9 O +] O +. O +This O +excess O +entropy O +contains O +both O +, O +the O +vibrational B-Task +and I-Task +the I-Task +configurational I-Task +parts I-Task +. O +The O +excess O +vibrational O +entropy O +, O +defined O +as O +the O +deviation O +from O +the O +entropy O +of O +a O +mechanical O +mixture O +of O +the O +end O +members O +A O +and O +B O +( O +i.e. O +, O +Smmechmix B-Material += I-Material +XASmA I-Material ++ I-Material +XBSmB I-Material +) O +, O +can O +be O +determined O +by O +measuring B-Process +the I-Process +low I-Process +temperature I-Process +heat I-Process +capacity I-Process +( I-Process +5 I-Process +to I-Process +300K I-Process +) I-Process +versus I-Process +composition I-Process +behaviour I-Process +. O +The O +determination O +of O +the O +excess B-Task +configurational I-Task +entropy I-Task +, O +i.e. O +, O +the O +excess O +entropy O +coming O +from O +non-random O +atomic O +distributions O +and O +defects O +, O +is O +much O +more O +difficult O +. O +Here O +, O +neutron B-Process +scattering I-Process +investigations I-Process +together O +with O +computer B-Process +simulations I-Process +are O +normally O +used O +. O +If O +, O +however O +, O +reliable B-Material +data I-Material +of I-Material +the I-Material +total I-Material +excess I-Material +entropy I-Material +( O +from O +enthalpic B-Material +and I-Material +chemical I-Material +potential I-Material +data I-Material +) O +are O +available O +, O +the O +measurement B-Process +of I-Process +the I-Process +excess I-Process +vibrational I-Process +entropy I-Process +enables O +the O +determination B-Process +of I-Process +the I-Process +excess I-Process +configurational I-Process +entropy I-Process +simply O +by O +subtraction B-Process +. O +Since O +configurational O +and O +vibrational O +entropies O +may O +have O +different O +temperature O +dependencies O +, O +it O +is O +worthwhile O +to O +separate B-Task +the I-Task +entropic I-Task +effects I-Task +. O +This O +is O +one O +aim O +of O +this O +study O +. O +Another O +aim O +is O +to O +deliver B-Task +experimental I-Task +data I-Task +so O +that O +first O +principles O +studies O +can O +test O +their O +models O +on O +a O +disordered B-Material +alloy I-Material +, O +whose O +structural O +details O +( O +short-range O +order O +) O +depend O +on O +temperature O +. O + +The O +algorithm O +allows O +the O +modelling B-Task +of I-Task +plasmas I-Task +of I-Task +arbitrary I-Task +degeneracy I-Task +under O +the O +binary B-Process +collision I-Process +approximation I-Process +. O +It O +uses O +a O +numerical B-Process +interpolation I-Process +of O +the O +inverse O +cumulative O +density O +function O +of O +the O +Fermi B-Process +– I-Process +Dirac I-Process +distribution I-Process +to O +initialise O +simulation B-Material +particles I-Material +, O +and O +collisions B-Process +are O +subject O +to O +Pauli B-Process +blocking I-Process +. O +It O +is O +not O +appropriate O +in O +the O +limit O +of O +very O +strong O +coupling B-Process +because O +the O +plasma B-Task +theory I-Task +which O +the O +Monte B-Process +Carlo I-Process +code I-Process +is O +based O +on O +breaks O +down O +. O +The O +strong B-Task +coupling I-Task +limit I-Task +corresponds O +to O +lnΛ O +≲ O +3 O +, O +with O +lnΛ O +the O +Coulomb B-Process +logarithm I-Process +[ O +10 O +] O +. O +The O +code O +is O +designed O +for O +lnΛ O +> O +3 O +in O +collisional B-Material +plasmas I-Material +with O +a O +non-negligible O +level O +of O +degeneracy O +. O +It O +is O +noted O +that O +Monte B-Process +Carlo I-Process +techniques I-Process +with O +degenerate O +capabilities O +have O +been O +developed O +for O +studying O +transport B-Task +in I-Task +semi-conductors I-Task +[ O +11 O +] O +but O +no O +such O +method O +exists O +for O +fully-ionised B-Material +plasmas I-Material +. O +Some O +of O +the O +techniques O +described O +are O +potentially O +applicable O +to O +other O +types O +of O +codes O +, O +for O +example O +, O +Particle-In-Cell O +( O +PIC O +) O +codes O +. O + +Similar O +numerical B-Process +oscillations I-Process +to O +those O +described O +above O +also O +emerge O +in O +the O +ISPM B-Process +when O +utilising O +classical B-Process +IBM I-Process +kernels I-Process +due O +to O +their O +lack O +of O +regularity O +( O +with O +discontinuous O +second O +derivatives O +) O +. O +Furthermore O +, O +it O +is O +important O +to O +remark O +that O +the O +immersed O +structure O +stresses O +are O +captured O +in O +the O +Lagrangian B-Process +description I-Process +and O +hence O +, O +in O +order O +to O +compute O +them O +accurately O +, O +it O +is O +important O +to O +ensure O +that O +these O +spurious O +oscillations B-Material +are O +not O +introduced O +via O +the O +kernel B-Process +interpolation I-Process +functions I-Process +. O +In O +this O +paper O +, O +the O +authors O +have O +specifically O +designed O +a O +new B-Task +family I-Task +of I-Task +kernel I-Task +functions I-Task +which O +do B-Task +not I-Task +introduce I-Task +these I-Task +spurious I-Task +oscillations I-Task +. O +The O +kernel B-Process +functions I-Process +are O +obtained O +by O +taking O +into O +account O +discrete O +reproducibility O +conditions O +as O +originally O +introduced O +by O +Peskin O +[ O +14 O +] O +( O +in O +our O +case O +, O +tailor-made O +for O +Cartesian B-Process +staggered I-Process +grids I-Process +) O +and O +regularity O +requirements O +to O +prevent O +the O +appearance O +of O +spurious O +oscillations B-Material +when O +computing O +derivatives O +. O +A O +Maple B-Material +computer I-Material +program I-Material +has O +been O +developed O +to O +obtain B-Task +explicit I-Task +expressions I-Task +for I-Task +the I-Task +new I-Task +kernels I-Task +. O + +After O +all O +micro O +elements O +reach O +a O +relaxed O +steady-state O +, O +measurements O +are O +obtained O +using O +a O +cumulative B-Process +averaging I-Process +technique I-Process +to O +reduce B-Task +noise I-Task +. O +Each O +micro B-Material +element I-Material +is O +divided O +into O +spatially-oriented B-Material +bins I-Material +in O +the O +y-direction O +in O +order O +to O +resolve B-Task +the I-Task +velocity I-Task +and I-Task +shear-stress I-Task +profiles I-Task +. O +Velocity O +in O +each O +bin B-Material +is O +measured O +using O +the O +Cumulative B-Process +Averaging I-Process +Method I-Process +( O +CAM B-Process +) O +[ O +24 O +] O +, O +while O +the O +stress B-Process +tensor I-Process +field I-Process +is O +measured O +using O +the O +Irving B-Process +– I-Process +Kirkwood I-Process +relationship I-Process +[ O +25 O +] O +. O +A O +least-squares B-Process +polynomial I-Process +fit I-Process +to O +the O +data O +is O +performed O +, O +which O +helps O +reduce B-Process +noise I-Process +further O +. O +The O +fit O +produces O +a O +continuous B-Process +function I-Process +that O +avoids B-Process +stability I-Process +issues I-Process +arising O +from O +supplying O +highly B-Material +fluctuating I-Material +data I-Material +to O +the O +macro B-Material +solver I-Material +. O +A O +least-squares B-Process +fit I-Process +is O +applied O +to O +an O +Nth B-Material +order I-Material +polynomial I-Material +for O +the O +velocity O +profile O +in O +the O +core B-Material +region I-Material +, O +and O +an O +Mth B-Material +order I-Material +polynomial I-Material +for O +the O +velocity O +profile O +in O +the O +constrained O +region O +:( O +16 O +)〈 O +ui,core O +〉=∑ O +k O += O +1Nbk,iyi′ O +( O +N O +− O +k O +) O +, O +for O +0 O +⩽ O +yi′ O +⩽ O +hcore O +, O +and O +( O +17 O +)〈 O +ui,cs O +〉=∑ O +k O += O +1Mck,iyi O +″( O +M O +− O +k O +) O +, O +for O +0 O +⩽ O +yi O +″⩽ O +hcs O +, O +where O +bk,i O +and O +ck,i O +are O +the O +coefficients B-Material +of O +the O +polynomials B-Material +used O +in O +the O +core B-Material +micro I-Material +region I-Material +and O +constrained B-Material +region I-Material +respectively O +. O +An O +estimate O +of O +the O +new O +slip O +velocity O +uB O +for O +input O +to O +the O +macro B-Material +solution I-Material +( O +6 O +) O +is O +taken O +directly O +from O +the O +compressed B-Material +wall I-Material +micro-element I-Material +solution I-Material +( O +16 O +) O +, O +at O +yi′ O += O +0 O +. O + +It O +is O +interesting O +to O +quantify O +the O +effects O +of O +the O +Schmidt O +number O +and O +the O +chemical B-Process +reaction I-Process +rate O +on O +the O +bulk-mean B-Process +concentration I-Process +of O +B B-Material +in O +water B-Material +. O +The O +data O +could O +present O +important O +information O +on O +evaluating O +the O +environmental O +impacts O +of O +the O +degradation B-Process +product O +of O +B B-Material +, O +as O +well O +as O +acidification B-Process +of O +water B-Material +by O +the O +chemical B-Process +reaction I-Process +. O +Here O +, O +the O +bulk-mean B-Material +concentration I-Material +of O +B B-Material +is O +defined O +by O +( O +24 O +) O +CB O +⁎¯=∫ O +01 O +〈 O +CB O +⁎〉( O +z O +⁎) O +dz O +⁎ O +Fig. O +15 O +depicts O +the O +effect O +of O +the O +Schmidt O +and O +the O +chemical B-Process +reaction I-Process +rate O +on O +the O +bulk-mean B-Material +concentration I-Material +CB B-Material +⁎¯ I-Material +. O +It O +is O +worth O +to O +mention O +here O +that O +the O +bulk-mean B-Process +concentration I-Process +of O +B B-Material +reaches O +approximately O +0.6 O +as O +the O +chemical B-Process +reaction I-Process +rate O +and O +the O +Schmidt O +number O +increase O +to O +infinite O +, O +and O +the O +concentration O +is O +smaller O +than O +the O +equilibrium O +concentration O +of O +A B-Material +at O +the O +interface O +. 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O +We O +need O +an O +extensive B-Task +investigation I-Task +on I-Task +the I-Task +efficiency I-Task +of I-Task +the I-Task +aquarium I-Task +chemical I-Task +reaction I-Task +in O +the O +near O +future O +to O +extend O +the O +results O +of O +this O +study O +further O +to O +establish B-Task +practical I-Task +modelling I-Task +for I-Task +the I-Task +gas I-Task +exchange I-Task +between I-Task +air I-Task +and I-Task +water I-Task +. O + +Numerical B-Task +simulation I-Task +of O +the O +gas O +flow O +through O +such O +non-trivial O +internal O +geometries O +is O +, O +however O +, O +extremely O +challenging O +. 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O +For O +the O +smooth O +solutions O +considered O +as O +test O +cases O +, O +the O +results O +show O +that O +this O +dominance O +of O +geometric O +errors O +quickly O +limits O +the O +effectiveness O +of O +further O +increases O +in O +the O +number O +of O +degrees O +of O +freedom O +, O +either O +through O +mesh B-Process +refinement I-Process +or O +higher B-Task +solution I-Task +polynomial I-Task +orders I-Task +. O +Increasing O +the O +order O +of O +the O +geometry O +parametrisation O +reduces B-Task +the I-Task +geometric I-Task +error I-Task +. 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O +Conventional B-Process +continuum I-Process +fluid I-Process +dynamics I-Process +( O +CFD B-Process +) O +becomes O +invalid O +or O +inaccurate O +as O +the O +characteristic O +scale O +of O +the O +geometry O +( O +e.g. O +the O +channel O +height O +, O +h O +) O +approaches O +the O +molecular O +mean O +free O +path O +, O +λ O +[ O +1,2 O +] O +. O +When O +λ O +/ O +h O +≳ O +0.1 O +, O +the O +error O +in O +solutions O +obtained O +from O +CFD O +may O +be O +significant O +, O +and O +we O +must O +consider O +the O +fluid O +for O +what O +it O +is O +: O +a O +collection B-Material +of I-Material +interacting I-Material +particles I-Material +. O +However O +, O +the O +computational O +expense O +of O +simulating O +the O +flow B-Material +of I-Material +a I-Material +rarefied I-Material +gas I-Material +in O +high-aspect-ratio B-Material +micro I-Material +geometries I-Material +( O +i.e. O +ones O +that O +are O +long B-Material +, I-Material +relative I-Material +to I-Material +their I-Material +cross I-Material +section I-Material +) O +using O +a O +particle B-Process +method I-Process +, O +such O +as O +the O +direct B-Process +simulation I-Process +Monte I-Process +Carlo I-Process +( O +DSMC B-Process +) O +method O +[ O +2 O +] O +, O +can O +be O +prohibitively O +high O +[ O +3,4 O +] O +. O +The O +computational O +intensity O +of O +the O +particle B-Process +method I-Process +is O +greater O +still O +when O +simulating O +low-speed O +microfluidic B-Material +devices I-Material +where O +there O +are O +only O +small B-Material +deviations I-Material +from I-Material +equilibrium I-Material +, O +characterised O +by O +extremely B-Material +low I-Material +Mach I-Material +numbers I-Material +and I-Material +weak I-Material +temperature I-Material +gradients I-Material +. O + +In O +this O +work O +, O +we O +have O +developed O +a O +simple O +numerical B-Process +scheme I-Process +based O +on O +the O +Galerkin B-Process +finite I-Process +element I-Process +method I-Process +for O +a O +multi-term B-Task +time I-Task +fractional I-Task +diffusion I-Task +equation I-Task +which O +involves O +multiple B-Process +Caputo I-Process +fractional I-Process +derivatives I-Process +in I-Process +time I-Process +. 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O +The O +extensive O +numerical B-Process +experiments I-Process +in O +one B-Process +- I-Process +and I-Process +two-dimension I-Process +fully O +confirmed O +our O +convergence O +analysis O +: O +the O +empirical B-Material +convergence I-Material +rates I-Material +agree O +well O +with O +the O +theoretical O +predictions O +for O +both O +smooth O +and O +nonsmooth O +data O +. O + +In O +this O +work O +, O +light B-Task +propagation I-Task +in I-Task +a I-Task +scattering I-Task +medium I-Task +with I-Task +piece-wise I-Task +constant I-Task +refractive I-Task +index I-Task +using O +the O +radiative B-Process +transport I-Process +equation I-Process +was O +studied O +. O +Light O +propagation O +in O +each O +sub-domain O +with O +a O +constant O +refractive O +index O +was O +modeled O +using O +the O +RTE B-Process +and O +the O +equations O +were O +coupled O +using O +boundary O +conditions O +describing O +Fresnel B-Process +reflection I-Process +and I-Process +transmission I-Process +phenomenas I-Process +on O +the O +interfaces O +between O +the O +sub-domains O +. O +The O +resulting O +coupled B-Process +system I-Process +of I-Process +RTEs I-Process +was O +numerically O +solved O +using O +the O +FEM B-Process +. O +The O +proposed O +model O +was O +tested O +using O +simulations B-Process +and O +was O +compared O +with O +the O +solution B-Material +of I-Material +the I-Material +Monte I-Material +Carlo I-Material +method I-Material +. O +The O +results O +show O +that O +the O +coupled O +RTE B-Process +model O +describes O +light O +propagation O +accurately O +in O +comparison O +with O +the O +Monte B-Material +Carlo I-Material +method I-Material +. O +In O +addition O +, O +results O +show O +that O +neglecting O +internal O +refractive O +index O +changes O +can O +lead O +to O +erroneous O +boundary O +measurements O +of O +scattered O +light O +. O +This O +indicates O +that O +the O +quality O +of O +the O +DOT B-Process +reconstructions I-Process +could O +possible O +be O +increased O +by O +incorporating O +a O +model O +for O +internal O +refractive B-Process +index I-Process +changes I-Process +in O +the O +image B-Process +reconstruction I-Process +procedure I-Process +. O + +The O +validity B-Task +of I-Task +semi-classical I-Task +boundary I-Task +conditions I-Task +for O +the O +WTE O +as O +introduced O +in O +[ O +8 O +] O +is O +a O +topic O +under O +vivid O +debate O +, O +especially O +after O +recent O +works O +which O +address O +the O +non-uniqueness B-Process +and I-Process +the I-Process +symmetry I-Process +properties I-Process +of I-Process +the I-Process +Wigner I-Process +function I-Process +[ O +27,28,46 O +] O +. O +The O +numerical B-Material +test I-Material +cases I-Material +presented O +therein O +are O +for O +symmetric B-Material +potentials I-Material +for O +which O +we O +cannot O +provide O +reliable O +, O +i.e. O +well-resolved O +, O +results O +due O +to O +the O +presence O +of O +singular O +terms O +in O +the O +steady B-Process +state I-Process +Wigner I-Process +functions I-Process +, O +see O +Section O +4.3 O +. O +Other B-Material +recent I-Material +studies I-Material +demonstrate O +the O +convergence B-Task +of I-Task +the I-Task +WTE I-Task +calculations I-Task +upon O +increasing B-Process +the I-Process +size I-Process +of I-Process +the I-Process +simulation I-Process +domain I-Process +[ O +44 O +] O +as O +well O +as O +possible O +improvements O +by O +adapting B-Process +the I-Process +boundary I-Process +distribution I-Process +to O +the O +physical O +state O +of O +the O +active O +device O +region O +[ O +47 O +] O +. O +Despite O +their O +approximate O +nature O +we O +employ B-Process +inflow I-Process +/ I-Process +outflow I-Process +boundary I-Process +conditions I-Process +here O +as O +well O +and O +demonstrate O +that O +accurate B-Task +and I-Task +physically I-Task +valid I-Task +results I-Task +can O +be O +achieved O +for O +sufficiently O +large O +values O +of O +Lres O +. O +Due O +to O +the O +problematics O +with O +singular O +terms O +we O +present B-Task +simulations I-Task +only I-Task +for I-Task +non-zero I-Task +bias I-Task +voltages I-Task +VDS O +≠ O +0 O +V O +. O + +A O +multi-physics B-Process +description I-Process +of I-Process +a I-Process +multiscale I-Process +system I-Process +is O +often O +referred O +to O +as O +a O +‘ B-Process +hybrid’ I-Process +model I-Process +. O +In O +fluid B-Task +dynamics I-Task +, O +a O +typical O +hybrid B-Process +combines O +a O +molecular B-Process +treatment I-Process +( O +a O +‘ B-Process +micro’ I-Process +model I-Process +) O +with O +a O +continuum-fluid B-Process +one I-Process +( O +a O +‘ O +macro’ B-Process +model I-Process +) O +, O +with O +the O +aim O +of O +obtaining B-Task +the I-Task +accuracy I-Task +of I-Task +the I-Task +former I-Task +with I-Task +the I-Task +efficiency I-Task +of I-Task +the I-Task +latter I-Task +[ O +1 O +– O +4 O +] O +. O +The O +micro B-Process +and I-Process +macro I-Process +models I-Process +generally O +have O +characteristic O +timescales O +that O +are O +very O +different O +, O +which O +means O +that O +time-accurate O +simulations O +can O +be O +extremely O +challenging O +: O +the O +size O +of O +the O +timestep O +required O +to O +make O +the O +micro O +model O +stable O +and O +accurate O +is O +so O +small O +that O +simulations O +over O +significant O +macro-scale O +time O +periods O +are O +intractable O +. O +If O +the O +system O +is O +‘ O +scale-separated’ O +, O +a O +physical O +( O +as O +distinct O +from O +numerical O +) O +approximation O +can O +be O +made O +that O +enables O +the O +coupled O +models O +to O +advance O +at O +different O +rates O +( O +asynchronously O +) O +with O +negligible O +penalty O +on O +macro-scale O +accuracy O +. O +E O +et O +al O +. O +[ O +5 O +] O +were O +the O +first O +to O +introduce O +and O +implement O +this O +concept O +in O +a O +time-stepping O +method O +for O +coupled O +systems O +, O +referred O +to O +in O +the O +classification O +of O +Lockerby O +et O +al O +. O +[ O +6 O +] O +as O +a O +continuous O +asynchronous O +( O +CA O +) O +scheme O +(‘ O +continuous’ O +since O +the O +micro O +and O +macro O +models O +advance O +without O +interruption O +[ O +5 O +]) O +. O +In O +this O +paper O +we O +extend O +this O +idea O +to O +multiscale O +systems O +comprising O +an O +arbitrary O +number O +of O +coupled O +models O +. O + +The O +particular O +phase B-Task +field I-Task +model I-Task +we O +employ O +is O +an O +extension O +of O +[ O +6 O +] O +, O +and O +is O +based O +on O +the O +three B-Process +dimensional I-Process +thermal I-Process +phase I-Process +field I-Process +model I-Process +of O +[ O +7 O +] O +and O +two B-Process +dimensional I-Process +thermal-solutal I-Process +phase I-Process +field I-Process +model I-Process +of O +[ O +8 O +] O +. O +One O +feature O +of O +the O +physical O +problem O +is O +that O +it O +is O +purely O +dissipative O +, O +or O +entropy O +increasing O +, O +as O +all O +natural O +relaxational O +phenomena O +are O +. O +The O +resulting O +PDEs B-Material +are O +of O +Allen O +– O +Cahn O +[ O +9 O +] O +and O +Carn O +– O +Hilliard O +type O +[ O +10 O +] O +. O +That O +is O +to O +say O +, O +the O +model O +involves O +time B-Process +derivatives I-Process +of I-Process +the I-Process +three I-Process +fields I-Process +coupled I-Process +to I-Process +forms I-Process +involving I-Process +variational I-Process +derivatives I-Process +of O +some O +functional B-Process +– O +typically O +the O +free B-Process +energy I-Process +functional I-Process +. O +As O +the O +dendrite B-Material +grows O +the O +free O +energy O +reduces O +monotonically O +with O +time O +but O +never O +achieves O +equilibrium O +if O +the O +domain O +boundary O +is O +far O +from O +the O +dendrite O +. O +Although O +we O +have O +listed O +some O +of O +the O +difficult O +aspects O +of O +this O +model O +, O +the O +relaxational O +aspect O +is O +typically O +an O +asset O +and O +results O +in O +stable O +numerical B-Process +schemes I-Process +: O +there O +is O +no O +convection O +, O +for O +example O +( O +at O +least O +in O +the O +absence O +of O +flow O +in O +the O +melt B-Material +) O +. O + +Inspired O +by O +energy-fueled O +phenomena O +such O +as O +cortical B-Process +cytoskeleton I-Process +flows I-Process +[ O +46,45,32 O +] O +during O +biological B-Process +morphogenesis I-Process +, O +the O +theory B-Task +of I-Task +active I-Task +polar I-Task +viscous I-Task +gels I-Task +has O +been O +developed O +[ O +37,33 O +] O +. O +The O +theory O +models B-Process +the I-Process +continuum I-Process +, I-Process +macroscopic I-Process +mechanics I-Process +of O +a O +collection O +of O +uniaxial B-Material +active I-Material +agents I-Material +, O +embedded O +in O +a O +viscous B-Material +bulk I-Material +medium I-Material +, O +in O +which O +internal O +stresses O +are O +induced O +due O +to O +dissipation O +of O +energy O +[ O +41,58 O +] O +. O +The O +energy-consuming O +uniaxial B-Material +polar I-Material +agents I-Material +constituting O +the O +gel B-Material +are O +modeled O +as O +unit O +vectors O +. O +The O +average O +of O +unit O +vectors O +in O +a O +small O +local O +volume O +at O +each O +point O +defines O +the O +macroscopic O +directionality O +of O +the O +agents O +and O +is O +described O +by O +a O +polarization B-Process +field I-Process +. O +The O +polarization O +field O +is O +governed O +by O +an O +equation B-Process +of I-Process +motion I-Process +accounting O +for O +energy O +consumption O +and O +for O +the O +strain O +rate O +in O +the O +fluid B-Material +. O +The O +relationship O +between O +the O +strain O +rate O +and O +the O +stress O +in O +the O +fluid O +is O +provided O +by O +a O +constitutive B-Process +equation I-Process +that O +accounts O +for O +anisotropic O +, O +polar O +agents O +and O +consumption O +of O +energy O +. O +These B-Process +equations I-Process +, I-Process +along I-Process +with I-Process +conservation I-Process +of I-Process +momentum I-Process +, O +provide O +a O +continuum B-Process +hydrodynamic I-Process +description I-Process +modeling O +active O +polar B-Material +viscous I-Material +gels I-Material +as O +an O +energy B-Material +consuming I-Material +, I-Material +anisotropic I-Material +, I-Material +non-Newtonian I-Material +fluid I-Material +[ O +37,33,32,41 O +] O +. O +The O +resulting O +partial O +differential O +equations O +governing O +the O +hydrodynamics O +of O +active B-Material +polar I-Material +viscous I-Material +gels I-Material +are O +, O +however O +, O +in O +general O +analytically O +intractable O +. O + +The O +boundary B-Process +element I-Process +method I-Process +( O +BEM B-Process +) O +has O +clear O +advantages O +when O +applied O +to O +shape B-Task +optimisation I-Task +of I-Task +high-voltage I-Task +devices I-Task +, O +see O +[ O +4 O +– O +8 O +] O +for O +an O +introduction O +to O +BEM B-Process +. O +First O +of O +all O +, O +BEM O +relies O +only O +on O +a O +surface B-Process +discretisation I-Process +so O +that O +there O +is O +no O +need O +to O +maintain O +an O +analysis-suitable O +volume O +discretisation O +during O +the O +shape B-Process +optimisation I-Process +process O +. O +Moreover O +, O +BEM B-Process +is O +ideal O +for O +solving B-Task +problems I-Task +in I-Task +unbounded I-Task +domains I-Task +that O +occur O +in O +electrostatic B-Process +field I-Process +analysis I-Process +. O +In O +gradient-based B-Task +shape I-Task +optimisation I-Task +the O +shape B-Process +derivative I-Process +of O +the O +cost O +functional O +with O +respect O +to O +geometry O +perturbations O +is O +needed O +[ O +9 O +– O +11 O +] O +. O +To O +this O +purpose O +, O +we O +use O +the O +adjoint B-Process +approach I-Process +and O +solve O +the O +primary B-Task +and I-Task +the I-Task +adjoint I-Task +boundary I-Task +value I-Task +problems I-Task +with O +BEM B-Process +. O +The O +associated O +linear O +systems O +of O +equations O +are O +dense O +and O +an O +acceleration O +technique O +, O +such O +as O +the O +fast B-Process +multipole I-Process +method I-Process +[ O +12,13 O +] O +, O +is O +necessary O +for O +their O +efficient O +solution O +. O +For O +some O +recent O +applications O +of O +fast B-Task +BEM I-Task +in I-Task +shape I-Task +optimisation I-Task +and O +Bernoulli-type B-Task +free-boundary I-Task +problems I-Task +we O +refer O +to O +[ O +14 O +– O +16 O +] O +. O + +The O +extrapolation B-Task +of I-Task +the I-Task +upwind I-Task +value I-Task +required O +for O +TVD B-Process +differencing I-Process +is O +a O +particular O +hurdle O +for O +the O +application O +on O +unstructured B-Material +meshes I-Material +. O +As O +discussed O +in O +Section O +3.2 O +, O +two O +methods O +to O +extrapolate O +the O +value O +at O +the O +virtual O +upwind O +node O +, O +using O +data B-Material +readily I-Material +available I-Material +on I-Material +unstructured I-Material +meshes I-Material +, O +are O +considered O +. O +Given O +how O +the O +virtual B-Process +upwind I-Process +node I-Process +is I-Process +incorporated I-Process +in I-Process +the I-Process +gradient I-Process +ratio I-Process +rf I-Process +, O +the O +extrapolation O +method O +of O +Darwish B-Process +and I-Process +Moukalled I-Process +[ O +13 O +] O +is O +referred O +to O +as O +implicit B-Process +extrapolation I-Process +and O +the O +method B-Process +introduced I-Process +by I-Process +Ubbink I-Process +and I-Process +Issa I-Process +[ O +12 O +] O +as O +explicit B-Process +extrapolation I-Process +. O +Both O +methods O +precisely O +reconstruct O +the O +upwind O +value O +for O +equidistant B-Material +, I-Material +rectilinear I-Material +meshes I-Material +but O +fail O +to O +do O +so O +on O +non-equidistant B-Material +or O +non-rectilinear B-Material +meshes I-Material +, O +as O +discussed O +in O +Section O +3.2 O +. O +Using O +the O +explicit B-Process +extrapolation I-Process +method O +this O +issue O +can O +be O +rectified O +by O +imposing O +appropriate O +limits O +on O +the O +extrapolated O +upwind O +value O +. O + +A O +popular O +choice O +is O +to O +couple B-Process +a I-Process +set I-Process +of I-Process +quadrature I-Process +points I-Process +with I-Process +an I-Process +equal I-Process +number I-Process +of I-Process +nodal I-Process +Lagrange I-Process +polynomials I-Process +defined O +at O +the O +same O +points O +, O +leading O +to O +a O +collocation B-Process +method I-Process +. O +There O +are O +many O +examples O +of O +this O +throughout O +the O +literature O +, O +both O +in O +terms O +of O +the O +more O +traditionally O +utilised O +continuous O +Galerkin B-Process +( O +CG B-Process +) O +and O +discontinuous B-Process +Galerkin I-Process +( O +DG B-Process +) O +formulations O +, O +as O +well O +as O +newer B-Process +extensions I-Process +such O +as O +the O +flux B-Process +reconstruction I-Process +( O +FR B-Process +) O +technique O +as O +presented O +by O +Huynh O +[ O +23 O +] O +. O +In O +collocation B-Process +methods I-Process +, O +while O +most O +linear B-Material +operators I-Material +can O +be O +exactly O +integrated O +in O +this O +setting O +depending O +on O +the O +choice O +of O +quadrature O +, O +integrals O +of O +nonlinear O +terms O +typically O +incur O +numerical O +error O +. 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O +) O +To O +showcase O +this O +effect O +in O +the O +angular O +dimension O +, O +a O +large O +spatial B-Process +domain I-Process +( I-Process +4000km I-Process +× I-Process +4000km I-Process +) I-Process +is I-Process +simulated I-Process +, O +with O +a O +monochromatic B-Material +wave I-Material +propagating O +over O +a O +long O +distance O +in O +deep B-Material +water I-Material +( O +d O += O +10000m O +) O +. O +For O +the O +spatial B-Process +discretisation I-Process +a O +structured B-Process +triangle I-Process +mesh I-Process +is O +used O +, O +with O +an O +element O +edge O +length O +of O +67km O +( O +Fig. O +11 O +( O +a O +)) O +. O +The O +initial O +wave B-Material +field I-Material +, O +located O +500km O +from O +the O +lower O +and O +left O +side O +has O +a O +Gaussian B-Material +distribution I-Material +in I-Material +space I-Material +, O +with O +a O +significant O +wave B-Material +height O +of O +Hs O += O +2.5m O +and O +a O +standard O +deviation O +of O +150km O +( O +Fig. O +11 O +( O +b O +)) O +. O +Its O +mean O +direction O +is O +30 O +° O +with O +an O +angular O +distribution O +of O +cos2 O +⁡( O +θ O +) O +and O +a O +frequency O +of O +0.1Hz O +. O +The O +simulation B-Process +is O +time-dependent O +and O +runs O +for O +5 O +days O +with O +a O +time-step O +of O +600s O +. O + +Multi-phase B-Task +flows I-Task +are O +common O +, O +in O +fact O +quite O +general O +, O +in O +environmental B-Process +and I-Process +industrial I-Process +processes I-Process +. O +Broadly O +these O +may O +be O +modelled O +as O +continuous O +problems O +where O +phases B-Process +are I-Process +mixed I-Process +( O +e.g. O +oil B-Process +– I-Process +water I-Process +homogenisation I-Process +[ O +36 O +] O +, O +sediment B-Process +transport I-Process +[ O +18 O +]) O +or O +interface B-Process +problems I-Process +where O +phases O +are O +distinct O +and O +interact O +at O +the O +interface O +( O +e.g. O +gas-assisted B-Process +injection I-Process +moulding I-Process +[ O +21 O +] O +, O +liquid B-Process +jet I-Process +breakup I-Process +[ O +40 O +]) O +. O +In O +some O +cases O +flows O +start O +as O +interface O +problems O +but O +as O +mixing B-Process +occurs O +at O +the O +interface O +they O +become O +effectively O +continuous O +, O +at O +least O +locally O +. O +Air B-Task +entrainment I-Task +, O +perhaps O +due O +to O +wave B-Process +breaking I-Process +, O +is O +an O +obvious O +example O +. O +We O +consider O +here O +two-phase B-Task +interface I-Task +problems I-Task +where O +the O +interface O +remains O +distinct O +and O +the O +density O +difference O +is O +high O +, O +e.g. O +air B-Material +and O +water B-Material +, O +and O +where O +one O +phase O +may O +be O +considered O +incompressible O +. O +The O +interface O +is O +transient O +and O +may O +become O +highly O +distorted B-Process +and I-Process +interconnected I-Process +. O +Such O +problems O +have O +been O +tackled O +with O +mesh-based B-Process +methods I-Process +using O +periodic O +( O +or O +adaptive O +) O +re-meshing B-Process +or O +additional O +phase B-Process +tracking I-Process +functions I-Process +[ O +40 O +] O +. O +However O +, O +these O +approaches O +can O +be O +time-consuming O +to O +implement O +and O +prone O +to O +errors O +in O +surface O +representation O +[ O +50 O +] O +or O +mass O +conservation O +[ O +34 O +] O +. O + +This O +section O +is O +devoted O +to O +the O +discretization B-Task +of I-Task +the I-Task +advection I-Task +– I-Task +diffusion I-Task +equation I-Task +and O +to O +the O +analysis O +of O +dispersion B-Task +and I-Task +diffusion I-Task +eigencurves I-Task +for O +different O +polynomial O +orders O +. O +The O +spectral O +/ O +hp O +continuous O +Galerkin B-Process +method I-Process +considered O +closely O +resembles O +the O +formulation O +presented O +in O +[ O +7 O +] O +. O +Sec O +. O +2.1 O +describes O +in O +detail O +the O +derivation B-Process +of I-Process +the I-Process +semi-discrete I-Process +advection I-Process +– I-Process +diffusion I-Process +problem I-Process +as O +applied O +to O +wave-like B-Material +solutions I-Material +, O +from O +which O +the O +relevant O +eigencurves O +can O +be O +obtained O +. O +The O +inviscid B-Material +case I-Material +( O +linear B-Material +advection I-Material +) O +is O +then O +addressed O +in O +Sec O +. O +2.2 O +, O +where O +the O +role O +of O +primary O +and O +secondary O +eigencurves O +is O +discussed O +from O +the O +perspective O +introduced O +in O +[ O +9 O +] O +. O +The O +viscous B-Material +case I-Material +is O +subsequently O +considered O +in O +Sec O +. O +2.3 O +, O +where O +eigencurves O +are O +shown O +to O +feature O +irregular O +oscillations O +for O +problems O +strongly O +dominated O +by O +either O +convection O +or O +diffusion O +. O + +Discovering O +that O +both O +the O +vacancy O +and O +interstitial O +defect B-Task +migration I-Task +pathways I-Task +are O +confined O +to O +Ga-free O +regions O +suggests O +changes O +in O +recombination O +rates O +of O +isolated O +vacancy-interstitial O +pairs O +in O +comparison O +to O +pure O +Pu O +. O +The O +degree O +to O +which O +the O +rates O +are O +effected O +depends O +on O +the O +distribution O +of O +residual O +defects O +post O +a O +cascade O +event O +, O +in O +addition O +to O +the O +concentration O +and O +ordering O +of O +the O +Ga B-Material +atoms O +. O +If O +vacancies O +and O +interstitials O +become O +greatly O +separated O +after O +the O +collision O +cascade O +, O +then O +pathways O +to O +recombination O +are O +likely O +to O +become O +restricted O +and O +recovery O +times O +will O +be O +extended O +. O +This O +is O +viable O +for O +cascades O +that O +created O +a O +vacancy O +rich O +core O +surrounded O +by O +dispersed O +interstitials O +, O +as O +found O +for O +the O +low O +energy O +cascades O +in O +Pu O +and O +PuGa O +[ O +11,12 O +] O +. O +This O +may O +also O +be O +the O +case O +for O +channelling O +events O +, O +where O +energetic O +atoms O +travel O +deep O +into O +the O +lattice O +through O +channels O +of O +low O +atomic O +density O +. O + +Our O +simulations B-Material +confirm O +experimental O +observations O +that O +W B-Task +net I-Task +erosion I-Task +represents O +only O +tiny O +fraction O +( O +in O +our O +simulation O +∼ O +1 O +%) O +of O +the O +W B-Task +gross I-Task +erosion I-Task +. O +The O +estimated B-Process +upstream I-Process +W I-Process +fluxes I-Process +, O +FWupstrem B-Process +, O +are O +in O +good O +agreement O +with O +the O +experimentally B-Material +observed I-Material +values I-Material +⩽ O +1019m-2s-1 O +[ O +16 O +] O +. O +Moreover O +, O +this O +value O +is O +not O +very O +sensitive O +to O +the O +divertor B-Material +plasma O +temperature O +. O +For O +low O +temperatures O +the O +energy O +of O +D B-Material +and I-Material +C I-Material +ions I-Material +hitting B-Process +to I-Process +the I-Process +divertor I-Process +plates I-Process +is O +too O +low O +to O +sputter O +sufficient O +amount O +of O +W B-Material +. O +With O +increasing B-Process +energy I-Process +the O +W B-Process +sputtering I-Process +increases O +, O +but O +the O +potential O +drop O +in O +the O +divertor B-Material +plasma I-Material +increases O +too O +. O +As O +a O +result O +, O +most O +of O +the O +W B-Material +atoms I-Material +are O +ionized B-Process +in O +the O +vicinity O +of O +the O +divertor B-Material +and O +return B-Process +back O +to O +the O +plates B-Material +. O +There O +are O +two O +effects O +leading O +to O +the O +observed B-Task +prompt I-Task +redeposition I-Task +of O +W B-Material +ions I-Material +: O +first O +is O +the O +“ O +near-divertor B-Process +” I-Process +ionization I-Process +of O +W B-Material +due O +to O +low O +ionization B-Process +potential O +− O +7.86eV O +( O +for O +comparison O +the O +ionization O +potentials O +for O +D B-Material +and O +C B-Material +are O +13,6 O +and O +10.6eV O +) O +, O +second O +, O +W B-Material ++ I-Material +n I-Material +ions I-Material +have O +large B-Process +Larmor I-Process +radius I-Process +∼ O +2 O +/ O +nmm O +, O +so O +that O +they O +are O +redeposited O +within O +the O +distance O +of O +a O +Larmor O +radius O +. O +Important O +to O +note O +that O +a O +significant O +fraction O +of O +W B-Material +ions I-Material +escaping O +this O +prompt O +redeposition O +are O +returned O +back O +due O +to O +the O +friction B-Process +with I-Process +the I-Process +main I-Process +ions I-Process +. O + +The O +displacement B-Task +cascade I-Task +is O +a O +rapid O +process O +( O +of O +order O +picoseconds O +) O +. O +Further O +migration B-Process +of I-Process +vacancies I-Process +and I-Process +SIAs I-Process +, O +mainly O +by O +diffusion B-Process +, O +happens O +over O +a O +timescale O +of O +order O +nanoseconds O +[ O +17 O +] O +. O +This O +is O +still O +short O +compared O +to O +operating O +times O +, O +so O +is O +important O +to O +consider O +the O +equilibrium O +result O +of O +such O +processes O +: O +If O +the O +vacancies O +and O +SIAs O +were O +likely O +to O +find O +their O +Frenkel O +partner O +, O +recombine O +, O +and O +annihilate O +, O +then O +the O +metal O +should O +essentially O +return O +to O +its O +original O +structure B-Material +; O +however O +, O +if O +defects B-Material +instead O +formed O +large O +clusters O +of O +a O +single O +type O +this O +could O +result O +in O +formation O +of O +voids B-Material +, O +dislocation B-Material +loops I-Material +or O +swelling B-Material +, O +possibly O +weakening O +the O +material O +in O +the O +process O +. 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O +Subsequently O +, O +due O +to O +fast O +diffusion O +in O +the O +liquid B-Material +phase O +, O +the O +initial O +sample O +composition O +( O +x O +( O +PuO2 B-Material +)= O +0.25 O +) O +tends O +to O +be O +rapidly O +restored O +. O +It O +is O +however O +clear O +, O +from O +the O +simulation B-Process +, O +that O +the O +fast O +cooling B-Process +occurring O +after O +the O +end O +of O +the O +laser B-Process +pulse I-Process +leads O +to O +onset O +of O +solidification B-Process +before O +the O +initial O +composition O +is O +fully O +recovered O +in O +the O +liquid B-Material +. O +A O +surface B-Material +solid I-Material +crust I-Material +forms O +then O +upon O +freezing B-Process +before O +the O +total O +liquid B-Material +mass O +has O +crystallised O +( O +see O +insets O +in O +Fig. O +4 O +) O +. O +The O +double O +inflection O +during O +cooling B-Process +in O +this O +case O +corresponds O +to O +the O +solidification B-Process +onset O +on O +the O +sample B-Material +surface I-Material +( O +first O +inflection O +) O +and O +to O +the O +disappearance O +of O +the O +last O +liquid B-Material +inside O +the O +material O +( O +second O +inflection O +) O +. O +The O +highest O +recalescence O +temperature O +represents O +the O +solidification B-Process +point O +of O +a O +composition O +very O +close O +to O +the O +initial O +one O +( O +approximately O +± O +0.01 O +on O +x O +( O +PuO2 O +) O +in O +the O +current O +example O +) O +, O +except O +for O +small B-Task +segregation I-Task +effects I-Task +. O +These O +latter O +have O +been O +studied O +also O +experimentally O +in O +the O +present O +research O +, O +by O +post-melting B-Process +material I-Process +characterisation I-Process +. O + +The O +vapour B-Material +phase I-Material +consists O +of O +a O +number B-Material +of I-Material +different I-Material +gases I-Material +with O +silicon B-Material +exhibiting O +a O +far O +higher O +partial O +pressure O +than O +all O +carbon B-Material +containing O +species O +over O +the O +full O +temperature O +range O +. O +As O +an O +immediate O +result O +the O +vapour B-Material +contains O +a O +higher O +amount O +of O +silicon B-Material +leaving O +the O +solid B-Process +phase I-Process +with O +excess O +carbon B-Material +. O +This O +carbon O +is O +likely O +to O +precipitate B-Process +on I-Process +the I-Process +surface I-Process +of I-Process +the I-Process +SiC I-Process +grains I-Process +, O +a O +process O +that O +becomes O +very O +rapid O +as O +the O +temperature O +approaches O +2100K O +[ O +24 O +] O +. O +Within O +the O +TRISO B-Material +particle I-Material +the O +SiC B-Material +layer O +is O +sandwiched O +between O +two O +coatings O +of O +dense O +carbon B-Material +. O +The O +partial B-Material +pressure I-Material +in O +thermodynamic O +equilibrium O +of O +gaseous B-Material +carbon I-Material +forming O +above O +graphite B-Material +was O +calculated O +using O +data B-Material +taken I-Material +from I-Material +JANAF I-Material +tables I-Material +and O +added O +to O +Fig. O +1 O +[ O +25 O +] O +, O +which O +showed O +that O +in O +the O +whole O +temperature O +range O +relevant O +for O +this O +study O +the O +vapour B-Task +pressure I-Task +of I-Task +carbon I-Task +is O +several O +magnitudes O +smaller O +than O +that O +of O +the O +dominant O +gas B-Material +phases O +above O +SiC B-Material +. O + +The O +second B-Task +stress I-Task +state I-Task +is O +a O +tri-axial B-Task +tensile I-Task +stress I-Task +designed O +to O +represent O +the O +zone O +ahead O +of O +an O +advancing B-Material +crack I-Material +tip I-Material +. O +Micro-scale O +lateral O +cracks O +have O +been O +observed O +in O +the O +oxide B-Material +layer I-Material +, O +and O +appear O +to O +form O +very O +close O +to O +or O +at O +the O +metal B-Material +– I-Material +oxide I-Material +interface I-Material +( O +Fig. O +1 O +) O +. O +Finite B-Process +element I-Process +analysis I-Process +by O +Parise O +et O +al. O +indicated O +that O +these O +cracks B-Material +form O +as O +a O +result O +of O +localised B-Material +tensile I-Material +stresses I-Material +above O +peaks O +in O +the O +metal B-Material +– I-Material +oxide I-Material +interface I-Material +roughness O +[ O +31 O +] O +. O +These O +cracks O +are O +considered O +separate O +to O +any O +nano-scale O +cracks O +that O +might O +result O +from O +the O +tetragonal B-Process +to I-Process +monoclinic I-Process +phase I-Process +transformation I-Process +. O +An O +assumption O +is O +made O +here O +that O +whether O +the O +micro-scale O +lateral O +cracks O +form O +via O +fracture O +of O +the O +oxide B-Material +or O +by O +de-bonding B-Process +at O +the O +interface O +a O +triaxial B-Process +tensile I-Process +stress I-Process +state O +will O +still O +be O +present O +. O +In O +manufactured B-Material +partially I-Material +stabilised I-Material +zirconia I-Material +cracks O +would O +be O +expected O +to O +destabilise O +the O +tetragonal B-Process +phase I-Process +. O +This O +is O +simulated B-Task +by I-Task +applying I-Task +tensile I-Task +stress I-Task +in I-Task +direction I-Task +1 I-Task +, I-Task +2 I-Task +and I-Task +3 I-Task +. O +As O +this O +the O +maximum B-Process +stress I-Process +at O +the O +crack O +tip O +is O +not O +known O +, O +the O +applied B-Process +tensile I-Process +stresses I-Process +cover O +a O +range O +from O +0.1GPa O +up O +to O +a O +maximum O +stress O +value O +of O +2.2GPa O +as O +it O +is O +approximately O +equal O +to O +three O +times O +the O +fracture B-Process +strength O +of O +bulk O +fracture O +strength O +for O +manufactured B-Material +stabilized I-Material +zirconia I-Material +[ O +34 O +] O +. O +For O +the O +biaxial B-Task +compressive I-Task +and I-Task +triaxial I-Task +tensile I-Task +stress I-Task +states I-Task +it O +is O +the O +trends O +in O +behaviour O +rather O +than O +the O +absolute O +values O +that O +are O +considered O +of O +greatest O +importance O +for O +this O +work O +. O + +The O +early O +theoretical O +work O +of O +Catlow O +assessed O +a O +number O +of O +Willis B-Material +type I-Material +clusters I-Material +and O +found O +them O +all O +to O +be O +stable O +using O +potential-based B-Process +methods I-Process +[ O +6 O +] O +. O +More O +recently O +“ O +split B-Task +interstitial I-Task +” I-Task +type I-Task +clusters I-Task +( O +Fig. O +1 O +) O +have O +emerged O +from O +computational O +studies O +as O +stable O +species O +following O +the O +potential B-Process +based I-Process +investigation I-Process +of O +Govers O +et O +al. O +which O +found O +the O +2:2:2 O +cluster O +in O +a O +UO2 B-Material +supercell I-Material +relaxed O +to O +a O +split O +di-interstitial B-Material +[ O +13 O +] O +( O +Fig. O +1 O +( O +b O +)) O +; O +a B-Material +single I-Material +VO I-Material +with I-Material +three I-Material +Oi I-Material +displaced O +approximately O +1.6Å O +in O +〈 O +111 O +〉 O +directions O +from O +the O +VO O +. O +This O +result O +was O +later O +confirmed O +by O +the O +LSDA B-Process ++ I-Process +U I-Process +calculations O +of O +Geng O +et O +al O +. O +[ O +7 O +] O +. O +The O +family O +of O +split B-Material +interstitial I-Material +clusters I-Material +was O +extended O +to O +include O +tri-interstitials B-Material +[ O +8 O +] O +( O +a O +di-interstitial B-Material +with I-Material +the I-Material +fourth I-Material +Oi I-Material +site I-Material +occupied I-Material +) O +and O +quad-interstitials B-Material +[ O +9 O +] O +( O +two B-Material +di-interstitials I-Material +on I-Material +adjacent I-Material +sites I-Material +, O +giving O +a O +total O +of O +two O +VO B-Material +and O +six O +Oi B-Material +) O +( O +Fig. O +1 O +( O +d O +)) O +. O +Following O +this O +Andersson O +et O +al. O +postulated O +a O +model B-Material +for I-Material +U4O9 I-Material +based O +on O +a O +UO2 B-Material +supercell I-Material +containing O +multiple B-Material +split I-Material +quad-interstitial I-Material +clusters I-Material +; O +following O +the O +prediction O +of O +their O +LSDA B-Process ++ I-Process +U I-Process +calculations O +that O +the O +quad-interstitial B-Material +is O +more O +stable O +than O +its O +cuboctahedral B-Material +counterpart O +[ O +12 O +] O +. O + +In O +the O +calculations O +for O +the O +formation B-Task +energy I-Task +, O +the O +box B-Material +size O +is O +set O +to O +30a0 O +× O +30a0 O +× O +30a0 O +, O +where O +a0 O +is O +the O +bcc O +Fe B-Material +lattice I-Material +parameter O +. O +For O +all O +calculations O +periodic O +boundary O +conditions O +and O +constant O +volume O +are O +used O +. O +The O +Monte B-Process +Carlo I-Process +algorithm I-Process +used O +to O +determine B-Process +the I-Process +lowest I-Process +energy I-Process +configuration I-Process +of O +the O +cluster O +[ O +28 O +] O +is O +organised O +as O +follows O +. O +First O +, O +the O +energetics O +of O +voids B-Material +without I-Material +helium I-Material +are O +investigated O +. O +A O +vacancy O +is O +introduced O +into O +the O +simulation B-Material +cell I-Material +and O +the O +system O +is O +minimised O +using O +a O +conjugate B-Process +gradient I-Process +algorithm I-Process +, O +yielding O +a O +single B-Material +vacancy I-Material +formation I-Material +energy I-Material +Evac B-Material +of O +1.72eV O +. O +Next O +, O +the O +atom O +with O +the O +highest O +potential O +energy O +is O +removed O +from O +the O +system O +and O +again O +the O +system O +is O +minimised B-Process +. O +This O +scheme O +is O +iteratively O +continued O +to O +create O +voids O +up O +to O +the O +number O +of O +target O +vacancies O +and O +the O +formation O +energy O +of O +each O +is O +calculated O +. O +Next O +, O +helium B-Material +atoms I-Material +are O +introduced O +to O +the O +vacancies O +. O +The O +total B-Material +system I-Material +energy I-Material +is O +measured O +and O +recorded O +. O +At O +this O +point O +, O +a O +Metropolis B-Process +MC I-Process +scheme I-Process +[ O +29 O +] O +is O +used O +to O +find O +the O +low B-Material +energy I-Material +configurations I-Material +. O +Every O +helium B-Material +in O +the O +system O +is O +randomly O +displaced O +from O +its O +site O +up O +to O +a O +maximum O +of O +rmax O +( O +4.5Å O +, O +the O +cut O +off O +distance O +for O +He B-Process +– I-Process +He I-Process +interactions I-Process +) O +in O +each O +of O +the O +x O +, O +y O +and O +z O +directions O +and O +then O +minimised B-Process +using O +the O +conjugate B-Process +gradient I-Process +algorithm I-Process +. O +Each O +bubble O +is O +continued O +for O +a O +minimum O +of O +10,000 O +steps O +. O +After O +that O +, O +the O +searches O +will O +be O +terminated O +if O +the O +system O +energy O +does O +not O +drop O +within O +a O +further O +10 O +steps O +. O +A O +schematic O +of O +this O +iterative B-Process +process I-Process +is O +shown O +in O +Fig. O +1 O +. O + +The O +class B-Material +of I-Material +steels I-Material +known O +as O +oxide B-Material +dispersion I-Material +strengthened I-Material +( O +ODS B-Material +) O +ferritic B-Material +alloys I-Material +( O +also O +known O +as O +nanostructured B-Material +ferritic B-Material +alloys I-Material +) O +consist O +of O +a O +dispersion B-Material +of I-Material +ultra-fine I-Material +oxide I-Material +particles I-Material +throughout I-Material +the I-Material +matrix I-Material +. O +These O +oxide O +particles O +serve O +to O +improve B-Task +the I-Task +mechanical I-Task +properties I-Task +of I-Task +the I-Task +system I-Task +, O +particularly O +at O +high O +temperatures O +, O +of O +the O +system O +through O +inhibiting O +dislocation O +motion O +and O +grain O +boundary O +sliding O +. O +In O +nuclear O +applications O +the O +oxide B-Material +particles I-Material +have O +been O +suggested O +to O +act O +as O +point O +defect O +sinks O +[ O +10,11 O +] O +to O +improve B-Task +radiation I-Task +tolerance I-Task +, O +and O +as O +preferential O +sites O +for O +the O +formation O +of O +nano-scale B-Material +He I-Material +bubbles I-Material +therefore O +reducing B-Task +swelling I-Task +compared O +to O +non-ODS B-Material +steels I-Material +[ O +12 O +– O +15 O +] O +. O +The O +ability O +of O +the O +oxide B-Material +particles I-Material +to O +improve O +these O +properties O +depends O +on O +the O +structure B-Material +and I-Material +composition I-Material +of I-Material +the I-Material +particles I-Material +[ O +10,11,16,17 O +] O +and O +their O +stability O +under O +irradiation B-Process +. O +Typical O +compositions O +of O +ODS B-Material +steels I-Material +include O +between O +9 B-Material +and I-Material +14at. I-Material +% I-Material +Cr I-Material +for O +oxidation B-Process +resistance O +( O +most O +commonly O +14at. O +%) O +; O +W B-Material +for O +solid O +solution O +hardening O +; O +Y2O3 B-Material +that O +is O +put O +into O +solid B-Material +solution I-Material +during O +the O +initial O +, O +mechanical B-Process +alloying I-Process +, O +process O +but O +then O +during O +consolidation B-Process +at O +high O +temperatures O +forms O +precipitates B-Material +; O +and O +Ti B-Material +to O +inhibit O +significant O +growth O +of O +the O +oxide B-Material +particles I-Material +; O +the O +balance B-Material +being O +made O +up O +of O +Fe B-Material +and I-Material +impurities I-Material +[ O +18 O +] O +. O +For O +this O +reason O +these O +steels B-Material +are O +often O +referred O +to O +as O +14YWT B-Material +, O +reflecting O +the O +constituent B-Material +elements I-Material +. O + +Zirconium B-Material +alloys I-Material +are O +used O +as O +cladding B-Material +to O +encapsulate O +fuel B-Material +pellets I-Material +in O +pressurised O +and O +boiling O +water B-Material +nuclear I-Material +reactors I-Material +. O +Research O +into O +oxidation B-Task +of I-Task +these I-Task +alloys I-Task +has O +been O +significant O +since O +the O +introduction O +of O +the O +material O +. O +However O +, O +the O +microstructure B-Process +and I-Process +electro-chemical I-Process +processes I-Process +during O +oxidation B-Process +are O +complex O +and O +many O +questions O +still O +remain O +unanswered O +. O +One O +such O +issue O +is O +the O +formation O +of O +lateral O +cracks O +near O +the O +metal-oxide B-Material +interface I-Material +. O +Small O +cracks O +have O +been O +seen O +to O +form O +continuously O +during O +oxidation B-Process +, O +with O +large O +scale O +networks O +of O +lateral O +cracks O +forming O +cyclically O +every O +∼ O +2μm O +of O +oxide O +growth O +. O +These O +networks O +of O +cracks O +can O +be O +correlated O +with O +acceleration O +in O +the O +corrosion B-Material +kinetics I-Material +[ O +1 O +– O +7 O +] O +. O +These O +lateral O +cracks O +might O +enable O +the O +link B-Material +up I-Material +of I-Material +nano I-Material +pores I-Material +along O +grain B-Material +boundaries O +perpendicular O +to O +the O +metal B-Material +/ I-Material +oxide I-Material +interface I-Material +as O +reported O +in O +[ O +8,9 O +] O +. O +Experiments O +using O +Synchrotron B-Process +X-Ray I-Process +Diffraction I-Process +( O +S-XRD B-Process +) O +by O +both O +Polatidis O +et O +al. O +and O +Petigny O +et O +al. O +, O +have O +separately O +shown O +that O +oxides B-Material +formed O +on O +Zircaloy-4 B-Material +are O +composed O +of O +monoclinic B-Material +and I-Material +stabilised I-Material +tetragonal I-Material +phases I-Material +, O +with O +an O +∼ B-Material +7 I-Material +% I-Material +reduction I-Material +in I-Material +the I-Material +tetragonal I-Material +phase I-Material +fraction O +from O +1 O +to O +3μm O +oxide O +growth O +[ O +4,10 O +] O +. O +One O +theory O +is O +that O +the O +lateral O +cracks O +may O +destabilise O +the O +tetragonal O +phase O +close O +to O +the O +metal-oxide B-Material +interface I-Material +. O +The O +phase B-Process +transformation I-Process +has O +an O +∼ O +6 O +% O +expansion O +associated O +with O +it O +, O +which O +could O +lead O +to O +fracture B-Process +perpendicular O +to O +the O +metal-oxide B-Material +interface I-Material +, O +thereby O +generating O +fast O +ingress B-Process +routes O +for O +oxygen B-Material +containing I-Material +species I-Material +[ O +11,12 O +] O +. O + +Spark B-Process +plasma I-Process +sintering I-Process +( O +SPS B-Process +) O +is O +a O +relatively O +new O +sintering-based B-Process +technique I-Process +[ O +17 O +] O +in O +which O +the O +powder B-Material +to O +be O +consolidated O +is O +loaded O +into O +an O +electrically B-Process +and I-Process +thermally I-Process +conductive I-Process +graphite I-Process +mould I-Process +and I-Process +a I-Process +large I-Process +DC I-Process +pulsed I-Process +current I-Process +( I-Process +1000 I-Process +– I-Process +5000A I-Process +) I-Process +is I-Process +applied I-Process +under I-Process +a I-Process +uniaxial I-Process +pressure I-Process +. O +When O +current O +passes O +through O +the O +graphite O +mould O +( O +and O +the O +powder B-Material +if O +it O +is O +electrically O +conductive O +) O +, O +the O +powder O +is O +heated O +both O +from O +the O +outside O +( O +the O +mould B-Material +acts O +as O +a O +heating B-Material +element I-Material +) O +and O +inside O +( O +due O +to O +Joule O +heating O +from O +the O +intrinsic O +electrical O +resistance O +of O +the O +powder B-Material +material I-Material +) O +. O +SPS B-Process +is O +characterised O +by O +very O +fast O +heating O +( O +up O +to O +2000 O +° O +C O +/ O +min O +) O +and O +cooling O +rates O +and O +short O +holding O +times O +( O +minutes O +) O +to O +achieve O +near O +theoretical O +density O +[ O +17 O +] O +. O +Thus O +SPS O +occupies O +a O +very O +different O +time O +– O +temperature O +– O +density O +space O +in O +powder B-Process +consolidation I-Process +maps I-Process +when O +compared O +with O +conventional B-Process +methods I-Process +, O +such O +as O +hot B-Process +pressing I-Process +sintering I-Process +and O +HIP B-Process +with O +ramp O +rate O +of O +50 O +– O +80 O +° O +C O +/ O +min O +and O +a O +few O +hours O +holding O +time O +. O +Although O +SPS B-Process +has O +been O +studied O +for O +a O +rapidly O +growing O +number O +of O +materials O +[ O +17 O +] O +, O +there O +are O +only O +a O +small O +number O +of O +studies O +on O +the O +fabrication B-Task +and I-Task +microstructural I-Task +characterisation I-Task +of I-Task +ODS I-Task +steels I-Task +processed I-Task +by I-Task +SPS I-Task +, O +briefly O +reviewed O +below O +. O + +To O +conclude O +, O +the O +electrochemical B-Task +reduction I-Task +of I-Task +uranium I-Task +dioxide I-Task +to O +uranium B-Material +metal I-Material +has O +been O +studied O +in O +a O +lithium B-Material +chloride I-Material +– I-Material +potassium I-Material +chloride I-Material +eutectic I-Material +molten I-Material +salt I-Material +at O +450 O +° O +C O +. O +Both O +electrochemical B-Process +and O +synchrotron B-Process +X-ray I-Process +techniques O +have O +been O +utilised O +to O +deduce B-Task +the I-Task +electrochemical I-Task +reduction I-Task +potential I-Task +, I-Task +mechanism I-Task +and I-Task +reduction I-Task +pathway I-Task +. O +The O +electrochemical O +reduction O +potential O +of O +the O +UO2 B-Material +| I-Material +U I-Material +couple I-Material +is O +dependent O +on O +the O +activity O +of O +oxide B-Material +ions I-Material +existing O +within O +the O +melt B-Material +. O +The O +electrochemical B-Process +reduction I-Process +of O +uranium B-Material +dioxide I-Material +to O +uranium B-Material +metal I-Material +seems O +to O +occur O +in O +a O +single O +, O +4-electron-step B-Process +, O +process O +; O +indicated O +by O +a O +single O +reduction O +peak O +( O +C1 O +) O +in O +the O +cyclic O +voltammograms O +and O +also O +by O +the O +exclusion O +of O +any O +other O +phases O +in O +the O +EDXD O +data O +. O +The O +electrochemical O +reduction O +may O +be O +impeded O +by O +an O +increase O +in O +oxo-acidity O +of O +the O +molten O +salt O +. O +That O +is O +, O +O2 O +− O +ions O +that O +are O +liberated O +by O +the O +electroreduction O +may O +not O +react O +at O +the O +counter O +electrode O +and O +, O +thus O +, O +not O +be O +removed O +from O +the O +molten O +salt O +. O +This O +could O +be O +due O +to O +the O +electrode O +geometry O +and O +/ O +or O +the O +inherent O +microstructure O +of O +the O +working O +electrode O +: O +a O +high O +tortuosity O +, O +for O +example O +, O +would O +impede O +the O +diffusion O +of O +O2 O +− O +ions O +out O +of O +the O +working O +electrode O +. O +This O +could O +then O +cause O +an O +increase O +in O +the O +activity O +of O +oxide O +ions O +existing O +within O +the O +melt O +and O +hence O +inhibit O +the O +electrochemical O +reduction O +– O +exploration O +of O +the O +microstructure O +of O +working O +electrodes O +will O +be O +the O +focus O +of O +future O +work O +. O + +The O +primary O +benefit O +of O +using O +a O +3D B-Process +model I-Process +is O +that O +it O +allows O +the O +application O +of O +anisotropic B-Task +material I-Task +properties I-Task +. O +As O +a O +hexagonal O +close O +packed O +lattice O +structure O +, O +a O +single O +zirconium B-Material +grain I-Material +is O +plastically O +anisotropic O +due O +to O +the O +difficulty O +of O +activating O +slip O +with O +a O +〈 O +c O +〉 O +component O +[ O +23 O +– O +26 O +] O +. O +Abaqus B-Process +allows O +this O +to O +be O +represented O +by O +setting O +plasticity B-Process +potential I-Process +ratios I-Process +. O +The O +anisotropic B-Material +elastic I-Material +and I-Material +plastic I-Material +constants I-Material +are O +shown O +in O +Table O +1 O +. O +Zirconium B-Material +alloys O +can O +often O +have O +a O +bimodal B-Process +basal I-Process +pole I-Process +distribution I-Process +, O +with O +a O +tilt O +on O +the O +basal O +normal O +or O +c O +direction O +of O +± O +30 O +° O +in O +the O +normal O +direction O +being O +quoted O +for O +recrystallized B-Material +Zircaloy-4 I-Material +[ O +27,28 O +] O +. O +However O +, O +for O +simplicity O +the O +basal O +normal O +or O +c O +direction O +has O +been O +taken O +as O +being O +parallel O +to O +the O +normal O +direction O +. O +As O +such O +the O +1 O +, O +2 O +and O +3 O +directions O +in O +Table O +1 O +correlate O +with O +the O +X O +, O +Y O +and O +Z O +global O +coordinate O +system O +for O +the O +3D B-Process +simulations I-Process +, O +with O +the O +3 O +direction O +correlating O +to O +the O +c O +direction O +of O +a O +zirconium B-Material +unit I-Material +lattice I-Material +. O +Table O +1 O +also O +shows O +the O +elastic O +properties O +incorporated O +into O +the O +simulations B-Process +. O +The O +oxide B-Material +layer I-Material +has O +been O +simulated O +as O +a O +purely B-Material +elastic I-Material +material I-Material +. O +Although O +it O +is O +known O +that O +the O +oxide B-Material +is O +strongly O +textured O +[ O +29 O +] O +, O +it O +is O +still O +simulated O +as O +a O +homogenous O +solid O +therefore O +isotropic B-Task +material I-Task +properties I-Task +have O +been O +used O +for O +the O +oxide B-Material +in O +all O +simulations B-Process +. O + +Zirconium B-Material +alloys I-Material +are O +commonly O +used O +as O +the O +fuel B-Material +cladding I-Material +for O +water B-Material +cooled I-Material +nuclear I-Material +fission I-Material +reactors I-Material +, O +mainly O +due O +to O +their O +low O +neutron O +cross-section O +, O +good O +corrosion O +resistance O +during O +normal O +operating O +conditions O +and O +sufficient O +mechanical O +strength O +[ O +1 O +] O +. O +Despite O +high O +corrosion O +resistance O +at O +normal O +operating O +temperatures O +( O +around O +300 O +° O +C O +) O +[ O +2 O +] O +, O +Zr B-Material +alloys I-Material +oxidise B-Process +very O +rapidly O +when O +exposed O +to O +temperatures O +a O +few O +hundred O +degrees O +higher O +. O +This O +is O +an O +exothermic B-Process +reaction I-Process +, O +which O +can O +further O +accelerate O +oxidation B-Process +and O +, O +at O +temperatures O +beyond O +1000 O +° O +C O +, O +potentially O +lead O +to O +disintegration B-Process +of I-Process +the I-Process +fuel I-Process +rods I-Process +, O +as O +highlighted O +during O +the O +Fukushima O +Daiichi O +nuclear O +accident O +. O +For O +this O +reason O +new O +research O +activities O +have O +been O +initiated O +worldwide O +to O +develop B-Task +accident I-Task +tolerant I-Task +fuels I-Task +( O +ATF B-Material +) O +. O +Additionally O +, O +ATFs O +could O +also O +provide O +further O +enhancements B-Task +in I-Task +corrosion I-Task +performance I-Task +during O +normal O +operating O +conditions O +enabling O +the O +development B-Task +of I-Task +fuel I-Task +assemblies I-Task +for O +very O +high O +burn-up O +. O + +In O +all O +these O +studies O +, O +the O +association O +between O +the O +transition O +and O +lateral O +cracking O +in O +the O +oxide B-Material +layer I-Material +depicts O +some O +interaction O +between O +the O +mechanical O +behaviour O +of O +the O +system O +, O +and O +its O +corrosion O +kinetics O +, O +but O +does O +not O +provide O +a O +clear O +understanding B-Task +of I-Task +the I-Task +morphology I-Task +of I-Task +the I-Task +metal I-Task +: I-Task +oxide I-Task +interface I-Task +during O +the O +corrosion B-Process +process I-Process +, O +at O +the O +nanometre O +level O +. O +Understanding B-Task +why I-Task +this I-Task +transition I-Task +behaviour I-Task +happens I-Task +is O +critical O +when O +modelling B-Task +the I-Task +rate I-Task +of I-Task +growth I-Task +of I-Task +oxide I-Task +, O +and O +therefore O +to O +the O +lifetime O +prediction O +of O +Zr B-Material +clads I-Material +, O +and O +ultimately O +to O +the O +safety O +of O +nuclear B-Material +power I-Material +reactors I-Material +. O +No O +model O +will O +be O +complete O +without O +a O +nanoscale O +understanding B-Task +of I-Task +what I-Task +is I-Task +going I-Task +on I-Task +during I-Task +oxidation I-Task +. O +Thus O +, O +it O +is O +essential O +that O +the O +oxide B-Material +scale I-Material +and O +the O +top B-Material +layers I-Material +of I-Material +the I-Material +metal I-Material +are O +studied O +at O +nanometre O +resolution O +to O +reveal O +the O +detailed O +structural B-Process +and I-Process +chemical I-Process +changes I-Process +associated O +with O +diffusion B-Process +of I-Process +oxygen I-Process +and O +the O +resulting O +oxidation B-Process +of I-Process +the I-Process +metal I-Process +. O +Whilst O +a O +number O +of O +techniques O +have O +been O +employed O +for O +this O +purpose O +, O +it O +is O +clear O +that O +various O +techniques O +within O +transmission B-Process +electron I-Process +microscopy I-Process +( O +TEM B-Process +) O +will O +be O +among O +the O +most O +versatile O +and O +informative O +for O +this O +purpose O +, O +although O +additional O +information O +can O +be O +added O +by O +techniques O +such O +as O +atom B-Process +probe I-Process +tomography I-Process +. O + +Solid B-Material +pieces I-Material +of O +23 O +– O +114 O +mg O +were O +further O +used O +to O +measure B-Process +the I-Process +enthalpy I-Process +increments I-Process +using O +a O +Setaram B-Process +Multi-detector I-Process +High I-Process +Temperature I-Process +Calorimeter I-Process +( O +MDHTC-96 B-Process +) O +using O +a O +drop B-Process +detector I-Process +. O +For O +more O +details O +about O +the O +technique O +we O +refer O +to O +our O +previous O +studies O +[ O +9,10 O +] O +. O +The O +measurements O +were O +carried O +out O +under O +an O +argon B-Material +atmosphere O +( O +with O +an O +oxygen B-Material +content O +of O +7 O +ppm O +) O +, O +using O +pure O +platinum B-Material +ingots I-Material +( O +64 O +– O +144 O +mg O +) O +of O +99.95 O +at O +% O +purity O +as O +a O +reference B-Material +material I-Material +. O +The O +temperature O +range O +of O +the O +experiment O +was O +from O +430.3 O +K O +to O +1088.8 O +K O +using O +steps O +of O +50 O +K O +. O +Each O +isothermal B-Process +run I-Process +consisted O +of O +2 B-Material +– I-Material +4 I-Material +drops I-Material +of I-Material +Bi2UO6 I-Material +samples I-Material +, O +each O +surrounded O +by O +two O +drops O +of O +platinum B-Material +from O +which O +the O +sensitivity O +of O +the O +device O +was O +determined O +. O +The O +drops O +were O +separated O +by O +time O +intervals O +of O +20 O +min O +, O +long O +enough O +to O +re-stabilize O +the O +monitored O +heat B-Process +flow I-Process +signal O +. O +Background B-Process +subtraction I-Process +and I-Process +peak I-Process +integration I-Process +were O +performed O +using O +commercially B-Material +available I-Material +software I-Material +for I-Material +data I-Material +processing I-Material +. O +The O +reported O +temperatures O +were O +corrected B-Process +in O +accordance O +with O +the O +calibration O +curve O +obtained O +prior O +to O +measurement O +using O +several O +high B-Material +purity I-Material +standard I-Material +metals I-Material +( O +Sn B-Material +, O +Pb B-Material +, O +Zn B-Material +, O +Al B-Material +, O +Ag B-Material +, O +Ni B-Material +) O +with O +various O +melting O +temperatures O +in O +order O +to O +cover O +the O +whole O +temperature O +range O +of O +the O +measurement O +. O +After O +drop O +calorimetric B-Process +measurements I-Process +at O +the O +maximum O +considered O +temperature O +, O +the O +material O +was O +subjected O +to O +a O +new O +XRD B-Process +measurement O +, O +confirming O +the O +stability O +of O +the O +compound B-Material +under O +the O +experimental O +conditions O +. O + +The O +fluence B-Task +of I-Task +each I-Task +capsule I-Task +was O +determined O +by O +using O +activation B-Material +monitor I-Material +sets I-Material +. I-Material +These O +monitor O +sets O +consist O +of O +different O +metal B-Material +wire I-Material +pieces I-Material +that O +have O +an O +activation O +reaction O +at O +a O +specific O +energy O +range O +. O +The O +different O +activation O +energies O +are O +chosen O +in O +such O +a O +way O +that O +the O +spectrum O +can O +be O +reconstructed O +. O +In O +BODEX O +, O +each O +capsule B-Material +contained O +a O +flux B-Material +monitor I-Material +set I-Material +on O +the O +‘ O +back O +side’ O +( O +as O +seen O +from O +the O +core O +) O +and O +one O +on O +the O +front O +side O +, O +positioned O +at O +the O +central O +height O +of O +the O +capsules B-Material +. O +Additionally O +, O +one O +detector B-Material +was O +placed O +at O +the O +top O +and O +one O +at O +the O +bottom O +, O +resulting O +in O +a O +total O +of O +6 O +monitor B-Material +sets O +per O +leg O +. O +The O +fluence O +in O +each O +capsule B-Material +was O +determined O +as O +the O +average O +between O +the O +two O +flux B-Material +monitor I-Material +located O +in O +each O +capsule B-Material +. O +The O +sets O +have O +been O +analysed O +by O +determining B-Task +the I-Task +activation I-Task +of I-Task +each I-Task +wire I-Task +piece I-Task +, O +which O +indicates O +the O +fluence B-Process +of O +a O +specific O +energy O +range O +. O +Table O +3 O +show O +the O +values O +of O +the O +fluences B-Process +for O +the O +two O +capsules B-Material +containing O +molybdenum B-Material +. O + +Following O +fission B-Process +, O +noble B-Material +gas I-Material +atoms I-Material +will O +be O +distributed O +in O +the O +fuel B-Process +matrix I-Process +initially O +accommodated O +at O +point B-Process +defects I-Process +trap I-Process +sites I-Process +, O +generally O +thought O +to O +be O +Schottky B-Process +trivacancy I-Process +defects I-Process +[ O +4,5,31 O +] O +. O +Diffusion B-Process +to O +either O +bubbles B-Material +or O +grain B-Material +boundaries I-Material +is O +then O +facilitated O +by O +associating O +a O +further O +uranium B-Material +vacancy O +defect O +for O +the O +gas B-Material +atom I-Material +to O +‘ B-Process +hop’ I-Process +into I-Process +, O +with O +the O +original O +vacancy O +then O +able O +to O +loop B-Process +around I-Process +to O +ensure O +continued O +diffusion B-Process +. O +The O +rate O +determining O +step O +in O +the O +process O +is O +not O +the O +migration B-Process +of O +the O +Xe B-Material +itself O +but O +rather O +the O +rearrangement B-Process +of O +the O +VU B-Material +defect O +to O +facilitate O +net O +Xe B-Process +diffusion I-Process +[ O +6 O +– O +8 O +] O +. O +Activation B-Process +energies O +for O +the O +overall O +process O +depend O +on O +the O +availability O +of O +the O +defect B-Process +trap I-Process +sites I-Process +, O +which O +in O +turn O +depends O +on O +the O +crystal B-Process +stoichiometry I-Process +. O +For O +Xe B-Material +diffusion O +in O +UO2 B-Material +− I-Material +x I-Material +, O +UO2 O +and O +UO2 B-Material ++ I-Material +x I-Material +the O +activation O +energies O +calculated O +using O +DFT B-Process +are O +7.04 O +– O +12.92 O +eV O +, O +4.15 O +– O +7.88 O +eV O +and O +1.38 O +– O +4.07 O +eV O +with O +the O +ranges O +reflecting O +the O +way O +the O +calculations O +were O +performed O +depending O +on O +the O +charge B-Process +states O +of O +the O +defects O +involved O +and O +the O +presence O +of O +a O +Jahn B-Process +– I-Process +Teller I-Process +distortion I-Process +[ O +7 O +] O +. O +Activation O +energies O +calculated O +using O +empirical B-Process +pair I-Process +potentials I-Process +can O +vary O +strongly O +depending O +on O +the O +choice O +of O +potential B-Process +. O +Govers O +et O +al. O +examined O +three O +different O +potentials B-Process +for O +UO2 B-Material +( O +those O +of O +Basak O +[ O +9 O +] O +, O +Jackson O +[ O +10 O +] O +and O +Morelon O +[ O +11 O +]) O +coupled O +with O +different O +parameterisations O +for O +the O +U B-Material +– I-Material +Xe I-Material +and O +O B-Material +– I-Material +Xe I-Material +interactions O +from O +Geng O +[ O +12 O +] O +and O +Nicoll O +[ O +13 O +] O +and O +recommend O +values O +of O +6.5 O +eV O +, O +4.5 O +eV O +and O +2.4 O +eV O +[ O +6 O +] O +for O +the O +different O +stoichiometric O +regimes O +in O +very O +good O +agreement O +with O +the O +experimental O +values O +of O +6.0 O +eV O +, O +3.9 O +eV O +and O +1.7 O +eV O +respectively O +[ O +14 O +] O +. O + +Ferritic B-Material +and I-Material +martensitic I-Material +steels I-Material +are O +candidate O +materials O +for O +use O +in O +nuclear B-Material +reactors I-Material +[ O +1,2 O +] O +. O +The O +transmutation-created B-Material +inert I-Material +gas I-Material +, O +especially O +He B-Material +, O +plays O +an O +important O +role O +in O +the O +microstructural B-Task +evolution I-Task +of I-Task +these I-Task +steels I-Task +under I-Task +neutron I-Task +irradiation I-Task +. O +In O +a O +previous O +paper O +[ O +3 O +] O +the O +mechanisms B-Task +by I-Task +which I-Task +He I-Task +in I-Task +a I-Task +perfect I-Task +body-centred-cubic I-Task +( I-Task +bcc I-Task +) I-Task +Fe I-Task +lattice I-Task +, I-Task +can I-Task +agglomerate I-Task +into I-Task +bubbles I-Task +was O +discussed O +. O +It O +was O +shown O +that O +small O +He B-Material +interstitial I-Material +clusters I-Material +are O +highly O +mobile O +but O +become O +effectively O +pinned O +with O +the O +emission O +of O +Fe B-Material +interstitials I-Material +when O +the O +clusters O +contain O +5 O +or O +more O +He B-Material +atoms I-Material +. O +Small O +bubbles B-Material +up O +to O +around O +1.5 O +nm O +in O +diameter O +can O +easily O +form O +at O +room O +temperature O +from O +such O +seed O +points O +but O +larger O +bubbles O +are O +more O +difficult O +to O +form O +by O +diffusion B-Process +alone O +due O +to O +the O +induced B-Process +strain I-Process +in O +the O +bcc B-Material +lattice I-Material +which O +increases O +the O +energy O +barriers O +for O +diffusion B-Material +towards O +the O +bubbles B-Material +whilst O +reducing O +them O +in O +a O +direction O +away O +from O +the O +bubbles O +. O +Subsequent O +bubble B-Material +enlargement O +can O +then O +only O +occur O +either O +through O +increased O +temperature O +or O +by O +radiation B-Process +induced I-Process +mechanisms I-Process +which O +increase O +the O +number O +of O +vacancies O +in O +the O +bubble B-Material +and O +reduce B-Task +the I-Task +lattice I-Task +strain I-Task +. O +Emission B-Process +of I-Process +interracial I-Process +loops I-Process +from O +such O +a O +bubble B-Material +was O +not O +observed O +in O +molecular B-Process +dynamics I-Process +simulations I-Process +. O + +An O +increase O +of O +neutron B-Process +leakage I-Process +from O +the O +core B-Material +region I-Material +can O +be O +achieved O +through O +modifications B-Process +in I-Process +the I-Process +core I-Process +geometry I-Process +( O +usually O +by O +adopting O +a O +pan-cake B-Process +geometry I-Process +of I-Process +the I-Process +active I-Process +core I-Process +region I-Process +at O +the O +expense O +of O +the O +general O +neutron B-Material +economy O +) O +. O +Extensive O +studies O +determined O +a O +set O +of O +core B-Task +design I-Task +modifications I-Task +that I-Task +optimised I-Task +the I-Task +total I-Task +sodium I-Task +void I-Task +reactivity I-Task +( O +becoming O +less O +positive O +) O +. O +Among O +the O +most O +efficient O +design B-Process +solutions I-Process +identified O +is O +an O +enlarged B-Process +sodium I-Process +plenum I-Process +above O +the O +active O +core B-Material +region O +in O +combination O +with O +an O +absorber B-Process +layer I-Process +above O +the O +sodium B-Material +plenum I-Material +( O +to O +reduce B-Task +neutron I-Task +backscattering I-Task +from I-Task +the I-Task +reflector I-Task +region I-Task +above I-Task +the I-Task +plenum I-Task +) O +. O +Fig. O +19 O +shows O +the O +combined O +effect O +of O +different O +upper B-Material +plenum I-Material +thicknesses O +of O +the O +absorber B-Material +and I-Material +boron I-Material +layers I-Material +. O +It O +can O +be O +observed O +that O +the O +sequential O +increase B-Process +of I-Process +the I-Process +layer I-Process +'s I-Process +thickness I-Process +converge O +to O +an O +asymptotic O +value O +of O +reactivity B-Process +reduction I-Process +slightly O +over O +800pcm O +. O +The O +pair O +of O +values O +selected O +was O +60cm O +for O +the O +sodium B-Material +plenum I-Material +and O +30cm O +for O +the O +boron B-Material +layer I-Material +. O +These O +modifications O +implied O +a O +considerable O +increase B-Process +in I-Process +the I-Process +sub-assembly I-Process +length I-Process +that O +was O +compensated O +by O +reducing B-Task +the I-Task +upper I-Task +axial I-Task +reflector I-Task +width I-Task +( O +Sun O +et O +al. O +, O +2013 O +) O +. O + +The O +design O +, O +and O +the O +temperature O +reached O +in O +the O +sample B-Material +holders I-Material +, O +guarantees O +that O +the O +Na B-Material +remains O +liquid O +during O +operation O +to O +improve B-Task +the I-Task +heating I-Task +transfer I-Task +and O +avoiding O +solid B-Process +formation I-Process +( O +too O +cold O +working O +temperature O +) O +or O +sodium B-Material +boiling O +( O +too O +hot O +working O +temperature O +) O +. O +The O +temperature O +above O +and O +just O +below O +the O +Na B-Material +surface I-Material +will O +be O +monitored B-Process +by I-Process +six I-Process +dedicated I-Process +thermocouples I-Process +. O +In O +order O +to O +prevent O +oxidation B-Process +of O +the O +Na B-Material +, O +the O +plenum O +of O +the O +1st O +containment O +is O +filled O +with O +high-purity B-Material +He I-Material +at O +0.1MPa O +, O +sealed O +after O +final O +assembly O +and O +kept O +closed O +during O +in-pile O +operation O +( O +no O +gas B-Process +circulation I-Process +in O +the O +1st O +containment O +) O +. O +The O +heat O +generated O +by O +fission B-Process +and I-Process +gamma I-Process +absorption I-Process +in O +the O +materials O +will O +be O +radially O +dissipated O +through O +the O +Na B-Material +bath I-Material +, O +the O +structural O +materials O +and O +the O +gas B-Material +gaps O +by O +conduction O +and O +radiation O +to O +the O +downstream O +primary O +coolant O +of O +the O +TRIO B-Material +wet I-Material +channel I-Material +. O + +Geomagnetic B-Process +jerks I-Process +are O +conspicuous O +yet O +poorly O +understood O +phenomena O +of O +Earth B-Material +’s I-Material +magnetic I-Material +field I-Material +, O +motivating O +investigations O +of O +their O +morphology O +and O +the O +theory O +behind O +their O +origins O +. O +Jerks B-Process +are O +most O +commonly O +defined O +by O +their O +observed O +form O +at O +a O +single O +observatory O +as O +‘ O +V’ O +shapes O +in O +a O +single O +component O +of O +the O +geomagnetic B-Process +secular I-Process +variation I-Process +( O +SV B-Process +) O +, O +the O +first O +time O +derivative O +of O +the O +main B-Material +magnetic I-Material +field I-Material +( O +MF B-Material +) O +. O +The O +times O +of O +the O +gradient B-Process +changes I-Process +, O +which O +separate O +linear O +trends O +of O +several O +years O +, O +have O +associated O +step O +changes O +in O +the O +second O +time O +derivative O +of O +the O +MF B-Material +( O +secular B-Process +acceleration I-Process +( O +SA B-Process +)) O +and O +impulses O +in O +the O +third O +time O +derivative O +. O +The O +‘ O +V’ O +shape O +SV O +definition O +of O +jerks B-Process +includes O +an O +implicit O +expectation O +of O +a O +‘ B-Process +large’ I-Process +magnitude I-Process +step I-Process +change I-Process +in O +the O +gradient O +without O +definition O +of O +this O +scale O +or O +its O +threshold O +value O +other O +than O +the O +basic O +need O +for O +it O +to O +be O +observable O +in O +the O +data O +above O +the O +highly O +variable O +background O +noise O +. O +Jerks B-Process +can O +be O +described O +by O +their O +amplitude O +, O +that O +is O +, O +the O +difference O +in O +the O +gradients O +of O +the O +two O +linear O +SV B-Process +segments I-Process +about O +a O +jerk B-Process +, O +A O += O +a2-a1 O +, O +where O +a2 O +is O +the O +gradient O +after O +the O +jerk O +and O +a1 O +is O +the O +gradient O +before O +the O +jerk O +. O +This O +measure O +is O +essentially O +the O +best O +fit O +SA B-Process +change I-Process +across O +a O +jerk B-Process +. O +Jerk B-Process +amplitude I-Process +is O +thus O +positive O +for O +a O +positive O +step O +in O +SA B-Process +and O +negative O +for O +a O +negative O +step O +. O +Here O +we O +do O +not O +consider O +spatial O +extent O +in O +our O +definition O +and O +refer O +to O +individual O +features O +in O +one O +field O +component O +of O +a O +given O +observatory O +time O +series O +as O +a O +single O +jerk B-Process +. O + +Seismic B-Process +tomography I-Process +is O +a O +powerful O +tool O +to O +investigate B-Task +the I-Task +deep I-Task +structure I-Task +under I-Task +the I-Task +volcanoes I-Task +. O +With O +the O +recently O +rapid O +development O +of O +Chinese O +provincial B-Process +seismic I-Process +networks I-Process +( O +Zheng O +et O +al. O +, O +2009 O +, O +2010 O +) O +and O +some O +portable B-Process +seismic I-Process +arrays I-Process +( O +Hetland O +et O +al. O +, O +2004 O +; O +Duan O +et O +al. O +, O +2009 O +; O +Lei O +et O +al. O +, O +2012b O +) O +around O +the O +volcanoes O +, O +it O +has O +become O +possible O +to O +image B-Process +the I-Process +detailed I-Process +3-D I-Process +velocity I-Process +structure I-Process +under O +some O +of O +these O +volcanoes O +, O +where O +seismic B-Material +stations I-Material +are O +densely O +spaced O +. O +In O +this O +overview O +, O +we O +synthesize B-Task +the I-Task +results I-Task +from I-Task +the I-Task +deep I-Task +seismic I-Task +images I-Task +of I-Task +the I-Task +upper I-Task +mantle I-Task +under O +the O +Changbaishan B-Material +, I-Material +Tengchong I-Material +, I-Material +Hainan I-Material +volcanoes I-Material +as I-Material +well I-Material +as I-Material +the I-Material +Datong I-Material +volcano O +( O +Fig. O +1 O +) O +. O +We O +also O +evaluate O +the O +advantages B-Task +of I-Task +recently I-Task +updated I-Task +seismic I-Task +tomographic I-Task +techniques I-Task +for O +deriving O +potential O +information O +. O +This O +work O +updates O +a O +previous O +review O +of O +Zhao O +and O +Liu O +( O +2010 O +) O +on O +this O +topic O +, O +with O +more O +detailed O +synthesis O +of O +all O +the O +available O +information O +. O + +Microhardness B-Task +can O +be O +related O +to O +other O +macroscopic O +mechanical O +properties O +such O +as O +yield O +stress O +, O +σ O +, O +and O +elastic O +modulus O +, O +E O +, O +both O +derived O +from O +compression B-Process +testing I-Process +. O +For O +work-hardened B-Material +metals I-Material +, O +Tabor O +derived B-Process +a I-Process +direct I-Process +proportionality I-Process +between O +hardness O +and O +compressive O +yield O +stress O +: O +H O +≈ O +3σ O +[ O +20 O +] O +. O +However O +, O +it O +was O +soon O +realized O +that O +Tabor O +'s O +relationship O +only O +applies O +to O +materials B-Material +that I-Material +exhibit I-Material +full I-Material +plasticity I-Material +[ O +9,10 O +] O +. O +Deviations B-Task +from I-Task +this I-Task +relationship I-Task +have O +been O +reported O +for O +a O +number O +of O +metals O +, O +glasses B-Material +and O +polymers B-Material +where I-Material +the I-Material +elastic I-Material +strains I-Material +are O +non-negligible O +[ O +9 O +] O +. O +Hence O +, O +the B-Task +different I-Task +expressions I-Task +describing I-Task +the I-Task +correlation I-Task +of I-Task +hardness I-Task +with I-Task +conventional I-Task +macroscopic I-Task +mechanical I-Task +properties I-Task +rely O +on O +the O +validity O +of O +the O +above-mentioned O +elasto-plastic O +models O +. O +In O +this O +way O +, O +hardness O +and O +yield O +stress O +no O +longer O +hold B-Process +direct I-Process +proportionality I-Process +but I-Process +their I-Process +relationship I-Process +depends O +on O +the O +specific B-Task +material I-Task +properties I-Task +, I-Task +such O +as O +Poisson O +'s O +ratio O +and O +elastic O +modulus O +[ O +9,11 O +– O +13 O +] O +. O +It O +has O +been O +shown O +that O +these O +elasto-plastic O +models O +not O +only O +satisfactorily O +explain O +an O +H O +/ O +σ O +ratio O +of O +≈ O +2 O +for O +a O +number O +of O +polyethylene B-Material +materials I-Material +of O +different O +nature O +, O +but O +also O +theoretically O +account O +for O +the O +range O +of O +H O +/ O +E O +ratios O +experimentally O +determined O +[ O +21 O +] O +. O + +Up O +to O +now O +, O +morphological B-Task +studies I-Task +of O +the O +multi-component B-Material +polymeric I-Material +materials I-Material +have O +been O +carried O +out O +by O +various O +microscopic B-Process +and I-Process +scattering I-Process +methods I-Process +. O +Optical B-Material +microscopes I-Material +, O +transmission B-Material +electron I-Material +microscopes I-Material +( O +TEMs B-Material +) O +, O +scanning B-Material +electron I-Material +microscopes I-Material +( O +SEMs B-Material +) O +and O +atomic B-Material +force I-Material +microscopes I-Material +( O +AFMs B-Material +) O +are O +commercially O +available O +and O +widely O +used O +. O +The O +biggest O +advantage O +of O +microscopy B-Task +is O +that O +they O +provide O +intuitive O +real-space O +representations O +of O +the O +various O +morphologies O +. O +However O +, O +when O +it O +comes O +to O +“ O +measurements O +” O +, O +especially O +in O +a O +quantitative O +way O +, O +microscopy O +sometimes O +lacks O +a O +statistical O +accuracy O +due O +to O +the O +small O +field O +of O +view O +. O +In O +contrast O +, O +the O +scattering B-Process +methods I-Process +provide O +much O +a O +superior O +statistical O +accuracy O +than O +that O +of O +microscopy B-Task +simply O +because O +the O +observation O +volume O +is O +larger O +than O +that O +of O +the O +microscopes B-Material +. O +One O +must O +remember O +, O +however O +, O +that O +the O +scattering B-Process +methods I-Process +normally O +require O +“( B-Process +hypothesized I-Process +) I-Process +models I-Process +” I-Process +for O +data B-Task +analysis I-Task +in O +advance O +: O +They O +do O +not O +provide O +an O +intuitive O +insight O +into O +the O +morphologies O +as O +does O +microscopy B-Task +. O +After O +all O +, O +for O +the O +complete O +characterization O +of O +a O +specific O +morphology O +, O +one O +may O +need O +to O +first O +know O +the O +morphologies O +from O +the O +microscopy O +and O +subsequently O +to O +evaluate O +the O +structural O +parameters O +by O +scattering O +on O +the O +basis O +of O +the O +morphology O +; O +the O +two O +methods O +are O +complementary O +. O + +We O +deal O +with O +the O +intensity O +scattered O +by O +a O +random O +mixture O +of O +deuterated B-Process +/ O +hydrogenated B-Process +PE B-Material +chains I-Material +. O +The O +algorithm O +used O +by O +us O +to O +evaluate O +the O +Kratky B-Material +plots I-Material +by O +sets O +of O +parallel B-Material +polymer I-Material +stems I-Material +is O +very O +simplified O +. O +We O +checked O +it O +to O +be O +adequate O +in O +the O +reciprocal O +coordinate O +range O +under O +investigation O +[ O +0 O +< O +q O +(= O +4πsinθ O +/ O +λ O +)≤ O +0.25Å O +− O +1 O +] O +comparing O +the O +results O +with O +more O +precise O +calculations B-Task +. O +The O +scattering B-Material +centres I-Material +are O +identified O +with O +pseudo-atoms B-Material +repeating O +after O +a O +constant O +distance O +of O +1.27Å O +along O +straight O +lines O +coinciding O +with O +the O +stem B-Material +axes I-Material +, O +100 O +scattering B-Process +centres O +being O +placed O +on O +each O +stem O +; O +the O +scattering O +by O +atoms B-Material +belonging O +to O +chain B-Material +folds I-Material +is O +neglected O +. O +The O +parallel B-Material +stem I-Material +axes I-Material +are O +disposed O +according O +to O +a O +hexagonal O +setting O +– O +a O +rough O +approximation O +to O +the O +monoclinic O +, O +pseudo-hexagonal O +structure O +of O +PE B-Material +– O +and O +the O +scattering O +centres O +have O +the O +same O +axial O +coordinates O +in O +all O +the O +stems B-Material +. O +Defining O +an O +integer O +i O +going O +from O +1 O +to O +the O +total O +number O +ns O +· O +100 O +of O +scattering B-Material +centres I-Material +, O +we O +have O +( O +q O +< O +1 O +) O +[ O +9 O +]( O +1A O +) O +q2 O +· O +I O +( O +q O +)= O +C O +·( O +bH O +− O +bD O +) O +2 O +∑ O +i O += O +1ns O +· O +100 O +∑ O +j O += O +1ns O +· O +1004πqsin O +( O +q O +· O +dij O +) O +dij O +; O +dij2 O += O +Δij2 O ++( O +zj O +− O +zi O +) O +2 O +; O +q O += O +2πsinθλwhere O +bH O +, O +bD O +respectively O +are O +the O +scattering O +lengths O +of O +hydrogen B-Material +and O +deuterium B-Material +, O +dij O +is O +the O +distance O +between O +C B-Material +atoms I-Material +, O +2θ O +is O +the O +diffraction O +angle O +and O +λ O +the O +wavelength O +. O +The O +i-th O +C O +atom O +coordinate O +along O +the O +stem O +axis O +is O +zi O +and O +Δij O +is O +the O +distance O +between O +the O +stem O +axes O +where O +the O +atoms O +i O +and O +j O +belong O +. O +For O +all O +the O +stems B-Material +we O +have O +the O +same O +set O +of O +zi O +coordinates O +. O +The O +sum O +in O +Eq O +. O +( O +1A O +) O +is O +extended O +to O +all O +the O +stems O +of O +the O +crystalline B-Material +domain O +, O +see O +Figs. O +2 O +and O +10 O +for O +examples O +. O + +With O +ever O +increasing O +computer O +performance O +, O +simulations B-Process +in O +much O +larger O +systems O +have O +become O +feasible O +. O +However O +, O +full-atomistic B-Process +approaches I-Process +to O +polymer B-Task +crystallization I-Task +need O +extremely O +large O +computer O +power O +even O +in O +the O +case O +of O +simple B-Material +polymers I-Material +, O +and O +appropriate B-Process +modeling I-Process +or O +coarse-graining B-Process +of I-Process +the I-Process +system I-Process +is O +imperative O +. O +From O +a O +series O +of O +work O +on O +the O +development O +of O +coarse-grained B-Process +models I-Process +for O +polymers B-Material +, O +Mayer O +and O +Muller-Plathe O +have O +build O +up O +a O +model O +of O +poly B-Material +( I-Material +vinyl I-Material +alcohol I-Material +) I-Material +( O +PVA B-Material +) O +for O +studying O +early O +stage O +of O +crystallization B-Process +. O +They O +investigated O +the O +emergence O +of O +crystalline B-Material +order O +from O +the O +isotropic B-Material +melt I-Material +by O +rapid B-Process +quenching I-Process +[ O +51,52 O +] O +. O +They O +could O +reproduce O +many O +elementary O +processes O +of O +homogenous B-Process +nucleation I-Process +that O +showed O +good O +correspondence O +with O +experiments O +and O +other O +simulations B-Process +, O +in O +temperature O +dependence O +of O +lamella B-Material +thickness O +, O +structure O +of O +fold B-Material +surface I-Material +, O +etc O +. O +In O +their O +work O +, O +they O +neglected O +long-range O +force O +( O +van O +der O +Waals O +attraction O +) O +to O +accelerate O +computation O +. O +Their O +model O +has O +the O +energy O +contribution O +due O +to O +intrachain B-Process +interactions I-Process +only O +and O +the O +dominant O +driving O +force O +for O +crystallization B-Process +is O +entropic O +, O +which O +seems O +to O +ignore O +dominant O +driving O +force O +for O +polymer B-Process +crystallization I-Process +in O +conventional O +sense O +. O +However O +, O +their O +work O +is O +reminiscent O +of O +the O +classical B-Process +solid I-Process +– I-Process +liquid I-Process +transition I-Process +in O +systems O +of O +repulsive B-Material +spherical I-Material +atoms I-Material +[ O +53 O +] O +and O +poses O +an O +intriguing O +problem O +as O +to O +the O +intrinsic O +driving O +force O +for O +polymer B-Process +crystallization I-Process +. O + +SPM B-Process +, O +and O +AFM B-Process +in O +particular O +, O +has O +been O +widely O +applied O +to O +questions B-Task +in I-Task +polymer I-Task +crystallization I-Task +. O +The O +technique O +has O +several O +strengths O +that O +make O +it O +ideally O +suited O +for O +such O +studies O +. O +It O +is O +a O +high B-Process +resolution I-Process +technology I-Process +, O +routinely O +resolving B-Process +sub I-Process +10nm I-Process +features I-Process +[ O +13,14 O +] O +, O +and O +hence O +allowing O +the O +fundamental O +length O +scale O +of O +the O +polymer B-Material +lamellar I-Material +crystal I-Material +, O +its O +thickness O +, O +to O +be O +observed O +. O +AFM B-Process +requires O +no O +staining B-Process +or O +metal B-Process +coating I-Process +of O +the O +sample O +, O +so O +sample B-Process +preparation I-Process +is O +relatively O +straightforward O +. O +Also O +, O +it O +is O +non-destructive O +under O +many O +circumstances O +. O +This O +allows O +images O +to O +be O +obtained O +while O +a O +process O +such O +as O +crystal B-Material +growth O +or O +melting B-Process +is O +occurring O +, O +giving O +time-resolved B-Material +data I-Material +at O +lamellar O +or O +sub-lamellar O +resolution O +[ O +15 O +– O +18 O +] O +. O +It O +is O +this O +final O +feature O +that O +provides O +many O +of O +the O +most O +exciting O +possibilities O +of O +AFM B-Process +for O +studying B-Task +polymer I-Task +crystallization I-Task +, O +as O +it O +is O +now O +possible O +to O +watch O +crystal B-Process +growth I-Process +, O +crystal B-Process +melting I-Process +, O +and O +re-organisations B-Process +within I-Process +crystals I-Process +at I-Process +the I-Process +lamellar I-Process +scale I-Process +, O +seeing O +how O +structure O +evolves O +and O +local O +conditions O +influence O +kinetics O +. O +AFM B-Material +has O +a O +wide O +range O +of O +different O +measuring O +modes O +, O +and O +, O +with O +the O +ever O +increasing O +number O +of O +functional O +semicrystalline B-Material +polymers I-Material +available O +( O +e.g. O +[ O +19 O +]) O +, O +the O +breadth O +of O +experiments O +that O +can O +be O +carried O +out O +with O +a O +single O +machine O +is O +also O +one O +of O +the O +techniques O +attractions O +. O + +Inverse B-Process +miniemulsion I-Process +polymerization I-Process +is O +a O +water-in-oil B-Process +( O +W B-Process +/ I-Process +O I-Process +) O +heterogeneous B-Process +polymerization I-Process +process I-Process +that O +forms O +kinetically B-Material +stable I-Material +macroemulsions I-Material +at O +, O +below O +, O +or O +around O +the O +critical B-Material +micellar I-Material +concentration I-Material +( O +CMC B-Material +) O +. O +This O +process O +contains O +aqueous B-Material +droplets I-Material +( O +including O +water-soluble B-Material +monomers I-Material +) O +stably O +dispersed O +, O +with O +the O +aid O +of O +oil-soluble B-Material +surfactants I-Material +, O +in O +a O +continuous O +organic B-Material +medium I-Material +. O +Stable B-Material +inverse I-Material +miniemulsions I-Material +are O +formed O +under O +high O +shear O +by O +either O +a O +homogenizer B-Material +or O +a O +high B-Material +speed I-Material +mechanical I-Material +stirrer I-Material +. O +Oil-soluble B-Material +nonionic I-Material +surfactants I-Material +with O +hydrophilic-lipophilic O +balance O +( O +HLB O +) O +value O +around O +4 O +are O +used O +to O +implement B-Task +colloidal I-Task +stability I-Task +of I-Task +the I-Task +resulting I-Task +inverse I-Task +emulsion I-Task +. O +Upon O +addition O +of O +radical B-Material +initiators I-Material +, O +polymerization B-Process +occurs O +within O +the O +aqueous B-Material +droplets I-Material +producing O +colloidal B-Material +particles I-Material +( O +Fig. O +2 O +) O +[ O +83 O +] O +. O +Several O +reports O +have O +demonstrated O +the O +preparation O +of O +stable B-Material +particles I-Material +of I-Material +hydrophilic I-Material +and I-Material +water-soluble I-Material +polymers I-Material +[ O +86 O +– O +89 O +] O +, O +polyaniline B-Material +nanoparticles I-Material +[ O +90 O +] O +, O +and O +organic B-Material +– I-Material +inorganic I-Material +hybrid I-Material +particles I-Material +[ O +91 O +– O +93 O +] O +. O +This O +method O +also O +allows O +for O +the O +preparation B-Process +of I-Process +crosslinked I-Process +microgels I-Process +in I-Process +the I-Process +presence I-Process +of I-Process +difunctional I-Process +crosslinkers I-Process +[ O +27,94 O +– O +100 O +] O +. O +In O +addition O +, O +CRP B-Process +techniques I-Process +including O +ATRP B-Process +[ O +78,79,82,101,102 O +] O +and O +RAFT B-Process +[ O +103 O +] O +in O +inverse B-Material +miniemulsion I-Material +have O +been O +explored O +to O +prepare O +well-defined O +nanoparticles B-Material +and O +nanogels B-Material +. O + +In O +contrast O +with O +polymers B-Material +, O +which O +are O +typically O +synthesized B-Process +in I-Process +the I-Process +liquid I-Process +phase I-Process +, O +SWNTs B-Material +are O +produced B-Process +through I-Process +a I-Process +variety I-Process +of I-Process +synthesis I-Process +techniques I-Process +that O +typically O +involve O +the B-Process +reaction I-Process +of I-Process +a I-Process +gaseous I-Process +carbon I-Process +feedstock I-Process +to I-Process +form I-Process +the I-Process +nanotubes I-Process +on I-Process +catalyst I-Process +particles I-Process +. O +MWNTs B-Task +were O +first O +observed B-Process +in I-Process +arc I-Process +discharge I-Process +fullerene I-Process +reactors I-Process +[ O +1,26 O +] O +; O +this B-Task +technique I-Task +was O +later O +adapted O +to O +produce O +SWNTs B-Material +[ O +3 O +] O +. O +Similarly O +, O +the B-Process +fullerene I-Process +production I-Process +method I-Process +of I-Process +laser I-Process +ablation I-Process +[ O +27 O +] O +was O +adapted O +to O +produce O +SWNTs B-Material +(∼ O +1.4nm O +diameter O +) O +in O +larger O +quantities O +on O +metal B-Material +catalyst I-Material +particles I-Material +[ O +28 O +– O +30 O +] O +. O +A O +number O +of O +chemical B-Process +vapor I-Process +deposition I-Process +( O +CVD B-Process +) O +processes O +have O +been O +developed O +to O +grow O +SWNTs B-Material +and O +MWNTs B-Material +, O +all O +involving O +the B-Process +reaction I-Process +of I-Process +a I-Process +gaseous I-Process +carbon I-Process +compound I-Process +as I-Process +feedstock I-Process +. O +These O +processes O +include O +fluidized B-Process +bed I-Process +[ O +31 O +] O +, O +“ B-Process +carpet I-Process +” I-Process +growth I-Process +of I-Process +carbon I-Process +nanotubes I-Process +( I-Process +CNTs I-Process +) I-Process +from I-Process +catalyst I-Process +particles I-Process +embedded I-Process +in I-Process +a I-Process +substrate I-Process +[ O +32 O +– O +35 O +] O +as O +shown O +in O +Fig. O +3 O +, O +and O +“ B-Process +catalytic I-Process +gas I-Process +flow I-Process +CVD I-Process +” I-Process +[ O +36,37 O +] O +. O +One O +of O +the B-Task +most I-Task +effective I-Task +, I-Task +cheap I-Task +, I-Task +and I-Task +scalable I-Task +CVD I-Task +techniques I-Task +is O +the O +HiPco B-Process +( I-Process +high-pressure I-Process +CO I-Process +) I-Process +process I-Process +, O +which O +does B-Process +not I-Process +use I-Process +pre-formed I-Process +catalyst I-Process +particles I-Process +unlike O +most O +other O +CVD B-Process +techniques I-Process +[ O +38 O +] O +. O + +ELRs B-Material +are O +particularly O +attractive O +for O +the O +synthesis B-Process +of I-Process +block I-Process +copolymers I-Process +that O +self-assemble O +into O +polymer B-Material +nanostructures I-Material +such O +as O +micelles B-Material +. O +The O +first O +work O +in O +this O +area O +involved O +an O +elastin-mimetic B-Material +di-block I-Material +copolymer I-Material +containing O +VPGEG B-Material +–( I-Material +IPGAG I-Material +) I-Material +4 I-Material +and O +VPGFG B-Material +–( I-Material +IPGVG I-Material +) I-Material +4 I-Material +as O +the O +hydrophilic B-Material +and I-Material +hydrophobic I-Material +blocks I-Material +, O +respectively O +[ O +49 O +] O +. O +The O +resulting O +micelles B-Material +were O +studied O +by O +dynamic B-Process +light I-Process +scattering I-Process +( O +DLS B-Process +) O +and O +DSC B-Process +was O +used O +to O +measure O +the O +enthalpy O +of O +self-assembly B-Process +. O +A O +tri-block B-Material +copolymer I-Material +was O +subsequently O +synthesized O +and O +the O +TEM B-Material +images I-Material +of O +this O +polymer B-Material +showed O +that O +it O +formed O +spherical B-Material +aggregates I-Material +[ O +50 O +] O +. O +Other O +multivalent B-Material +spherical I-Material +micelles I-Material +have O +been O +obtained O +from O +linear B-Material +elastin-like I-Material +AB I-Material +di-block I-Material +copolymers I-Material +in O +the O +temperature O +range O +37 O +– O +42 O +° O +C O +with O +the O +aim O +of O +targeting B-Task +cancer I-Task +cells I-Task +[ O +51 O +] O +. O +Bidwell O +et O +al. O +have O +also O +exploited O +the O +ELRs B-Material +for O +its O +ability O +to O +serve O +as O +macromolecular B-Material +carriers I-Material +for O +thermally B-Task +targeted I-Task +delivery I-Task +of I-Task +drugs I-Task +. O +Attachment O +of O +doxorubicin B-Material +to O +ELR-based B-Material +system I-Material +showed O +enhanced O +cytotoxicity B-Process +in O +uterine B-Material +sarcoma I-Material +cells I-Material +when O +aggregation B-Process +was O +induced O +with O +hyperthermia B-Process +[ O +52 O +] O +. 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O + +Note O +that O +the O +quantitative B-Task +introduction I-Task +of I-Task +a I-Task +reactive I-Task +functionality I-Task +into I-Task +the I-Task +polymer I-Task +chain I-Task +end I-Task +can O +be O +easily O +achieved O +by O +adopting O +the O +living B-Process +ROMP I-Process +technique I-Process +especially O +using O +the O +Schrock B-Material +type I-Material +molybdenum I-Material +alkylidene I-Material +initiator I-Material +[ O +7,12,21,61 O +– O +65 O +] O +. 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O +An O +equilibrium O +between O +coordination B-Process +and O +dissociation B-Process +of O +PR3 B-Material +should O +be O +present O +even O +in O +the O +propagation B-Process +process I-Process +, O +and O +replacement O +of O +halogen B-Material +with O +the O +other O +anionic B-Material +ligand I-Material +( O +and O +/ O +or O +replacement O +of O +PR3 B-Material +with O +the O +other O +neutral B-Material +donor I-Material +ligands I-Material +/ I-Material +substrates I-Material +) O +can O +also O +be O +considered O +as O +the O +probable O +side O +reactions O +. 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O +ROM B-Material +polymers I-Material +have O +been O +tested O +as O +matrix B-Material +materials I-Material +for O +the O +oxygen B-Material +sensing O +phosphorescent B-Material +complex I-Material +platinum I-Material +tetrakis I-Material +( I-Material +pentafluorophenyl I-Material +) I-Material +porphyrin I-Material +. O +A O +correlation O +between O +the O +nature O +of O +the O +ROM B-Material +polymer I-Material +’s I-Material +side I-Material +chain I-Material +and O +the O +optical O +response O +of O +the O +sensor B-Material +molecules I-Material +has O +been O +established O +[ O +34 O +] O +. O +Several O +works O +are O +dedicated O +to O +the O +synthesis B-Task +of I-Task +ROMP-able I-Task +optical I-Task +sensor I-Task +molecules I-Task +such O +as O +phenantroimidazoles B-Material +[ O +35,36 O +] O +, O +europium B-Material +complexes I-Material +[ O +37 O +] O +or O +xanthene B-Material +dyes I-Material +[ O +38 O +] O +, O +their O +random O +copolymerization B-Process +and O +the O +evaluation B-Task +of I-Task +their I-Task +sensing I-Task +profiles I-Task +in I-Task +the I-Task +copolymers I-Task +. 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O +Fig. O +11 O +shows O +a O +sample O +of O +temperature O +distribution O +of O +all O +window B-Material +components I-Material +at O +a O +plane O +passing O +through O +the O +horizontal O +window O +segment O +based O +on O +simulation B-Material +physical I-Material +conditions I-Material +listed O +on O +Table O +3 O +. O +Simulation B-Material +data I-Material +has O +been O +collected O +from O +all O +successive O +simulations B-Process +. O +The O +effect O +of O +increasing B-Process +direct I-Process +solar I-Process +radiation I-Process +on I-Process +both I-Process +solar I-Process +cells I-Process +and I-Process +water I-Process +temperatures I-Process +is O +shown O +in O +Fig. O +12. 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O +Through O +iteration O +, O +the O +process O +mitigates B-Process +the I-Process +noise I-Process +inherent O +in O +Monte B-Process +Carlo I-Process +raytracing I-Process +by O +combining B-Process +successive I-Process +results I-Process +and I-Process +averaging I-Process +them O +. O +At O +the O +same O +time O +, O +the O +density B-Process +estimate I-Process +bandwidth1Bandwidth I-Process +describes O +the O +support B-Process +, I-Process +or I-Process +area I-Process +of I-Process +influence I-Process +, I-Process +of I-Process +a I-Process +filter I-Process +used O +to O +weight B-Process +the I-Process +photons I-Process +retrieved O +from O +the O +photon B-Material +map I-Material +during O +a O +nearest B-Process +neighbour I-Process +lookup I-Process +on O +a O +surface B-Material +( O +Jensen O +, O +2001 O +) O +. 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O + +For O +the O +reverse B-Process +current I-Process +analysis I-Process +, O +for O +both O +scenarios O +( O +shading O +and O +short O +circuits O +) O +were O +tested O +on O +two O +systems O +, O +one O +system O +using O +standard B-Material +silicon I-Material +modules I-Material +and O +another O +system O +using O +high B-Material +efficiency I-Material +modules I-Material +. O +For O +the O +standard B-Material +silicon I-Material +system I-Material +, O +a O +power O +of O +50kWp O +was O +considered O +, O +with O +a O +system O +composed O +by O +10 B-Material +strings I-Material +of I-Material +24 I-Material +modules I-Material +per I-Material +string I-Material +and O +an O +approximate O +system O +Voc B-Material +of I-Material +864 I-Material +[ O +VDC B-Material +] O +. O +For O +the O +high B-Material +efficiency I-Material +system I-Material +, O +a O +power O +of O +40kWp O +was O +considered O +, O +with O +a O +system O +composed O +by O +10 B-Material +strings I-Material +of I-Material +18 I-Material +modules I-Material +per I-Material +string I-Material +and O +an O +approximate O +system O +Voc B-Material +of I-Material +873 I-Material +[ O +VDC B-Material +] O +. O +Fig. O +5 O +( O +a O +) O +shows O +the O +reverse B-Task +current I-Task +present O +in O +one O +string O +when O +different O +numbers O +of O +modules O +in O +the O +string O +are O +shaded O +by O +90 O +% O +. O +Fig. O +5 O +( O +b O +) O +shows O +the O +reverse O +current O +present O +in O +one O +string O +when O +different B-Process +numbers I-Process +of I-Process +modules I-Process +of I-Process +the I-Process +string I-Process +are I-Process +short-circuited I-Process +. O +For O +both O +figures O +the O +continuous O +lines O +are O +for O +the O +standard B-Material +silicon I-Material +system I-Material +and O +the O +dashed O +lines O +are O +for O +the O +high B-Material +efficiency I-Material +system I-Material +. O + +The O +final O +contribution O +to O +the O +force O +is O +the O +van B-Process +der I-Process +Waals I-Process +interaction I-Process +. O +It O +includes O +the O +following O +contributions O +: O +( O +i O +) O +between O +the O +macroscopic B-Material +Si I-Material +tip I-Material +of O +conical O +shape O +with O +the O +sphere O +of O +radius O +R O +at O +the O +end O +[ O +27 O +] O +and O +semi-infinite B-Material +substrate I-Material +; O +( O +ii O +) O +the O +dispersion B-Process +forces I-Process +between O +the O +atoms B-Material +in O +the O +sample O +treated O +atomistically O +; O +and O +( O +iii O +) O +the O +interaction O +between O +the O +macroscopic B-Material +part I-Material +of I-Material +the I-Material +tip I-Material +and O +the O +sample B-Material +atoms I-Material +. O +The O +first O +contribution O +is O +calculated O +analytically O +[ O +27 O +] O +. O +In O +fact O +, O +the O +macroscopic O +contribution O +to O +the O +van B-Process +der I-Process +Waals I-Process +force I-Process +is O +the O +same O +in O +each O +of O +the O +three O +systems O +described O +below O +, O +as O +it O +depends O +only O +on O +the O +tip B-Process +– I-Process +surface I-Process +separation I-Process +, O +macroscopic O +sphere O +radius O +, O +cone-angle O +and O +Hamaker O +constant O +of O +the O +system O +[ O +27 O +] O +. O +All O +these O +quantities O +are O +identical O +in O +each O +system O +we O +look O +at O +, O +so O +that O +the O +van B-Process +der I-Process +Waals I-Process +force I-Process +acts O +as O +a O +background O +attractive O +force O +independent O +of O +the O +microscopic O +properties O +of O +the O +system O +[ O +8 O +] O +. O +The O +Hamaker O +constant O +needed O +for O +the O +calculation B-Process +of O +the O +macroscopic B-Process +van I-Process +der I-Process +Waals I-Process +force I-Process +is O +estimated O +to O +be O +0.5eV O +[ O +32 O +] O +. O + +In O +the O +present O +work O +we O +use O +the O +mortar B-Process +finite I-Process +element I-Process +method O +for O +the O +coupling B-Task +of I-Task +nonconforming I-Task +discretized I-Task +sub-domains I-Task +in I-Task +the I-Task +framework I-Task +of I-Task +nonlinear I-Task +elasticity I-Task +. O +The O +mortar B-Process +method I-Process +has O +been O +shown O +to O +preserve O +optimal B-Task +convergence I-Task +rates I-Task +( O +see O +Laursen O +( O +2002 O +) O +[ O +25 O +] O +for O +details O +) O +and O +is O +variationally O +consistent O +. O +We O +show O +that O +the O +method O +can O +be O +applied O +to O +isogeometric B-Task +analysis I-Task +with O +little O +effort O +, O +once O +the O +framework B-Material +of I-Material +NURBS I-Material +based I-Material +shape I-Material +functions I-Material +has O +been O +implemented O +. O +Furthermore O +, O +a O +specific O +coordinate B-Process +augmentation I-Process +technique I-Process +allows O +the O +design O +of O +an O +energy B-Task +– I-Task +momentum I-Task +scheme I-Task +for O +the O +constrained O +mechanical B-Process +system I-Process +under O +consideration O +. O +The O +excellent O +performance O +of O +the O +redesigned O +mortar B-Process +method I-Process +as O +well O +as O +the O +energy B-Task +– I-Task +momentum I-Task +scheme I-Task +is O +illustrated O +in O +representative O +numerical O +examples.In O +the O +present O +work O +we O +use O +the O +mortar B-Process +finite I-Process +element I-Process +method I-Process +for O +the O +coupling B-Task +of I-Task +nonconforming I-Task +discretized I-Task +sub-domains I-Task +in I-Task +the I-Task +framework I-Task +of I-Task +nonlinear I-Task +elasticity I-Task +. O +The O +mortar B-Process +method I-Process +has O +been O +shown O +to O +preserve O +optimal O +convergence B-Task +rates I-Task +( O +see O +Laursen O +( O +2002 O +) O +[ O +25 O +] O +for O +details O +) O +and O +is O +variationally O +consistent O +. O +We O +show O +that O +the O +method O +can O +be O +applied O +to O +isogeometric B-Task +analysis I-Task +with O +little O +effort O +, O +once O +the O +framework B-Material +of I-Material +NURBS I-Material +based I-Material +shape I-Material +functions I-Material +has O +been O +implemented O +. O +Furthermore O +, O +a O +specific O +coordinate B-Process +augmentation I-Process +technique I-Process +allows O +the O +design O +of O +an O +energy B-Task +– I-Task +momentum I-Task +scheme I-Task +for O +the O +constrained B-Process +mechanical I-Process +system I-Process +under O +consideration O +. O +The O +excellent O +performance O +of O +the O +redesigned O +mortar B-Process +method I-Process +as O +well O +as O +the O +energy B-Task +– I-Task +momentum I-Task +scheme I-Task +is O +illustrated O +in O +representative O +numerical O +examples O +. O + +In O +this O +work O +, O +a O +numerical B-Process +strategy I-Process +for O +designing O +an O +optimal B-Task +maintenance I-Task +scheduling I-Task +for I-Task +a I-Task +structure I-Task +, O +accounting B-Process +explicitly I-Process +for I-Process +the I-Process +effects I-Process +of I-Process +uncertainty I-Process +is O +suggested O +. O +This O +contribution O +, O +which O +can O +be O +regarded O +as O +an O +extension O +of O +the O +methods O +developed O +in O +[ O +23 O +] O +, O +presents O +several O +novel O +aspects O +over O +similar O +approaches O +proposed O +in O +the O +literature O +. O +Firstly O +, O +the O +initiation B-Process +and I-Process +propagation I-Process +of I-Process +fatigue I-Process +crack I-Process +is O +modeled O +efficiently O +by O +means O +of O +cohesive B-Material +zone I-Material +elements I-Material +[ O +24 O +– O +26 O +] O +. O +The O +application O +of O +this O +class B-Material +of I-Material +elements I-Material +allows O +modeling B-Task +the I-Task +crack I-Task +initiation I-Task +and I-Task +propagation I-Task +within I-Task +a I-Task +unified I-Task +framework I-Task +. O +It O +should O +be O +noted O +that O +cohesive B-Material +zone I-Material +elements I-Material +have O +already O +been O +used O +for O +uncertainty B-Task +quantification I-Task +of I-Task +the I-Task +crack I-Task +propagation I-Task +phenomenon I-Task +[ O +27,28 O +] O +. O +However O +its O +application O +within O +the O +context O +of O +maintenance B-Task +scheduling I-Task +constitutes O +a O +novelty O +. O +The O +second O +innovative O +aspect O +of O +this O +contribution O +refers O +to O +the O +assessment B-Process +of I-Process +the I-Process +reliability I-Process +sensitivity I-Process +with I-Process +respect I-Process +to I-Process +the I-Process +variables I-Process +that I-Process +define I-Process +the I-Process +maintenance I-Process +scheduling I-Process +. O +The O +estimation B-Process +of I-Process +this I-Process +sensitivity I-Process +, O +which O +is O +required O +in O +order O +to O +determine O +the O +optimal B-Task +maintenance I-Task +schedule I-Task +within I-Task +the I-Task +proposed I-Task +framework I-Task +, O +can O +be O +quite O +demanding O +as O +the O +model B-Material +characterizing I-Material +repair I-Material +of I-Material +a I-Material +cracked I-Material +structure I-Material +leads O +to O +a O +discontinuous B-Task +performance I-Task +function I-Task +associated I-Task +with I-Task +the I-Task +failure I-Task +probability I-Task +. O +A O +new O +approach O +for O +modeling O +this O +function O +is O +proposed O +herein O +. O +The O +continuous B-Material +and I-Material +discontinuous I-Material +parts I-Material +respectively O +of O +the O +function O +are O +considered O +separately O +to O +estimate B-Process +accurately I-Process +the I-Process +gradients I-Process +of I-Process +the I-Process +failure I-Process +events I-Process +. O + +Finite B-Process +Element I-Process +Tearing I-Process +and I-Process +Interconnecting I-Process +( O +FETI B-Process +) O +methods O +are O +a O +powerful O +approach O +to O +designing O +solvers B-Task +for I-Task +large-scale I-Task +problems I-Task +in I-Task +computational I-Task +mechanics I-Task +. O +The O +numerical B-Material +simulation I-Material +problem I-Material +is O +subdivided O +into O +a O +number B-Material +of I-Material +independent I-Material +sub-problems I-Material +, O +which O +are O +then O +coupled O +in O +appropriate O +ways O +. O +NURBS B-Process +- O +( O +Non-Uniform B-Process +Rational I-Process +B-spline I-Process +) O +based O +isogeometric B-Process +analysis I-Process +( O +IGA B-Process +) O +applied O +to O +complex B-Material +geometries I-Material +requires O +to O +represent O +the O +computational B-Task +domain I-Task +as I-Task +a I-Task +collection I-Task +of I-Task +several I-Task +NURBS I-Task +geometries I-Task +. O +Since O +there O +is O +a O +natural O +decomposition O +of O +the O +computational O +domain O +into O +several B-Material +subdomains I-Material +, O +NURBS-based B-Process +IGA I-Process +is O +particularly O +well O +suited O +for O +using O +FETI O +methods.This O +paper O +proposes O +the O +new O +IsogEometric O +Tearing O +and O +Interconnecting O +( O +IETI O +) O +method O +, O +which O +combines O +the O +advanced O +solver O +design O +of O +FETI O +with O +the O +exact O +geometry O +representation O +of O +IGA O +. O +We O +describe O +the O +IETI O +framework O +for O +two O +classes O +of O +simple O +model O +problems O +( O +Poisson O +and O +linearized O +elasticity O +) O +and O +discuss O +the O +coupling O +of O +the O +subdomains O +along O +interfaces O +( O +both O +for O +matching O +interfaces O +and O +for O +interfaces O +with O +T-joints O +, O +i.e. O +hanging O +nodes O +) O +. O +Special O +attention O +is O +paid O +to O +the O +construction O +of O +a O +suitable O +preconditioner O +for O +the O +iterative O +linear O +solver O +used O +for O +the O +interface O +problem O +. O +We O +report O +several O +computational O +experiments O +to O +demonstrate O +the O +performance O +of O +the O +proposed O +IETI O +method O +. O + +To O +the O +best O +of O +authors’ O +knowledge O +, O +so O +far O +there O +are O +only O +very O +few O +papers O +[ O +12,13,16,29 O +] O +which O +address O +the O +performance B-Process +of I-Process +linear I-Process +algebra I-Process +solvers I-Process +. O +In O +Ref O +. O +[ O +16 O +] O +, O +the O +authors O +study O +the O +performance B-Process +of I-Process +direct I-Process +solvers I-Process +which O +are O +clearly O +not O +suitable O +for O +large B-Process +problems I-Process +, O +specially O +in O +three-dimensions O +. O +In O +Ref O +. O +[ O +29 O +] O +, O +the O +tearing B-Process +and I-Process +interconnecting I-Process +approach I-Process +of I-Process +finite I-Process +element I-Process +methods I-Process +is O +used O +in O +the O +context O +of O +isogeometric B-Task +analysis I-Task +, O +and O +the O +numerical B-Material +tests I-Material +( O +in O +absence O +of O +any O +theoretical B-Task +study I-Task +) O +suggest O +almost O +optimal O +( O +with O +a O +logarithmic O +factor O +) O +convergence O +rates O +of O +the O +proposed O +isogeometric B-Process +tearing I-Process +and I-Process +interconnecting I-Process +method I-Process +. O +The O +only O +paper O +which O +provides O +rigorous B-Task +theoretical I-Task +study I-Task +, O +supported O +by O +extensive B-Material +numerical I-Material +examples I-Material +, O +is O +by O +Beirao O +et O +al O +. O +[ O +12 O +] O +where O +the O +authors O +discuss O +the O +overlapping O +Schwarz B-Process +methods I-Process +. O +The O +same O +authors O +have O +also O +proposed O +BDDC B-Material +preconditioners I-Material +for O +isogeometric B-Task +analysis I-Task +in O +[ O +13 O +] O +. O + +An O +attempt O +of O +a O +quite O +comprehensive O +answer O +to O +this O +question O +is O +made O +hereafter O +, O +within O +the O +following O +structure O +of O +the O +remaining O +paper O +: O +first O +, O +we O +introduce O +the O +mathematical B-Material +systems I-Material +biology I-Material +of I-Material +bone I-Material +, O +starting O +from O +the O +work O +of O +Pivonka O +et O +al O +. O +[ O +25,26 O +] O +, O +and O +extending O +it O +to O +mechanoregulatory B-Process +feedback I-Process +control I-Process +( O +Section O +2 O +) O +. O +Then O +, O +we O +introduce O +a O +continuum B-Material +micromechanics I-Material +representation I-Material +adopted O +from O +Hellmich O +et O +al O +. O +[ O +30 O +] O +, O +in O +order O +to O +scale O +elasticity O +and O +strains O +from O +the O +level O +of O +the O +extravascular O +bone O +matrix O +to O +that O +of O +cortical O +bone1In O +this O +paper O +, O +we O +restrict O +ourselves O +to O +cortical O +bone O +, O +due O +to O +its O +major O +importance O +in O +providing O +sufficient O +load-carrying O +capacity O +. O +However O +, O +extension O +of O +the O +coupled O +approach O +proposed O +here O +to O +trabecular O +bone O +is O +straightforward O +; O +it O +merely O +requires O +recalibration O +of O +underlying O +parameters.1 O +and O +vice O +versa O +( O +Section O +3 O +) O +. O +The O +micromechanics O +formulation O +is O +fed O +with O +composition O +quantities O +derived O +from O +the O +systems O +biology O +approach O +, O +which O +, O +in O +turn O +, O +is O +provided O +with O +mechanical O +stimuli O +gained O +from O +the O +micromechanics O +model O +. O +We O +then O +apply O +the O +coupled O +approach O +to O +biochemical O +and O +mechanical O +conditions O +typical O +for O +postmenopausal O +osteoporosis O +( O +Section O +4 O +) O +and O +microgravity O +exposure O +( O +Section O +5 O +) O +, O +and O +discuss O +key O +sensitivity O +features O +( O +Section O +6 O +) O +. O +After O +emphasizing O +the O +potentials O +and O +limitations O +of O +the O +presented O +approach O +( O +Section O +7 O +) O +, O +we O +conclude O +the O +paper O +in O +( O +Section O +8 O +) O +. O + +The O +choice O +of O +the O +interpolation B-Process +functions I-Process +and O +support B-Material +point I-Material +coordinates I-Material +for I-Material +the I-Material +gradient I-Material +field I-Material +is O +crucial O +to O +ensure O +stability B-Task +and I-Task +accuracy I-Task +of I-Task +the I-Task +formulation I-Task +. O +For O +example O +, O +nodal B-Process +integration I-Process +and I-Process +NS-FEM I-Process +are O +unstable O +involving O +the O +appearance O +of O +spurious O +low-energy O +modes O +. O +They O +need O +non-physical B-Material +penalty I-Material +energy I-Material +functions I-Material +that O +stabilize B-Task +them I-Task +. O +The O +articles O +[ O +2,28 O +] O +numerically B-Task +verify I-Task +the I-Task +stability I-Task +, I-Task +convergence I-Task +and I-Task +accuracy I-Task +of I-Task +several I-Task +W2 I-Task +variants I-Task +including O +new O +elements O +which O +can O +be O +constructed O +based O +on O +the O +idea O +of O +assumed O +continuous B-Process +deformation I-Process +gradients I-Process +. O +For O +first B-Material +order I-Material +hexahedral I-Material +elements I-Material +, O +[ O +2,28 O +] O +found O +good O +results O +for O +the O +element B-Material +types I-Material +C3D B-Material +_ I-Material +8N I-Material +_ I-Material +27C I-Material +and O +C3D B-Material +_ I-Material +8N I-Material +_ I-Material +8I I-Material +. O +The O +first O +is O +defined O +by O +27 O +support O +points O +and O +a O +second B-Process +order I-Process +tensor-product I-Process +interpolation I-Process +of O +the O +deformation O +gradient O +by O +Lagrange O +polynomials O +. O +The O +latter O +element O +type O +is O +defined O +by O +16 O +support O +points O +with O +8 O +points O +being O +coincident O +with O +the O +nodes O +and O +8 O +additional O +points O +in O +the O +element O +interior O +. O +Among O +the O +tested O +first B-Material +order I-Material +tetrahedra I-Material +, O +the O +nodally B-Process +integrated I-Process +tetrahedron I-Process +with O +an O +additional O +bubble O +mode O +in O +the O +gradients O +was O +found O +to O +be O +most O +accurate O +. O +It O +turned O +out O +to O +be O +even O +the O +most O +efficient O +with O +respect O +to O +computing B-Task +time I-Task +in I-Task +explicit I-Task +analysis I-Task +[ O +28 O +] O +because O +the O +enlarged O +critical O +time O +step O +compensates O +the O +slightly O +increased O +numerical O +cost O +per O +restoring O +force O +assembly O +. O +Fig. O +1 O +illustrates O +the O +positions O +of O +support O +points O +for O +various O +CAG B-Process +and I-Process +SFEM I-Process +formulations I-Process +. O + +Algorithms B-Material +regarding I-Material +distance I-Material +fields I-Material +go O +back O +to O +the O +level B-Process +set I-Process +equation I-Process +. O +The O +level B-Process +set I-Process +method I-Process +was O +presented O +by O +Osher O +and O +Sethian O +[ O +20 O +] O +who O +described O +the O +temporal B-Process +propagation I-Process +of O +moving O +interfaces O +by O +numerical B-Process +methods I-Process +solving O +the O +Hamilton B-Process +– I-Process +Jacobi I-Process +equation I-Process +. O +This O +is O +performed O +by O +a O +finite B-Process +difference I-Process +scheme I-Process +working O +on O +a O +rectangular B-Material +grid I-Material +in I-Material +two I-Material +or I-Material +three I-Material +dimensions I-Material +. O +Information O +on O +normal O +vectors O +and O +curvature O +can O +be O +obtained O +. O +The O +fast B-Process +marching I-Process +method I-Process +[ O +21 O +] O +provides O +an O +efficient O +numerical B-Task +scheme I-Task +of I-Task +complexity I-Task +nlogn I-Task +to I-Task +compute I-Task +the I-Task +support I-Task +values I-Task +on I-Task +the I-Task +grid I-Task +. O +It O +is O +a O +reinterpretation O +of O +the O +propagation B-Process +process I-Process +, O +i.e. O +the B-Process +time I-Process +where I-Process +the I-Process +interface I-Process +passes I-Process +a I-Process +certain I-Process +grid I-Process +point I-Process +is I-Process +influenced I-Process +only I-Process +by I-Process +those I-Process +neighboring I-Process +grid I-Process +points I-Process +which I-Process +are I-Process +previously I-Process +passed I-Process +by I-Process +the I-Process +interface I-Process +. O +An O +overview O +on O +the O +theory B-Process +of I-Process +level I-Process +set I-Process +and O +fast B-Process +marching I-Process +methods O +and O +their O +applications O +to O +problems O +of O +various O +areas B-Task +are O +given O +in O +[ O +22,23 O +] O +, O +for O +example O +shape B-Task +offsetting I-Task +, O +computing B-Task +distances I-Task +, O +photolithography B-Task +development I-Task +, O +seismic B-Task +travel I-Task +times I-Task +, O +etc O +. O +Distance B-Task +fields I-Task +are O +a O +special O +case O +of O +the O +level B-Process +set I-Process +equation O +where O +the O +absolute O +value O +of O +the O +advection O +velocity O +is O +1 O +. O + +In O +this O +article O +we O +consider O +an O +extension B-Task +to I-Task +the I-Task +equations I-Task +of I-Task +poroelasticity I-Task +by O +modelling B-Task +the I-Task +flow I-Task +of I-Task +a I-Task +slightly I-Task +compressible I-Task +single I-Task +phase I-Task +fluid I-Task +in I-Task +a I-Task +viscoelastic I-Task +porous I-Task +medium I-Task +. O +The O +constitutive B-Process +equations I-Process +therefore O +allow O +for O +the O +presence O +of O +viscoelastic B-Process +relaxation I-Process +effects I-Process +in O +the O +porous B-Material +media I-Material +( O +but O +not O +the O +fluid B-Material +) O +. O +Fully B-Process +discrete I-Process +numerical I-Process +schemes I-Process +are O +derived O +based O +on O +a O +lagged B-Process +and I-Process +non-lagged I-Process +backward I-Process +Euler I-Process +time I-Process +stepping I-Process +method I-Process +applied O +to O +a O +mixed B-Material +and I-Material +Galerkin I-Material +finite I-Material +element I-Material +spatial I-Material +discretization I-Material +. O +We O +show O +that O +the O +lagged O +scheme O +is O +unconditionally O +stable O +and O +give O +an O +optimal O +a O +priori O +error O +bound O +for O +it O +. O +Furthermore O +, O +this O +scheme O +is O +practical O +and O +useful O +in O +the O +sense O +that O +it O +can O +be O +easily O +implemented O +in O +existing O +poroelasticity O +software O +because O +the O +coupling B-Process +between O +the O +viscous O +stresses O +and O +pressures O +and O +the O +elasticity O +and O +flow B-Process +equations I-Process +is O +‘ O +lagged’ O +by O +one O +time O +step O +. O +The O +required O +additional O +coding O +therefore O +takes O +the O +form O +of O +extra O +‘ O +right O +hand O +side O +loads’ O +together O +with O +some O +updating B-Process +subroutines I-Process +for O +the O +viscoelastic O +internal O +variables O +, O +but O +the O +solver O +and O +assembly B-Material +engines I-Material +remain O +intact O +. O +This O +idea O +of O +lagging O +has O +been O +used O +before O +for O +nonlinearly B-Task +viscoelastic I-Task +diffusion I-Task +problems I-Task +in O +[ O +3,24 O +] O +but O +, O +of O +course O +, O +is O +not O +new O +. O +Lagging O +in O +numerical B-Process +schemes I-Process +is O +discussed O +more O +widely O +by O +Lowrie O +in O +[ O +14 O +] O +. O + +Traditionally O +, O +the O +simulation B-Task +of I-Task +incompressible I-Task +fluid I-Task +flow I-Task +by O +the O +SPH B-Process +method I-Process +has O +been O +through O +a O +weakly B-Process +compressible I-Process +SPH I-Process +formulation I-Process +( O +WCSPH B-Process +) O +. O +In O +this O +approach O +, O +the O +pressure O +is O +treated O +as O +a O +thermodynamic O +variable O +and O +is O +calculated O +using O +an O +artificial B-Process +equation I-Process +of I-Process +state I-Process +. O +The O +sound O +speed O +is O +set O +to O +be O +sufficiently O +high O +to O +limit O +density O +variations O +to O +within O +a O +small O +fraction O +of O +the O +actual O +fluid B-Material +density O +. O +In O +practice O +, O +this O +high O +sound O +speed O +places O +a O +limitation O +on O +the O +maximum O +permissible O +time-step O +size O +through O +the O +Courant O +– O +Friedrichs O +– O +Lewy O +( O +CFL O +) O +constraint O +. O +A O +particular O +weakness O +relates O +to O +noise O +in O +the O +pressure O +field O +since O +a O +small O +perturbation O +in O +the O +local O +density O +will O +yield O +a O +large O +variation O +in O +the O +local O +pressure O +. O +This O +can O +make O +WCSPH B-Process +formulations O +ineffective O +for O +accurate O +force O +and O +pressure O +prediction O +, O +although O +recent O +developments O +which O +create B-Task +more I-Task +uniform I-Task +particle I-Task +distributions I-Task +have O +improved O +this O +[ O +1,2 O +] O +. O +A O +review O +of O +the O +SPH B-Process +method I-Process +can O +be O +found O +in O +[ O +3 O +] O +while O +a O +review O +of O +the O +classical O +WCSPH B-Process +formulation O +applied O +to O +free-surface B-Process +flows I-Process +can O +be O +found O +in O +[ O +4 O +] O +. O + +In O +this O +paper O +, O +however O +, O +we O +prefer O +the O +simpler O +‘ O +framed’ B-Process +cell I-Process +employed O +by O +Hadjiconstantinou O +and O +Patera O +[ O +16 O +] O +, O +where O +the O +shear B-Process +stress I-Process +is O +generated O +by O +constraining B-Process +the I-Process +velocity I-Process +in O +a O +‘ O +frame’ O +rather O +than O +by O +modifying O +the O +shape O +of O +the O +box O +. O +The O +framed B-Process +cell I-Process +is O +periodic O +, O +but O +we O +cannot O +simply O +calculate O +the O +average O +stress O +in O +the O +whole O +box O +because O +the O +presence O +of O +an O +external O +buffer O +would O +produce O +spurious O +results O +. O +We O +need O +the O +local O +stress O +in O +the O +core O +region O +, O +but O +this O +complicates O +the O +Oij O +term O +in O +Eq O +. O +( O +3 O +) O +. O +There O +are O +other O +methods O +to O +calculate B-Task +the I-Task +stress I-Task +tensor I-Task +such O +as O +the O +method B-Process +of I-Process +planes I-Process +[ O +32 O +] O +, O +the O +volume-average B-Process +approach I-Process +[ O +26,14 O +] O +, O +or O +the O +method O +derived O +from O +the O +Schweitz B-Process +virial I-Process +relation I-Process +[ O +25 O +] O +, O +but O +, O +in O +general O +, O +we O +must O +choose O +between O +a O +complicated B-Process +computational I-Process +cell I-Process +( O +i.e. O +Lees B-Process +– I-Process +Edwards I-Process +cell I-Process +) O +and O +simplifying O +the O +calculation O +of O +the O +momentum O +flux O +, O +or O +a O +simple B-Process +cell I-Process +( O +i.e. O +framed B-Process +cell I-Process +) O +and O +complicating O +the O +calculation O +of O +the O +momentum O +flux O +. O +The O +new O +method O +we O +propose O +here O +does O +not O +need O +the O +direct O +calculation O +of O +the O +flux O +, O +so O +it O +avoids O +this O +issue O +altogether O +: O +we O +can O +use O +the O +framed O +cell O +and O +, O +at O +the O +same O +time O +, O +avoid O +the O +calculation O +of O +the O +IK B-Process +equation I-Process +. O + +Powder B-Process +metallurgy I-Process +is O +a O +versatile O +technology B-Process +for I-Process +the I-Process +manufacturing I-Process +of I-Process +components I-Process +to I-Process +( I-Process +near I-Process +) I-Process +net-shape I-Process +with O +high O +product O +quality O +. O +For O +a O +hardmetal B-Material +( O +such O +as O +WC-Co B-Material +) O +cold O +compaction O +of O +the O +powder B-Material +to O +a O +“ O +green B-Material +body I-Material +” O +is O +followed O +by O +liquid-phase B-Process +sintering I-Process +from O +the O +subsequent O +heating B-Process +. O +This O +means O +that O +the O +binder O +metal O +Co B-Process +is I-Process +heated I-Process +to O +melt O +in O +order O +to O +obtain B-Task +sufficient I-Task +mobility I-Task +via I-Task +capillary I-Task +action I-Task +, O +i.e. O +, O +via O +surface B-Process +traction I-Process +, O +stemming O +from O +stored O +surface O +energy O +. O +The O +resulting O +flow O +causes O +gradual B-Process +filling I-Process +of I-Process +the I-Process +pore I-Process +space O +and O +brings O +about O +a O +macroscopic B-Process +shrinkage I-Process +of O +the O +particle B-Material +compact O +until O +a O +completely O +dense B-Material +state I-Material +is O +obtained O +, O +at O +least O +ideally O +. O +To O +model B-Task +and I-Task +quantitatively I-Task +simulate I-Task +the I-Task +sintering I-Task +process I-Task +is O +a O +challenging O +task O +. O +The O +goal O +is O +to O +( O +i O +) O +estimate B-Task +the I-Task +final I-Task +resulting I-Task +quality I-Task +( O +i.e. O +, O +in O +terms O +of O +porosity B-Task +) O +and O +( O +ii O +) O +to B-Task +predict I-Task +the I-Task +final I-Task +net I-Task +shape I-Task +and I-Task +size I-Task +of O +the O +sintered B-Material +component I-Material +. O + +As O +mentioned O +previously O +, O +the O +weakly B-Process +penalized I-Process +system O +can O +be O +thought O +of O +as O +a O +generalized B-Process +formulation I-Process +which O +can O +result O +in O +the O +PL B-Process +, I-Process +penalty I-Process +or I-Process +statically I-Process +condensed I-Process +PL I-Process +formulations I-Process +depending O +on O +the O +choice O +of O +the O +projection O +operator O +. O +The O +equivalence O +of O +these O +methods O +under O +the O +weakly O +penalized O +regime O +, O +allows O +us O +to O +combine O +and O +take O +advantage O +of O +the O +good O +characteristics O +of O +each O +method O +. O +For O +instance O +, O +the O +weakly B-Process +penalized I-Process +formulation I-Process +combines O +the O +simplified O +structure O +of O +the O +penalty B-Process +method I-Process +with O +the O +convergence O +characteristics O +of O +the O +PL B-Process +formulation I-Process +. O +However O +, O +due O +to O +the O +stiffness O +of O +the O +linear O +system O +at O +high O +values O +of O +the O +bulk O +modulus O +, O +the O +penalized B-Process +formulations I-Process +( O +classic B-Process +penalty I-Process +/ I-Process +weakly I-Process +penalized I-Process +) O +exhibit O +deteriorated O +nonlinear B-Material +convergence I-Material +. O +This O +stands O +in O +stark O +contrast O +to O +the O +PL B-Process +method O +which O +( O +for O +inf B-Process +– I-Process +sup I-Process +stable I-Process +schemes I-Process +) O +exhibits O +fast O +convergence B-Material +even O +for O +high O +bulk O +modulus O +. O +However O +, O +we O +observe O +that O +, O +when O +the O +choice O +of O +πh O +provides O +equivalence O +with O +the O +discrete O +PL B-Task +method O +, O +poor B-Material +nonlinear I-Material +convergence I-Material +is O +observed O +though O +, O +in O +principle O +, O +the O +convergence O +should O +be O +similar O +. O +Examining O +the O +update O +formulae O +for O +both O +weakly B-Process +penalized I-Process +and I-Process +PL I-Process +approaches I-Process +( O +see O +Appendix O +C O +) O +, O +we O +observe O +that O +deteriorated B-Task +convergence I-Task +stems O +from O +: O +( O +1 O +) O +initial B-Task +residual I-Task +amplification I-Task +, O +and O +( O +2 O +) O +the O +amplification B-Task +of I-Task +the I-Task +residual I-Task +. O + +Energy B-Process +conservation I-Process +is O +critical O +to O +ensure O +stability O +of O +a O +numerical O +method O +, O +especially O +for O +contact B-Task +and I-Task +collision I-Task +problems I-Task +[ O +28,43 O +] O +. O +A O +number O +of O +conserving O +schemes O +have O +been O +developed O +to O +ensure O +energy B-Task +conservation I-Task +. O +These O +schemes O +make O +use O +of O +the O +penalty B-Process +regulation I-Process +of O +normal O +contact O +constraint O +and O +inherit O +the O +conservation O +property O +from O +continuum B-Task +problems I-Task +. O +These O +conservation B-Process +schemes I-Process +can O +conveniently O +be O +combined O +with O +the O +finite B-Process +element I-Process +method I-Process +to O +simulate B-Task +frictionless I-Task +[ I-Task +44 I-Task +] I-Task +and I-Task +frictional I-Task +[ I-Task +43 I-Task +] I-Task +contact I-Task +and I-Task +collision I-Task +. O +Hesch O +and O +Betsch O +[ O +45 O +] O +formulated O +the O +node-to-segment B-Process +contact I-Process +method I-Process +and O +solved O +large B-Task +deformation I-Task +contact I-Task +problems I-Task +with O +the O +conserving B-Process +scheme I-Process +. O +More O +recently O +, O +an O +energy B-Process +and I-Process +momentum-conserving I-Process +temporal I-Process +discretization I-Process +scheme I-Process +[ O +46 O +] O +was O +developed O +for O +adhesive B-Task +contact I-Task +problems I-Task +without O +considering O +friction B-Process +and O +dissipation B-Process +. O +Even O +though O +the O +conserving B-Process +scheme I-Process +improves O +numerical O +stability O +, O +it O +also O +inherits O +from O +the O +penalty O +method O +the O +difficulty O +of O +having O +to O +determine O +penalty O +parameters O +. O +In O +order O +to O +remove O +penalty O +sensitivity O +, O +Chawla O +and O +Laursen O +[ O +47 O +] O +proposed O +an O +energy B-Process +and I-Process +momentum I-Process +conserving I-Process +algorithm I-Process +, O +which O +makes O +use O +of O +Lagrange O +multipliers O +instead O +of O +penalty O +parameters O +. O + +In O +this O +article O +we O +propose O +a O +method O +which O +adopts O +a O +different O +approach O +to O +the O +generation B-Process +procedure I-Process +outlined O +above O +and O +that O +helps O +to O +address O +the O +problem O +of O +generating B-Task +high-order I-Task +meshes I-Task +for I-Task +high I-Task +Reynolds I-Task +number I-Task +flows I-Task +. O +The O +method O +is O +conceptually O +simple O +, O +cheap O +to O +implement O +and O +does O +not O +require O +a O +dense B-Material +linear I-Material +boundary-layer I-Material +mesh I-Material +. O +It O +is O +based O +on O +the O +use O +of O +an O +isoparametric B-Process +[ I-Process +17 I-Process +] I-Process +or I-Process +, I-Process +in I-Process +general I-Process +, I-Process +a I-Process +transfinite I-Process +interpolation I-Process +[ O +18 O +] O +where O +a O +high-order B-Material +coarse I-Material +boundary-layer I-Material +prismatic I-Material +mesh I-Material +is O +subdivided B-Process +into I-Process +either I-Process +prisms I-Process +or I-Process +tetrahedra I-Process +using O +the O +mapping O +that O +defines O +the O +coarse B-Material +high-order I-Material +prisms I-Material +. O +The O +procedure O +is O +also O +very O +versatile O +as O +it O +permits O +meshes B-Material +with O +different O +distributions O +of O +y O ++ O +to O +be O +generated O +with O +ease O +and O +furthermore O +, O +the O +validity O +of O +these O +meshes O +is O +guaranteed O +if O +the O +initial B-Material +mesh I-Material +is O +valid O +and O +the O +polynomial B-Material +space I-Material +is O +chosen O +appropriately O +. O + +We O +shall O +establish O +the O +variational B-Material +format I-Material +in I-Material +the I-Material +space I-Material +– I-Material +time I-Material +domain I-Material +S B-Material += I-Material +defΩ I-Material +× I-Material +I I-Material +, O +for O +given O +spatial B-Material +domain I-Material +Ω I-Material +and O +time B-Material +domain I-Material +I I-Material +=( I-Material +0,T I-Material +) I-Material +, O +for O +a O +quite O +broad O +class O +of O +problems O +involving O +a O +first B-Task +order I-Task +time-derivative I-Task +. O +In O +particular O +, O +the O +coupled B-Task +problem I-Task +of I-Task +consolidation I-Task +of I-Task +geomaterials I-Task +falls O +within O +this O +class O +. O +Another O +interesting O +application O +is O +the O +problem B-Task +of I-Task +dynamics I-Task +, I-Task +rewritten I-Task +in I-Task +first-order I-Task +form I-Task +, O +i.e. O +through O +a O +Hamiltonian B-Task +description I-Task +. O +It O +is O +of O +considerable O +interest O +to O +note O +from O +the O +outset O +that O +, O +due O +to O +the O +forward O +transport O +of O +information O +in O +time O +, O +it O +is O +always O +possible O +to O +consider O +a O +set O +of O +finite O +time O +intervals O +, O +whereby O +the O +solution O +at O +the O +end O +of O +any O +such O +interval O +will O +act O +as O +the O +initial O +data O +for O +the O +next O +one O +. O +To O +this O +end O +, O +we O +introduce O +a O +partition O +0 O += O +t0 O +< O +t1 O +<⋯< O +tN O += O +T O +of O +the O +considered O +time O +domain O +I O +=( O +0,T O +) O +into O +time-intervals O +In O +=( O +tn O +− O +1,tn O +) O +of O +length O +Δtn O += O +tn O +− O +tn O +− O +1.11The O +abbreviated O +notation O +Δt O += O +Δtn O +will O +be O +used O +henceforth O +for O +the O +current O +time O +step O +associated O +with O +In O +. O +Hence O +, O +we O +define O +space B-Material +– I-Material +time I-Material +slabs I-Material +Sn B-Material += I-Material +defΩ I-Material +× I-Material +In I-Material +such O +that O +the O +space B-Material +– I-Material +time I-Material +domain I-Material +can O +be O +given O +as O +S B-Material += I-Material +defΩ I-Material +× I-Material +I I-Material += I-Material +S1 I-Material +∪ I-Material +S2 I-Material +⋯∪ I-Material +Sn I-Material +. O + +Isogeometric B-Task +analysis I-Task +. O +The O +central O +idea O +of O +isogeometric B-Task +analysis I-Task +is O +to O +use O +the O +same O +ansatz B-Process +functions I-Process +for O +the O +discretization O +of O +the O +partial O +differential O +equation O +at O +hand O +, O +as O +are O +used O +for O +the O +representation O +of O +the O +problem B-Task +geometry I-Task +. O +Usually O +, O +the O +problem O +geometry O +Ω O +is O +represented O +in O +computer B-Process +aided I-Process +design I-Process +( O +CAD B-Process +) O +by O +means O +of O +NURBS B-Material +or O +T-splines B-Material +. O +This O +concept O +, O +originally O +invented O +in O +[ O +1 O +] O +for O +finite B-Process +element I-Process +methods I-Process +( O +IGAFEM B-Process +) O +has O +proved O +very O +fruitful O +in O +applications O +[ O +1,2 O +] O +; O +see O +also O +the O +monograph O +[ O +3 O +] O +. O +Since O +CAD B-Process +directly O +provides O +a O +parametrization O +of O +the O +boundary O +∂ O +Ω O +, O +this O +makes O +the O +boundary B-Process +element I-Process +method I-Process +( O +BEM B-Process +) O +the O +most O +attractive O +numerical B-Process +scheme I-Process +, O +if O +applicable O +( O +i.e. O +, O +provided O +that O +the O +fundamental O +solution O +of O +the O +differential O +operator O +is O +explicitly O +known O +) O +. O +Isogeometric B-Process +BEM I-Process +( O +IGABEM B-Process +) O +has O +first O +been O +considered O +for O +2D B-Process +BEM I-Process +in O +[ O +4 O +] O +and O +for O +3D B-Process +BEM I-Process +in O +[ O +5 O +] O +. O +Unlike O +standard B-Process +BEM I-Process +with O +piecewise O +polynomials O +which O +is O +well-studied O +in O +the O +literature O +, O +cf. O +the O +monographs O +[ O +6,7 O +] O +and O +the O +references O +therein O +, O +the O +numerical B-Task +analysis I-Task +of I-Task +IGABEM I-Task +is O +essentially O +open O +. O +We O +only O +refer O +to O +[ O +2,8 O +– O +10 O +] O +for O +numerical O +experiments O +and O +to O +[ O +11 O +] O +for O +some O +quadrature B-Task +analysis I-Task +. O +In O +particular O +, O +a B-Process +posteriori I-Process +error I-Process +estimation I-Process +has O +been O +well-studied O +for O +standard B-Process +BEM I-Process +, O +e.g. O +, O +[ O +12 O +– O +18 O +] O +as O +well O +as O +the O +recent O +overview O +article O +[ O +19 O +] O +, O +but O +has O +not O +been O +treated O +for O +IGABEM B-Process +so O +far O +. O +The O +purpose O +of O +the O +present O +work O +is O +to O +shed B-Task +some I-Task +first I-Task +light I-Task +on I-Task +a I-Task +posteriori I-Task +error I-Task +analysis I-Task +for I-Task +IGABEM I-Task +which O +provides O +some O +mathematical B-Task +foundation I-Task +of I-Task +a I-Task +corresponding I-Task +adaptive I-Task +algorithm I-Task +. O + +In O +recent O +years O +, O +the O +Discontinuous B-Process +Galerkin I-Process +( O +DG B-Process +) O +method O +has O +emerged O +as O +a O +more O +thorough O +alternative O +for O +locally O +solving B-Task +conservation I-Task +laws I-Task +of I-Task +the I-Task +shallow I-Task +water I-Task +equations I-Task +with O +higher O +accuracy O +[ O +21 O +– O +27 O +] O +. O +The O +DG B-Process +method I-Process +further O +involves O +finite B-Process +element I-Process +weak I-Process +formulation I-Process +to O +– O +inherently O +from O +conservation B-Process +principles I-Process +– O +shape B-Task +a I-Task +piecewise-polynomial I-Task +solution I-Task +over I-Task +each I-Task +local I-Task +discrete I-Task +cell I-Task +, O +via O +local B-Process +basis I-Process +functions I-Process +. O +On O +this O +basis O +, O +the O +DG B-Process +polynomial I-Process +accuracy I-Process +is O +spanned O +by O +a O +set O +of O +coefficients O +, O +describing O +accuracy O +information O +, O +which O +are O +all O +locally O +evolved O +in O +time O +from O +conservation B-Process +principles I-Process +at O +the O +discrete O +level O +, O +with O +an O +arbitrary O +order O +of O +accuracy O +. O +A O +DG-based B-Task +shallow I-Task +water I-Task +model I-Task +appeals O +in O +providing O +higher O +quality O +solutions O +on O +very B-Material +coarse I-Material +meshes I-Material +than O +a O +traditional O +finite O +volume O +counterpart O +, O +but O +is O +comparatively O +expensive O +to O +run O +and O +imposes O +a O +more O +restrictive O +stability O +condition O +for O +the O +CFL B-Process +number I-Process +[ O +28,29 O +] O +. O + +FR B-Process +schemes I-Process +are O +similar O +to O +nodal B-Process +DG I-Process +schemes I-Process +, O +which O +are O +arguably O +the O +most O +popular O +type O +of O +unstructured B-Process +high-order I-Process +method I-Process +( O +at O +least O +in O +the O +field O +of O +computational B-Task +aerodynamics I-Task +) O +. O +Like O +nodal B-Process +DG I-Process +schemes I-Process +, O +FR B-Process +schemes I-Process +utilise O +a O +high-order B-Process +( O +nodal B-Process +) O +polynomial O +basis O +to O +approximate B-Process +the I-Process +solution I-Process +within O +each O +element O +of O +the O +computational B-Task +domain I-Task +, O +and O +like O +nodal B-Process +DG I-Process +schemes I-Process +, O +FR B-Process +schemes I-Process +do O +not O +explicitly O +enforce B-Process +inter-element I-Process +solution I-Process +continuity I-Process +. O +However O +, O +unlike O +nodal B-Process +DG I-Process +schemes I-Process +, O +FR B-Process +methods I-Process +are O +based O +solely O +on O +the O +governing O +system O +in O +a O +differential O +form O +. O +A O +description O +of O +the O +FR B-Process +approach I-Process +in O +1D O +is O +presented O +below O +. O +For O +further O +information O +see O +the O +original O +paper O +of O +Huynh O +[ O +2 O +] O +. O + +The O +immersed B-Process +boundary I-Process +method I-Process +( O +IBM B-Process +) O +, O +proposed O +by O +Peskin O +for O +studying B-Task +flow I-Task +patterns I-Task +around I-Task +heart I-Task +valves I-Task +[ O +3 O +] O +, O +has O +been O +applied O +to O +a O +wide O +range O +of O +problems O +including O +arterial B-Task +blood I-Task +flow I-Task +[ O +4 O +] O +, O +modelling B-Task +of I-Task +the I-Task +cochlea I-Task +[ O +5 O +] O +, O +modelling B-Task +of I-Task +red I-Task +blood I-Task +cells I-Task +in I-Task +Poiseuille I-Task +flow I-Task +[ O +6 O +] O +and O +flows B-Task +involving I-Task +suspended I-Task +particles I-Task +[ O +7 O +] O +. O +A O +comprehensive O +list O +of O +applications O +can O +be O +found O +in O +[ O +8 O +] O +. O +The O +IBM B-Process +is O +both O +a O +mathematical O +formulation O +and O +a O +numerical O +scheme O +for O +fluid B-Task +– I-Task +structure I-Task +interaction I-Task +problems I-Task +. O +As O +mentioned O +above O +, O +in O +a O +classical O +fluid B-Task +– I-Task +structure I-Task +interaction I-Task +problem I-Task +, O +the O +fluid B-Material +and O +the O +structure B-Material +are O +considered O +separately O +and O +then O +coupled B-Process +together I-Process +via O +some O +suitable O +jump O +conditions O +. O +In O +the O +IBM B-Process +however O +, O +the O +structure O +– O +which O +is O +usually O +immersed O +in O +a O +Newtonian B-Material +fluid I-Material +– O +is O +viewed O +as O +being O +part O +of O +the O +surrounding B-Material +fluid I-Material +. O +This O +means O +that O +only O +a O +single O +equation O +of O +motion B-Process +needs O +to O +be O +solved O +( O +i.e. O +a O +one-phase O +formulation O +) O +. O +Additionally O +, O +the O +IBM B-Process +allows O +the O +immersed O +structure O +to O +move O +freely O +over O +the O +underlying B-Material +fluid I-Material +mesh I-Material +, O +alleviating O +the O +need O +for O +the O +remeshing B-Process +required O +in O +a O +classical O +formulation O +. O + +We O +consider O +the O +shape B-Task +optimisation I-Task +of O +two B-Material +- I-Material +and I-Material +three-dimensional I-Material +solids I-Material +by O +combining B-Process +multiresolution I-Process +subdivision I-Process +surfaces I-Process +with O +immersed B-Material +finite I-Material +elements I-Material +. O +As O +widely O +discussed O +in O +isogeometric B-Material +analysis I-Material +literature I-Material +, O +the O +geometry B-Process +representations I-Process +used O +in O +today O +’s O +computer B-Process +aided I-Process +design I-Process +( O +CAD B-Process +) O +and O +finite B-Process +element I-Process +analysis I-Process +( O +FEA B-Process +) O +software O +are O +inherently O +incompatible O +[ O +1 O +] O +. O +This O +is O +particularly O +limiting O +in O +shape B-Task +optimisation I-Task +during O +which O +a O +given O +CAD B-Process +geometry I-Process +model I-Process +is O +to O +be O +iteratively O +updated O +based O +on O +the O +results O +of O +a O +finite B-Process +element I-Process +computation I-Process +. O +The O +inherent O +shortcomings O +of O +present O +geometry B-Task +and I-Task +analysis I-Task +representations I-Task +have O +motivated O +the O +proliferation O +of O +various O +shape B-Process +optimisation I-Process +techniques I-Process +. O +In O +the O +most O +prevalent O +approaches O +a O +surrogate B-Process +geometry I-Process +model I-Process +[ O +2 O +– O +8 O +] O +or O +the O +analysis B-Process +mesh I-Process +[ O +9,10 O +] O +instead O +of O +the O +true O +CAD B-Process +model I-Process +is O +optimised O +, O +see O +also O +[ O +11 O +] O +and O +references O +therein O +. O +Generally O +, O +it O +is O +tedious O +or O +impossible O +to O +map O +the O +optimised B-Process +surrogate I-Process +geometry I-Process +model I-Process +or O +analysis B-Process +mesh I-Process +back O +to O +the O +original O +CAD B-Process +model I-Process +, O +which O +is O +essential O +for O +continuing O +with O +the O +design O +process O +and O +later O +for O +manufacturing O +purposes O +. O +Moreover O +, O +geometric O +design O +features O +are O +usually O +defined O +with O +respect O +to O +the O +CAD O +model O +and O +cannot O +be O +easily O +enforced O +on O +the O +surrogate B-Process +model I-Process +. O +Recently O +, O +the O +shape B-Task +optimisation I-Task +of O +shells B-Material +, O +solids B-Material +and O +other O +applications O +using O +isogeometric B-Process +analysis I-Process +has O +been O +explored O +; O +that O +is O +, O +through O +directly B-Process +optimising I-Process +the O +CAD B-Process +geometry I-Process +model I-Process +[ O +12 O +– O +15 O +] O +. O + +The O +exquisite O +manipulation O +and O +exact B-Task +measurement I-Task +of I-Task +properties I-Task +of O +individual O +nanomaterials B-Material +, O +compared O +with O +notable O +progress O +in O +their O +preparation O +, O +have O +not O +been O +thoroughly O +addressed O +albeit O +being O +of O +prime O +importance O +for O +the O +sustained B-Task +development I-Task +of I-Task +new I-Task +devices I-Task +[ O +58 O +– O +61 O +] O +. O +To O +date O +, O +several O +instruments B-Material +have O +been O +designed O +for O +such O +goals O +, O +namely O +, O +scanning B-Material +electron I-Material +microscopes I-Material +( O +SEM B-Material +) O +, O +atomic B-Material +force I-Material +microscopes I-Material +( O +AFM B-Material +) O +and O +transmission B-Material +electron I-Material +microscopes I-Material +( O +TEM B-Material +) O +[ O +62,63 O +] O +. O +Compared O +with O +the O +first O +two O +setups O +, O +which O +have O +no O +direct O +access O +to O +the O +material B-Task +internal I-Task +structure I-Task +and O +atomic B-Task +bonding I-Task +information I-Task +[ O +64 O +– O +67 O +] O +, O +the O +state-of-the-art O +in O +situ O +high-resolution O +TEM B-Process +technique O +allows O +one O +to O +not O +only O +manipulate B-Process +with I-Process +an I-Process +individual I-Process +object I-Process +at O +the O +nano-scale O +precision O +but O +to O +also O +get O +deep O +insights O +into O +its O +physical O +, O +chemical O +, O +and O +microstructural O +statuses O +[ O +68 O +– O +71 O +] O +. O +Combining O +the O +capabilities O +of O +a O +conventional O +high-resolution O +TEM B-Process +and O +AFM B-Process +or O +STM B-Process +probes I-Process +produces O +advanced O +and O +dedicated O +TEM B-Process +holders I-Process +, O +which O +are O +becoming O +the O +powerful O +tools O +in O +nanomaterials B-Task +manipulation I-Task +and O +properties B-Task +analysis I-Task +. O +Such O +holders B-Process +have O +been O +commercialized O +, O +for O +instance O +, O +by O +“ O +Nanofactory O +Instruments O +AB O +’ O +’ O +, O +Goteborg O +, O +Sweden O +[ O +72 O +] O +. O +The O +full O +usefulness O +of O +these O +advanced O +in-situ O +TEM B-Process +techniques I-Process +is O +apparent O +with O +respect O +to O +mechanical B-Task +and I-Task +thermal I-Task +property I-Task +analysis I-Task +of O +individual O +nanostructures B-Material +, O +e.g. O +, O +elasticity O +, O +plasticity O +and O +strength O +data O +while O +employing O +direct B-Process +bent I-Process +or I-Process +tensile I-Process +tests I-Process +[ O +73 O +– O +75 O +] O +, O +probing B-Process +electrical I-Process +characteristics I-Process +, O +e.g. O +, O +field B-Task +emission I-Task +[ O +27,76,77 O +] O +, O +electrical B-Task +transport I-Task +tracing I-Task +[ O +78 O +– O +80 O +] O +, O +soldering B-Task +[ O +81,82 O +] O +, O +and O +doping B-Task +[ O +83 O +] O +, O +etc O +. O + +MINERAL B-Task +( I-Task +MINeral I-Task +ERror I-Task +AnaLysis I-Task +) I-Task +is O +a B-Task +new I-Task +MATLAB I-Task +® I-Task +based I-Task +program I-Task +that O +provides B-Process +mineral I-Process +formula I-Process +recalculations I-Process +combined I-Process +with I-Process +the I-Process +associated I-Process +propagation I-Process +of I-Process +the I-Process +analytical I-Process +uncertainties I-Process +. O +Methods B-Task +are O +based O +on O +the O +work O +of O +Giamarita O +and O +Day O +( O +1990 O +) O +. O +However O +, O +additional O +features O +have O +been O +added O +to B-Task +provide I-Task +users I-Task +with I-Task +greater I-Task +flexibility I-Task +in I-Task +data I-Task +reporting I-Task +. O +Many O +programs O +exist O +to O +recalculate O +wt O +% O +data O +into O +formula O +unit O +cations O +. O +Some B-Task +generalized I-Task +programs I-Task +can O +be O +used O +to O +recalculate B-Process +the I-Process +formula I-Process +of I-Process +multiple I-Process +minerals I-Process +e.g. O +CALCMIN B-Material +( O +Brandelik O +, O +2009 O +) O +and O +HYPER-FORM B-Material +( O +De O +Bjerg O +et O +al. O +, O +1992 O +) O +. O +Other O +programs O +are O +mineral O +specific O +e.g. O +AMPH B-Material +CLASS I-Material +( O +Esawi O +, O +2004 O +) O +and O +PROBE B-Material +AMPH I-Material +( O +Tindle O +and O +Webb O +, O +1994 O +) O +for O +the O +recalculation B-Task +of I-Task +amphibole I-Task +analyses I-Task +; O +ILMAT B-Material +( O +Lepage O +, O +2003 O +) O +for O +the O +recalculation B-Task +of I-Task +magnetite I-Task +and I-Task +ilmenite I-Task +; O +and O +PX-NOM B-Material +( O +Sturm O +, O +2002 O +) O +for O +the O +recalculation B-Task +of I-Task +pyroxene I-Task +analyses I-Task +. O +MINERAL B-Material +provides O +a O +rapid O +method O +for O +the O +recalculation B-Task +of I-Task +multiple I-Task +common I-Task +minerals I-Task +. O +However O +, O +its O +strength O +lies O +in O +the O +fact O +that O +is O +the O +first O +tool O +to O +incorporate B-Process +the I-Process +associated I-Process +uncertainty I-Process +propagation I-Process +calculations I-Process +. I-Process +As O +these O +are O +performed O +concurrently O +with O +the O +standard O +recalculations O +, O +no O +additional O +time O +is O +needed O +to O +perform O +uncertainty O +propagation O +. 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O + +A O +number O +of O +model O +parameters O +can O +change O +regionally O +or O +seasonally O +, O +in O +particular O +the O +inherent O +optical O +properties O +of O +water B-Material +constituents I-Material +[ O +ai B-Material +⁎( I-Material +λ I-Material +) O +, O +aY B-Material +⁎( I-Material +λ I-Material +) I-Material +, O +aD B-Material +⁎( I-Material +λ I-Material +) I-Material +, O +bX B-Material +( I-Material +λ I-Material +) I-Material +, O +bb,X B-Material +⁎ I-Material +, O +bb,Mie O +⁎] O +and O +the O +apparent O +optical O +properties O +of O +the O +bottom O +[ O +Rib O +( O +λ O +) O +, O +Bi O +] O +and O +the O +atmosphere O +. O +The O +database O +provided O +with O +WASI O +has O +been O +derived O +from O +in-situ O +measurements O +from O +lakes O +in O +Southern O +Germany O +( O +Gege O +, O +1998 O +; O +Heege O +, O +2000 O +; O +Pinnel O +, O +2007 O +) O +. 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O +In O +[ O +36 O +] O +, O +the O +co-simulation O +is O +performed O +using O +resources O +at O +the O +same O +location O +without O +synthetically O +introduced O +delays O +, O +which O +means O +the O +communication O +latency O +between O +RT O +simulators O +is O +ignored O +. O +In O +[ O +37 O +] O +, O +the O +authors O +have O +mentioned O +the O +communication O +latency O +as O +an O +important O +factor O +in O +the O +distributed B-Process +simulation I-Process +and O +that O +its O +effect O +on O +simulation O +stability O +will O +be O +studied O +as O +future O +work O +. O +An O +in-depth O +research O +about O +the O +role B-Material +of I-Material +communication I-Material +latency I-Material +and O +mitigation O +measure O +for O +geographically O +distributed O +RT O +simulations O +is O +identified O +as O +a O +technical O +gap O +and O +addressed O +in O +this O +paper O +. O + +Despite O +the O +fact O +that O +SRC-HE B-Process +reduces O +the O +number O +of O +FEs O +, O +audio O +measurements O +extraction O +based O +on O +SRC O +would O +still O +be O +not O +suitable O +for O +real-time O +applications O +[ O +39 O +] O +. O +The O +previous O +SRC-HE O +module O +is O +then O +replaced O +by O +the O +generalised B-Process +cross I-Process +correlation I-Process +phase I-Process +transform I-Process +( O +GCC-PHAT B-Process +) O +introduced O +in O +Section O +2.1 O +, O +as O +this O +does O +not O +involve O +cumbersome O +point O +function O +estimations O +. O +The O +drawback O +is O +that O +the O +basic O +GCC B-Process +algorithm I-Process +can O +only O +detect O +one O +source O +at O +a O +time O +and O +it O +is O +known O +to O +be O +sensitive O +to O +room O +reverberations O +[ O +5 O +] O +, O +however O +it O +is O +still O +effective O +under O +moderate O +reverberant O +environments O +( O +T60 O +≈ O +0.3s O +) O +[ O +40 O +] O +. O +For O +these O +reasons O +, O +at O +first O +experiments O +where O +only O +a O +speaker B-Process +is O +active O +at O +any O +given O +time O +are O +carried O +out O +, O +as O +it O +often O +happens O +in O +a O +polite O +conversation O +between O +two O +or O +more O +people O +. O +Speech B-Material +segments I-Material +using O +a O +voice B-Process +activity I-Process +detector I-Process +( O +VAD B-Process +) O +[ O +41 O +] O +are O +further O +extracted O +and O +processed O +using O +a O +GCC-PHAT B-Process +step I-Process +, O +for O +the O +signal O +to O +be O +more O +robust O +to O +reverberations O +. O +Thus O +, O +the O +measure O +vector O +obtained O +za O +( O +see O +Section O +2.1 O +) O +can O +now O +be O +rewritten O +as O +za O +={ O +τm O +( O +t O +)} O +, O +where O +each O +component O +τm O +is O +the O +TDOA O +collected O +at O +the O +m-th B-Process +microphone I-Process +pair I-Process +at O +each O +time O +step O +t O +. O +Since O +TDOAs O +are O +not O +linear O +in O +the O +speaker O +position O +, O +they O +must O +be O +input O +into O +an O +extended O +Kalman B-Process +filter I-Process +( O +EKF B-Process +) O +, O +as O +in O +[ O +10 O +] O +to O +get O +an O +audio B-Task +position I-Task +estimation I-Task +. O + +In O +this O +paper O +we O +construct O +such O +a O +physical B-Process +model I-Process +with O +a O +continuous B-Task +distribution I-Task +of I-Task +relaxations I-Task +. O +It O +is O +based O +on O +the O +phenomenological B-Task +theory I-Task +of I-Task +relaxation I-Task +processes I-Task +which O +have O +a O +long O +history O +in O +physics O +literature O +and O +was O +recently O +summarized O +in O +a O +monograph O +in O +which O +references O +to O +other O +relevant O +publications O +can O +be O +found O +, O +[ O +24 O +] O +; O +also O +see O +[ O +25 O +] O +. O +The O +present O +work O +is O +confined O +to O +relaxation B-Process +mechanisms I-Process +which O +result O +from O +changes O +in O +normal O +stresses O +. O +More O +specifically O +, O +we O +are O +interested O +in O +the O +local B-Task +mechanisms I-Task +of I-Task +irreversible I-Task +energy I-Task +loss I-Task +caused O +by O +uniform O +compression B-Process +or I-Process +expansion I-Process +of I-Process +a I-Process +medium I-Process +for O +which O +all O +components O +remain O +unchanged O +, O +rather O +than O +the O +losses O +caused O +by O +friction B-Process +between I-Process +different I-Process +layers I-Process +of I-Process +a I-Process +medium I-Process +which O +move O +with O +different O +velocities O +( O +for O +a O +more O +detailed O +discussion O +of O +this O +issue O +see O +[ O +26 O +]) O +. O +No O +attempt O +is O +made O +to O +model O +effects O +of O +shear B-Process +viscosity I-Process +and O +heat B-Process +conduction I-Process +beyond O +the O +conventional O +Navier B-Process +– I-Process +Stokes I-Process +approach I-Process +, O +since O +this O +topic O +goes O +far O +beyond O +the O +scope O +of O +this O +paper O +. O + +The O +propagation B-Task +of I-Task +unsteady I-Task +disturbances I-Task +in O +ducts B-Material +of O +slowly-varying O +geometry O +, O +such O +as O +those O +typical O +of O +an O +aeroengine B-Material +, O +can O +be O +successfully O +modelled O +using O +a O +multiple B-Process +scales I-Process +approach I-Process +. O +From O +the O +first O +application O +[ O +1 O +] O +of O +multiple-scales B-Process +analysis I-Process +to O +sound B-Process +propagation I-Process +in O +ducts B-Material +of O +rectangular O +and O +circular O +cross O +section O +without O +mean B-Process +flow I-Process +, O +more O +recent O +developments O +have O +extended O +the O +method O +to O +cases O +with O +uniform B-Process +mean I-Process +flow I-Process +[ O +2 O +] O +, O +mean B-Process +swirling I-Process +flow I-Process +[ O +3 O +] O +, O +ducts B-Material +of O +arbitrary O +cross O +section O +[ O +4 O +] O +( O +with O +uniform B-Process +mean I-Process +flow I-Process +) O +and O +strongly B-Material +curved I-Material +ducts I-Material +[ O +5 O +] O +. O +The O +multiple-scales B-Process +approach I-Process +has O +a O +number O +of O +distinct O +advantages O +over O +full O +numerical B-Process +methods I-Process +as O +it O +is O +ideally O +suited O +to O +handle O +higher B-Process +frequencies I-Process +and O +the O +computational O +complexity O +is O +only O +marginally O +more O +than O +calculating B-Process +the I-Process +eigenmodes I-Process +inside O +a O +straight B-Material +parallel I-Material +duct I-Material +. O +The O +accuracy O +and O +usefulness O +of O +the O +multiple B-Process +scales I-Process +approach I-Process +has O +been O +validated O +against O +finite-element B-Process +methods I-Process +[ O +6 O +] O +for O +realistic O +aeroengine B-Material +configurations O +and O +acoustic B-Task +frequencies I-Task +[ O +7,8 O +] O +. O + +We O +describe O +three O +ways O +to O +solve O +the O +reflection B-Task +problem I-Task +. O +The O +first O +way O +is O +very O +simple O +( O +Section O +4 O +) O +. O +We O +exploit O +the O +consequences O +of O +shifting B-Process +the I-Process +semi-infinite I-Process +row I-Process +by O +one O +period O +( O +to O +the O +right O +or O +left O +) O +. O +In O +effect O +, O +we O +regard O +the O +semi-infinite O +row O +as O +two B-Process +scatterers I-Process +, O +one O +of O +which O +is O +another O +semi-infinite B-Process +row I-Process +. O +This O +idea O +goes O +back O +to O +a O +series O +of O +papers O +by O +Millar O +in O +the O +1960s O +, O +starting O +with O +[ O +2 O +] O +. O +He O +used O +it O +for O +several O +two-dimensional B-Task +grating I-Task +problems I-Task +. O +A O +similar O +approach O +was O +used O +for O +layered B-Material +media I-Material +by O +Shenderov O +[ O +3 O +] O +. O +In O +our O +one-dimensional O +context O +, O +we O +obtain B-Process +a I-Process +quadratic I-Process +equation I-Process +for O +R O +; O +we O +show O +how O +to O +select O +the O +correct O +solution O +. O +We O +remark O +that O +there O +has O +been O +much O +recent O +interest O +in O +related O +two-dimensional B-Task +waveguide I-Task +problems I-Task +; O +see O +, O +for O +example O +, O +[ O +4 O +– O +6 O +] O +, O +where O +the O +shifting-by-one-period B-Process +idea I-Process +is O +again O +employed O +, O +leading O +to O +a O +quadratic B-Process +equation I-Process +for O +a O +certain O +operator O +. O + +Max-linear B-Process +programs I-Process +have O +been O +used O +to O +describe O +optimisation B-Process +problems I-Process +for O +multiprocessor B-Material +interactive I-Material +systems I-Material +. O +In O +some O +instances O +the O +variables B-Material +used O +in O +this O +model O +are O +required O +to O +be O +integer O +; O +however O +, O +no O +method O +seems O +to O +exist O +for O +finding O +integer B-Process +solutions I-Process +to O +max-linear O +programs.For O +a O +generic O +class O +of O +matrices O +, O +we O +show O +that O +integer O +solutions O +to O +two-sided O +max-linear O +systems O +and O +programs O +can O +be O +found O +in O +polynomial O +time O +. O +For O +general O +matrices O +, O +we O +adapt O +the O +existing O +methods O +for O +finding O +real O +solutions O +to O +obtain O +algorithms O +for O +finding O +integer O +solutions O +. O + +We O +study O +sequences B-Task +of I-Task +optimal I-Task +walks I-Task +of I-Task +a I-Task +growing I-Task +length I-Task +in I-Task +weighted I-Task +digraphs I-Task +, O +or O +equivalently O +, O +sequences B-Task +of I-Task +entries I-Task +of I-Task +max-algebraic I-Task +matrix I-Task +powers I-Task +with I-Task +growing I-Task +exponents I-Task +. O +It O +is O +known O +that O +these O +sequences O +are O +eventually O +periodic O +when O +the O +digraphs B-Process +are I-Process +strongly I-Process +connected I-Process +. O +The O +transient O +of O +such O +periodicity O +depends O +, O +in O +general O +, O +both O +on O +the O +size O +of O +digraph B-Material +and O +on O +the O +magnitude O +of O +the O +weights O +. O +In O +this O +paper O +, O +we O +show O +that O +some O +bounds O +on O +the O +indices O +of O +periodicity O +of O +( B-Material +unweighted I-Material +) I-Material +digraphs I-Material +, O +such O +as O +the O +bounds O +of O +Wielandt O +, O +Dulmage O +– O +Mendelsohn O +, O +Schwarz O +, O +Kim O +and O +Gregory O +– O +Kirkland O +– O +Pullman O +, O +apply O +to O +the O +weights O +of O +optimal O +walks O +when O +one O +of O +their O +ends O +is O +a O +critical O +node O +. O + +Owing O +to O +widespread O +availability O +, O +the O +most O +extensively O +adopted O +tomography B-Process +technique I-Process +utilizes O +the O +milling O +power O +of O +a O +focused B-Material +ion I-Material +beam I-Material +( O +FIB B-Material +) O +in O +conjunction O +with O +the O +imaging O +capabilities O +of O +high B-Process +resolution I-Process +FE-SEM I-Process +, O +to O +provide O +a O +sequence O +of O +2D B-Material +images I-Material +that O +can O +be O +effectively O +re-combined O +in O +3D O +space O +. O +However O +, O +because O +this O +technique O +is O +destructive O +, O +studies B-Task +of I-Task +microstructural I-Task +evolution I-Task +are O +influenced O +by O +inherent O +sample O +variability O +. O +Non-destructive B-Process +X-ray I-Process +nano-computed I-Process +tomography I-Process +( O +CT B-Process +) O +[ O +9 O +– O +11 O +] O +provides O +a O +platform O +for O +exploring B-Task +dynamic I-Task +microstructural I-Task +change I-Task +in O +the O +absence O +of O +these O +possible O +complications O +and O +is O +compatible O +with O +both O +laboratory B-Material +and I-Material +synchrotron I-Material +radiation I-Material +. O +The O +authors O +have O +previously O +demonstrated O +a O +technique O +for O +preparation B-Task +of I-Task +optimal I-Task +sample I-Task +geometries I-Task +for I-Task +X-ray I-Task +nano-CT I-Task +[ O +12 O +] O +, O +while O +this O +FIB B-Process +sample I-Process +preparation I-Process +route I-Process +will O +involve O +the O +selective O +removal O +of O +portions O +of O +the O +fuel B-Material +cell I-Material +electrode I-Material +microstructure I-Material +( O +and O +therefore O +may O +be O +destructive O +to O +the O +working B-Material +fuel I-Material +cell I-Material +) O +, O +the O +non-destructive B-Process +X-ray I-Process +characterization I-Process +technique I-Process +allows O +repeated O +, O +non-destructive O +characterization O +of O +the O +selected B-Material +sample I-Material +which O +facilitates O +the O +study O +of O +microstructural B-Process +evolution I-Process +processes I-Process +in O +response O +to O +various O +environmental O +changes O +. O + +In O +conclusion O +, O +a O +new B-Task +approach I-Task +to I-Task +the I-Task +“ I-Task +grind-free I-Task +” I-Task +nanoprecursor I-Task +route I-Task +to I-Task +direct I-Task +combinatorial I-Task +solid I-Task +state I-Task +synthesis I-Task +of O +several O +“ O +difficult O +to O +make O +” O +and O +hitherto O +unknown O +phase-pure B-Material +heterometallic I-Material +Ruddlesden I-Material +Popper I-Material +type I-Material +La4Ni3 I-Material +− I-Material +xFexO10 I-Material +materials I-Material +has O +been O +described O +. O +The O +new O +approach O +used O +a O +high-throughput B-Process +reactor I-Process +and O +robotic B-Process +automation I-Process +( O +RAMSI B-Process +) O +to O +rapidly O +synthesise B-Process +a I-Process +range I-Process +of I-Process +nanoparticle I-Process +co-precipitate I-Process +precursors I-Process +in O +cloned O +libraries O +at O +a O +rate B-Process +of I-Process +7.5 I-Process +samples I-Process +an I-Process +hour I-Process +. O +Each O +library O +could O +then O +be O +heat-treated B-Process +at O +a O +different O +temperature O +and O +an O +initial O +powder B-Process +XRD I-Process +screen I-Process +was O +used O +to O +locate B-Process +and I-Process +approximate I-Process +phase I-Process +boundary I-Process +. O +A O +more O +focussed O +second O +synthesis B-Process +and I-Process +XRD I-Process +characterisation I-Process +of O +selected O +larger O +heat-treated B-Material +powders I-Material +was O +then O +performed O +to O +reconfirm O +the O +locations O +of O +the O +phase O +boundaries O +with O +the O +highest O +dopant O +level O +being O +achieved O +for O +La4Ni2FeO10 B-Material +which O +is O +significantly O +greater O +Fe B-Material +doping O +than O +has O +been O +achieved O +by O +anyone O +previously O +( O +despite O +several O +notable O +efforts O +) O +. O +EXAFS B-Material +data I-Material +suggested O +that O +Fe3 B-Material ++ I-Material +was O +located O +onto O +Ni B-Material +sites O +in O +all O +cases O +and O +did O +not O +exist O +as O +a O +separate O +iron B-Material +oxide I-Material +phase O +. O + +At O +200 O +– O +300 O +° O +C O +: O +nuclear O +densities O +are O +localised O +in O +the O +tetrahedral O +volume O +roughly O +covering O +the O +8c O +and O +32f O +positions O +with O +“ B-Material +bulges I-Material +” I-Material +of O +nuclear O +densities O +pointing O +toward O +the O +48i O +position O +, O +while O +at O +400 O +and O +500 O +° O +C O +continuous O +nuclear O +densities O +forming O +a O +straight O +line O +along O +the O +< O +100 O +> O +direction O +are O +found O +, O +indicative O +of O +oxide-ion B-Process +diffusion I-Process +pathway O +along O +that O +direction O +. O +In O +the O +literature O +, O +curved O +pathways O +along O +the O +< O +100 O +> O +direction O +passing O +through O +the O +48i O +site O +are O +generally O +observed O +in O +fluorite O +materials O +[ O +20 O +] O +, O +the O +prevalence O +of O +curve O +pathway O +as O +opposed O +from O +straight O +pathway O +is O +explained O +by O +the O +repulsion O +between O +cation O +and O +anions O +, O +the O +curved O +pathway O +allowing O +the O +cation O +– O +anion O +to O +maintain O +a O +reasonable O +distance O +. O +However O +, O +a O +straight O +pathway O +is O +observed O +for O +Y0.785Ta0.215O1.715 O +[ O +23 O +] O +, O +as O +is O +the O +case O +for O +the O +present O +material O +. O +This O +suggests O +that O +Ta O +and O +Re O +cations O +might O +play O +a O +similar O +role O +in O +these O +systems O +. O + +While O +impedance B-Process +spectroscopy I-Process +is O +a O +quite O +common O +method O +to O +investigate O +mixed B-Material +conducting I-Material +thin I-Material +film I-Material +electrodes I-Material +, O +[ O +6,10 O +– O +12 O +] O +oxygen B-Process +tracer I-Process +experiments I-Process +are O +often O +performed O +on O +bulk B-Material +samples I-Material +[ O +13 O +– O +16 O +] O +. O +Recently O +, O +several O +IEDP B-Process +measurements I-Process +of O +mixed B-Material +conducting I-Material +cathode I-Material +materials I-Material +were O +published O +with O +the O +oxide B-Material +films I-Material +being O +deposited O +on O +insulating B-Material +substrates I-Material +[ O +17 O +– O +19 O +] O +. O +However O +, O +to O +the O +best O +of O +the O +authors' O +knowledge O +no O +study O +so O +far O +reported O +experiments O +with O +both O +techniques O +being O +applied O +on O +the O +same O +films B-Material +at O +the O +same O +temperature O +. O +This O +contribution O +reports O +the O +results O +of O +a O +study O +applying B-Task +EIS I-Task +and I-Task +IEDP I-Task +to I-Task +one I-Task +and I-Task +the I-Task +same I-Task +La0.6Sr0.4CoO3 I-Task +− I-Task +δ I-Task +( I-Task +LSC I-Task +) I-Task +thin I-Task +film I-Task +in O +order O +to O +get O +complementary O +results O +on O +the O +resistive B-Task +contributions I-Task +of I-Task +the I-Task +oxygen I-Task +reduction I-Task +kinetics I-Task +on O +such O +films B-Material +. O +As O +electrical B-Process +measurements I-Process +require O +an O +oxygen B-Material +ion I-Material +conductor I-Material +, O +yttria B-Material +stabilized I-Material +zirconia I-Material +( O +YSZ B-Material +) O +was O +used O +as O +substrate O +for O +LSC B-Material +films I-Material +with O +two O +different O +grain B-Material +sizes O +. O +Quantitative B-Task +material I-Task +parameters I-Task +are O +deduced O +from O +both O +types O +of O +experiments O +and O +comparison B-Process +of I-Process +the I-Process +data I-Process +allowed O +testing O +the O +appropriateness B-Task +of I-Task +analysis I-Task +models I-Task +. O + +Thin B-Material +MIEC I-Material +layers I-Material +of O +GDC B-Material +and O +STFO B-Material +on O +single-crystalline B-Material +YSZ I-Material +substrates I-Material +were O +exposed B-Process +to I-Process +H2 I-Process +/ I-Process +H218O I-Process +atmosphere I-Process +for O +thermally O +and O +electrochemically O +driven O +tracer B-Task +exchange I-Task +experiments I-Task +. O +Rectangular B-Material +noble I-Material +metal I-Material +thin I-Material +film I-Material +current I-Material +collectors I-Material +were O +deposited B-Process +on I-Process +top I-Process +and I-Process +beneath I-Process +the I-Process +MIEC I-Process +layer I-Process +and O +used O +for O +polarization B-Process +. O +The O +lateral B-Process +distribution I-Process +of I-Process +the I-Process +tracer I-Process +revealed O +several O +interesting O +features O +: O +( O +i O +) O +In O +case O +of O +thermal B-Process +tracer I-Process +exchange I-Process +, O +an O +enhanced O +tracer B-Process +fraction I-Process +is O +found O +on O +top O +of O +the O +metallic B-Material +current I-Material +collector I-Material +due O +to O +its O +ionically O +blocking O +nature O +. O +At O +the O +edges O +of O +the O +current O +collector O +, O +the O +concentration O +of O +18O B-Material +decreases O +with O +a O +finite O +step O +width O +that O +is O +correlated O +with O +in-plane B-Process +diffusion I-Process +of I-Process +oxygen I-Process +ions I-Process +. O +( O +ii O +) O +Due O +to O +the O +low B-Process +electronic I-Process +conductivity I-Process +of O +STFO B-Material +and O +GDC B-Material +, O +the O +MIEC O +area O +that O +is O +influenced O +by O +an O +applied B-Process +bias I-Process +is O +restricted O +to O +a O +region O +close O +to O +the O +current B-Material +collector I-Material +. O +The O +width B-Task +of I-Task +this I-Task +active I-Task +region I-Task +depends O +on O +the O +bias O +. O +It O +amounts O +to O +only O +10 O +– O +15μm O +for O +STFO B-Material +but O +more O +than O +100μm O +for O +GDC B-Material +at O +a O +cathodic O +bias O +of O +− O +500mV O +. O +( O +iii O +) O +Not O +only O +enhanced B-Process +tracer I-Process +incorporation I-Process +due O +to O +cathodic O +bias O +but O +also O +reduced B-Process +incorporation I-Process +due O +to O +anodic O +bias O +could O +be O +experimentally O +resolved O +in O +the O +active O +region O +. O + +Two O +different O +micro-contact B-Material +set-ups I-Material +were O +used O +in O +the O +experiments O +. O +The O +asymmetrically B-Material +heated I-Material +measurement I-Material +set-up I-Material +( O +Fig. O +2a O +) O +allows O +to O +change B-Process +the I-Process +contacted I-Process +electrode I-Process +within O +seconds O +and O +thereby O +to O +gain B-Task +statistical I-Task +information I-Task +over O +a O +large O +number O +of O +different O +microelectrodes B-Material +on O +one O +and O +the O +same O +sample O +in O +a O +relatively O +short O +time O +. O +It O +also O +enables O +monitoring B-Task +of I-Task +optical I-Task +changes I-Task +during O +the O +measurement O +in O +real O +time O +. O +However O +, O +the O +asymmetrical B-Process +heating I-Process +from O +the O +bottom O +side O +and O +local B-Process +cooling I-Process +( O +e.g. O +by O +convection B-Process +, O +radiation B-Process +, O +and O +the O +contacting B-Material +tip I-Material +acting O +as O +a O +heat B-Material +sink I-Material +) O +is O +known O +to O +cause O +temperature B-Process +gradients I-Process +within O +the O +sample O +[ O +11 O +] O +. O +Such O +temperature O +gradients O +are O +responsible O +for O +thermo-voltages O +, O +which O +can O +lead O +to O +measurement O +artifacts O +in O +electrochemical B-Process +experiments I-Process +[ O +24 O +] O +. O +Moreover O +, O +in O +this O +set-up O +temperature B-Process +cycles I-Process +can O +hardly O +be O +performed O +on O +single O +microelectrodes B-Material +but O +require O +subsequent O +contacting B-Process +and I-Process +de-contacting I-Process +of I-Process +different I-Process +microelectrodes I-Process +. O + +Room O +temperature O +powder B-Process +X-ray I-Process +diffraction I-Process +( O +XRD B-Process +) O +was O +performed O +on O +a O +PANalytical B-Process +Empyrean I-Process +diffractometer I-Process +. O +The O +obtained O +XRD B-Material +patterns I-Material +were O +analysed O +with O +STOE B-Process +Win I-Process +XPOW I-Process +software I-Process +in O +order O +to O +determine O +phase B-Task +purity I-Task +, O +the O +crystal B-Task +structure I-Task +and O +the O +cell B-Task +parameters I-Task +of O +the O +samples O +. O +Thermogravimetric B-Process +analysis I-Process +( O +TGA B-Process +) O +was O +performed O +using O +a O +Netzsch B-Process +STA I-Process +449C I-Process +instrument I-Process +equipped O +with O +Proteus B-Process +thermal I-Process +analysis I-Process +software I-Process +. O +The O +TGA O +studies O +were O +carried O +out O +under O +reducing B-Process +conditions I-Process +( O +5 B-Material +% I-Material +H2 I-Material +/ I-Material +Ar I-Material +) O +from O +room O +temperature O +to O +900 O +° O +C O +, O +in O +order O +to O +determine O +the O +weight B-Task +change I-Task +of O +the O +perovskite B-Material +during O +the O +reduction O +. O +The O +microstructure O +of O +the O +samples' O +surface O +was O +analysed O +using O +a O +JEOL O +JSM-6700 O +field B-Process +emission I-Process +74 I-Process +scanning I-Process +electron I-Process +microscope I-Process +( O +FEG-SEM B-Process +) O +. O +The O +total B-Task +conductivity I-Task +of O +the O +samples O +was O +measured O +using O +a O +conventional O +four-terminal B-Process +method I-Process +. O +Bar O +samples O +were O +prepared O +by O +calcination B-Task +at O +1300 O +° O +C O +for O +1h O +. O +Gold B-Material +wire I-Material +contacts I-Material +were O +attached O +to O +the O +bars O +, O +which O +then O +were O +cured O +at O +850 O +° O +C O +for O +1h O +. O +The O +conductivity B-Task +of O +the O +samples O +was O +measured O +under O +a O +redox B-Task +cycle I-Task +at O +900 O +° O +C O +. O +Low B-Process +oxygen I-Process +partial I-Process +pressure I-Process +was O +achieved O +by O +using O +a O +continuous O +flow B-Process +of O +5 O +% O +H2 B-Material +/ I-Material +Ar I-Material +. O + +A B-Task +nanocomposite I-Task +system I-Task +consisting O +of O +a B-Material +semiconducting I-Material +matrix I-Material +and I-Material +embedded I-Material +ferromagnetic I-Material +nanostructures I-Material +has O +been O +fabricated O +. O +The B-Task +ferromagnetic I-Task +characteristics I-Task +as O +coercivity B-Task +, I-Task +remanence I-Task +and I-Task +magnetic I-Task +anisotropy I-Task +of I-Task +the I-Task +nanocomposite I-Task +can O +be O +adjusted O +by O +the B-Material +electrochemical I-Material +parameters I-Material +. O +Furthermore O +the O +spatial O +distribution B-Process +of O +the O +metal O +structures O +within O +the O +pores O +can O +be O +varied O +which O +means O +that O +the O +magnetic O +interactions O +between O +the O +particles O +can O +be O +influenced O +. O +In O +the O +case O +of O +densely B-Task +packed I-Task +particles I-Task +within O +the O +pores O +dipolar O +coupling O +between O +them O +occurs O +and O +results O +in O +quasi O +magnetic O +chains O +which O +offer O +a B-Material +much I-Material +larger I-Material +magnetic I-Material +anisotropy I-Material +than O +non-interacting B-Material +particles I-Material +. O +By O +modifying B-Process +the I-Process +current I-Process +density I-Process +small B-Material +Ni-particles I-Material +( I-Material +3 I-Material +– I-Material +6nm I-Material +) I-Material +can O +be O +deposited O +. O +If O +the O +packing O +density O +of O +these B-Material +particles I-Material +is O +sufficiently O +close O +, O +Ni-tubes B-Material +of O +a O +few O +nanometer O +in O +thickness O +are O +covering O +the O +pore O +walls O +. O +The B-Task +presented I-Task +nanocomposite I-Task +is O +an O +interesting O +system O +for O +magnetic O +applications O +as O +magnetic O +sensor O +technology O +. O +Silicon B-Material +as O +substrate O +renders O +this O +composite O +a B-Task +good I-Task +candidate I-Task +for I-Task +the I-Task +integration I-Task +in O +existing O +process O +technology O +. O + +As O +the O +progression O +towards O +smaller B-Task +lithographic I-Task +nodes I-Task +continues O +it O +has O +become O +necessary O +to O +adopt O +thinner B-Material +resist I-Material +films I-Material +to O +mitigate O +problems O +such O +as O +pattern B-Process +collapse I-Process +. O +To O +address O +the O +issue O +of O +reduced B-Process +etch I-Process +resistance I-Process +of I-Process +thin I-Process +photoresist I-Process +films I-Process +the O +semiconductor O +industry O +has O +begun O +to O +develop O +multilayer B-Process +processes I-Process +where O +the O +pattern O +is O +first O +transferred O +into O +an O +intermediate B-Material +organic I-Material +hardmask I-Material +with O +higher O +etch O +selectivity O +before O +final O +silicon B-Process +pattern I-Process +transfer I-Process +[ O +25 O +– O +27 O +] O +. O +In O +this O +paper O +we O +demonstrate O +how O +the O +introduction O +of O +such O +a O +multilayer B-Process +process I-Process +can O +also O +benefit O +nanosphere B-Task +lithography I-Task +by O +increasing O +achievable O +aspect O +ratios O +of O +silicon B-Material +nanopillars I-Material +without O +the O +need O +for O +complex B-Process +etch I-Process +processes I-Process +requiring O +specialised O +and O +expensive O +equipment O +, O +but O +instead O +needing O +only O +a O +standard O +SF6 O +/ O +C4F8 O +inductively O +coupled B-Material +plasma I-Material +( O +ICP B-Material +) O +mixed O +mode O +etch O +process O +at O +room O +temperature O +[ O +28 O +] O +. O +As O +intermediate B-Material +layer I-Material +material I-Material +we O +used O +polyimide B-Material +, O +which O +finds O +widespread O +use O +as O +encapsulation B-Material +material I-Material +for O +IC B-Task +production I-Task +. O +It O +is O +readily O +patterned O +in O +oxygen B-Material +plasma I-Material +and O +has O +a O +lower O +etch O +rate O +than O +silicon B-Material +in O +SF6 B-Material +gas I-Material +. O +Its O +flexibility O +can O +also O +be O +used O +for O +the O +fabrication B-Task +of I-Task +soft I-Task +polymer I-Task +pillars I-Task +by O +the O +same O +process O +as O +we O +will O +show O +. O +The O +multilayer B-Process +process I-Process +slightly O +increases O +the O +complexity O +of O +sample B-Process +preparation I-Process +but O +allows O +basic O +ICP B-Process +etching I-Process +to O +achieve O +high O +aspect O +ratio O +structures O +at O +smaller O +feature O +sizes O +that O +previously O +reported O +without O +the O +need O +for O +complex O +etching B-Material +equipment I-Material +. O + +A O +3D B-Process +finite I-Process +element I-Process +based I-Process +( I-Process +FEM I-Process +) I-Process +COMSOL I-Process +capacitance I-Process +analysis I-Process +is O +combined O +with O +Monte B-Process +Carlo I-Process +single-electron I-Process +circuit I-Process +simulations I-Process +to O +model B-Task +device I-Task +operations I-Task +during I-Task +single I-Task +electron I-Task +detection I-Task +. O +The O +3D B-Material +structural I-Material +data I-Material +( O +Fig. O +1b O +) O +of O +the O +nanoscale B-Material +DQD I-Material +pair I-Material +and O +multiple B-Material +gate I-Material +electrodes I-Material +are O +precisely O +input O +into O +COMSOL B-Material +’s I-Material +FEM-based I-Material +electrostatics I-Material +simulator I-Material +. O +Capacitances O +between O +different O +device B-Material +components I-Material +are O +then O +extracted O +and O +fed O +into O +the O +well-tested B-Material +single I-Material +electron I-Material +circuit I-Material +simulator I-Material +SETSPICE B-Material +[ O +11 O +] O +, O +based O +on O +the O +orthodox B-Task +theory I-Task +of O +single B-Process +electron I-Process +tunnelling I-Process +[ O +12 O +] O +. O +For O +our O +target B-Material +d1 I-Material +of O +60nm O +, O +simulation B-Process +results O +( O +Fig. O +1c O +) O +showed O +that O +as O +we O +sweep O +the O +voltage O +applied O +on O +gate B-Material +G1 I-Material +, O +VG1 B-Material +, O +single B-Process +electron I-Process +tunnelling I-Process +into O +the O +turnstile B-Material +’s I-Material +two I-Material +QDs I-Material +should O +generate O +shifts B-Process +in I-Process +the I-Process +electrometer I-Process +current I-Process +, O +IDS B-Material +, O +of O +tens O +of O +pA O +. O +This O +is O +well O +within O +the O +charge O +sensitivity O +of O +DQD B-Material +electrometer I-Material +[ O +6 O +] O +and O +consistent O +to O +the O +same O +order O +of O +magnitude O +with O +previous O +work O +in O +single B-Task +electron I-Task +detection I-Task +[ O +13 O +] O +. O +In O +addition O +, O +the O +gate B-Material +to O +QD B-Process +capacitive I-Process +coupling I-Process +appear O +to O +be O +sufficient O +for O +the O +control B-Process +of I-Process +QD I-Process +occupations I-Process +down O +to O +the O +single O +electron O +limit O +, O +allowing O +for O +future O +manipulation B-Task +of I-Task +single I-Task +electron I-Task +spins I-Task +in O +qubit B-Task +research I-Task +. O + +We O +evaluated B-Task +three I-Task +spin-on I-Task +carbon I-Task +hardmasks I-Task +from I-Task +Irresistible I-Task +Materials I-Task +[ O +12 O +] O +. O +The O +spin-on B-Material +carbon I-Material +compositions I-Material +were O +dissolved O +in O +a O +suitable O +solvent B-Material +such O +as O +chloroform B-Material +or O +anisole B-Material +with O +a O +concentration O +in O +the O +range O +5 O +– O +50g O +/ O +l O +. O +In O +this O +report O +, O +film B-Process +thickness I-Process +measurements I-Process +were O +made O +for O +IM-HM11-01 B-Material +and O +IM-HM11-02 B-Material +films I-Material +, O +whilst O +IM-HM11-03 B-Material +was O +used O +for O +etching B-Process +; O +further O +investigations O +to O +compare B-Task +the I-Task +performance I-Task +of I-Task +the I-Task +different I-Task +compositions I-Task +across I-Task +tasks I-Task +are O +underway O +. O +Films B-Material +of I-Material +the I-Material +SoC I-Material +were O +prepared O +by O +spin B-Process +coating I-Process +on O +hydrogen-terminated B-Material +silicon I-Material +substrates I-Material +with O +a O +speed O +varying O +between O +800 O +and O +2000 O +RPM O +for O +60s O +. O +After O +spin O +coating O +the O +film B-Material +was O +baked O +for O +2min O +at O +temperatures O +of O +up O +to O +330 O +° O +C O +. O +In O +order O +to O +enable O +further O +processing O +, O +the O +SoC O +should O +be O +rendered O +insoluble O +in O +typical O +solvents O +for O +resist O +and O +spin-on-hardmask O +to O +enable O +further O +processing O +. O +The O +elution O +behavior O +of O +films O +of O +IM-HM11-01 O +and O +IM-HM11-02 O +for O +thicknesses O +between O +30 O +and O +325nm O +was O +tested O +as O +a O +function O +of O +the O +baking O +temperature O +. O +Fig. O +1 O +shows O +the O +normalized O +film O +thickness O +of O +two O +formulations O +of O +the O +SoC O +( O +IM-HM11-01 O +and O +IM-HM11-02 O +) O +, O +before O +and O +after O +dipping O +in O +monochlorobenzene O +( O +MCB O +) O +: O +IPA O +1:1 O +solution O +. O +Prior O +to O +baking O +the O +thickness O +of O +IM-HM11-01 O +was O +∼ O +320nm O +, O +and O +the O +thickness O +of O +IM-HM11-02 O +was O +∼ O +250nm O +. O +For O +temperatures O +above O +190 O +° O +C O +the O +IM-HM11-02 O +film O +was O +rendered O +insoluble O +, O +whilst O +a O +temperature O +of O +260 O +° O +C O +was O +required O +to O +achieve O +the O +same O +for O +IM-HM11-01 O +. O +Film O +thickness O +did O +not O +affect O +the O +elution O +results O +. O + +In O +summary O +, O +we O +have O +developed O +a O +technique O +for O +site-specific B-Task +nanowire I-Task +size I-Task +reduction I-Task +by O +FIB B-Process +thinning I-Process +. O +Transmission B-Material +electron I-Material +microscope I-Material +images I-Material +of O +a O +thinned B-Material +tungsten I-Material +composite I-Material +nanowire I-Material +with O +width O +reduced O +from O +80 O +to O +20nm O +show O +uniform B-Process +shrinking I-Process +along O +the O +length O +of O +the O +wire B-Material +and O +high B-Material +resolution I-Material +images I-Material +show O +no O +obvious O +changes O +of O +the O +morphology O +after O +thinning B-Process +. O +The O +critical O +current O +density O +of O +the O +as-deposited B-Material +wire I-Material +and O +one O +thinned O +to O +a O +width O +of O +50nm O +is O +1.7 O +× O +105 O +and O +1.4 O +× O +105A O +/ O +cm2 O +at O +4.26K O +, O +respectively O +, O +suggesting O +insignificant O +modulation B-Process +of I-Process +the I-Process +electrical I-Process +properties I-Process +during O +thinning B-Process +. O +These O +results O +suggest O +that O +FIB-milling B-Process +is O +a O +potential O +approach O +for O +controllable B-Task +size I-Task +reduction I-Task +with I-Task +high I-Task +resolution I-Task +towards I-Task +the I-Task +observation I-Task +of I-Task +size I-Task +- I-Task +and I-Task +quantum I-Task +effects I-Task +, O +as O +well O +as O +for O +construction B-Task +of I-Task +3D I-Task +superconducting I-Task +nanodevices I-Task +. O + +There O +have O +been O +suggestions O +that O +electrons B-Material +can O +be O +trapped B-Process +in I-Process +the I-Process +bulk I-Process +and I-Process +at I-Process +surfaces I-Process +of I-Process +silica I-Process +[ O +15 O +] O +but O +new O +models O +of O +electron B-Material +trapping I-Material +centres I-Material +started O +to O +appear O +only O +recently O +. O +It O +has O +been O +suggested O +by O +Bersuker O +et O +al. O +, O +who O +used O +molecular B-Process +models I-Process +, O +that O +electrons B-Material +can O +be O +trapped B-Process +by O +Si B-Material +– I-Material +O I-Material +bonds I-Material +in O +a-SiO2 B-Material +leading I-Material +to O +their O +weakening B-Process +and O +thus O +facilitating O +Si B-Process +– I-Process +O I-Process +bond I-Process +dissociation I-Process +[ O +16 O +] O +. O +Further O +calculations O +by O +Camellone O +et O +al. O +have O +shown O +that O +electrons B-Material +can O +spontaneously B-Process +trap I-Process +in O +non-defective B-Process +continuum I-Process +random I-Process +network I-Process +model I-Process +of O +a-SiO2 B-Material +[ O +17 O +] O +. O +Recent O +calculations O +have O +also O +demonstrated O +that O +the O +two O +dominant O +neutral B-Process +paramagnetic I-Process +defects I-Process +at O +surfaces B-Material +of I-Material +a-SiO2 I-Material +, O +the O +non-bridging B-Material +oxygen I-Material +centre I-Material +and O +the O +silicon B-Material +dangling I-Material +bond I-Material +, O +are O +deep B-Material +electron I-Material +traps I-Material +and O +can O +form O +the O +corresponding O +negatively B-Material +charged I-Material +defects I-Material +[ O +18 O +] O +. O +However O +, O +these O +theoretical O +predictions O +have O +not O +yet O +been O +confirmed O +experimentally O +, O +emphasising O +the O +challenges O +for O +identifying B-Task +defect I-Task +centres I-Task +. O + +Ever O +since O +the O +identification B-Process +of I-Process +the I-Process +paramagnetic I-Process +E′ I-Process +centre I-Process +in I-Process +SiO2 I-Process +as O +an O +unpaired B-Material +electron I-Material +localised O +in O +an O +sp3 B-Material +hybrid I-Material +orbital I-Material +of O +an O +Si B-Material +atom I-Material +backbonded O +to O +three O +oxygen B-Material +atoms I-Material +, O +a O +number O +of O +attempts O +has O +been O +made O +at O +explaining B-Task +the I-Task +optical I-Task +and I-Task +electronic I-Task +properties I-Task +of I-Task +SiO2 I-Task +in I-Task +the I-Task +presence I-Task +of I-Task +E′ I-Task +centres I-Task +. O +The O +irradiation B-Process +or O +hole B-Process +injection I-Process +induces O +trapping B-Process +of I-Process +positive I-Process +charge I-Process +in I-Process +thin I-Process +layers I-Process +of I-Process +a-SiO2 I-Process +grown I-Process +on I-Process +silicon I-Process +surfaces I-Process +by O +thermal B-Process +oxidation I-Process +. O +This O +effect O +has O +been O +correlated O +with O +paramagnetic B-Material +E′ I-Material +centre I-Material +signals I-Material +and O +led O +to O +the O +initial O +assignment O +of O +the O +neutral B-Material +oxygen I-Material +vacancy I-Material +as O +the O +major B-Material +hole I-Material +trap I-Material +in O +a-SiO2 B-Material +[ O +1 O +– O +3 O +] O +. O +In O +this O +model O +, O +originally O +proposed O +for O +E′ B-Material +centres I-Material +in I-Material +α-quartz I-Material +, O +upon O +trapping O +a O +hole O +, O +one O +Si B-Material +atom I-Material +from O +the O +two O +Si B-Material +atoms I-Material +constituting O +the O +vacancy O +remains O +neutral O +and O +hosts O +the O +localised B-Material +unpaired I-Material +electron I-Material +while O +its O +counterpart O +becomes O +positively O +charged O +. O +Although O +this O +model O +has O +initially O +been O +accepted O +widely O +for O +its O +simplicity O +, O +it O +fails O +to O +account O +for O +a O +number O +of O +observations O +, O +such O +as O +the O +positive B-Process +charge I-Process +trapping I-Process +without O +generation O +of O +E′ B-Material +centres I-Material +[ O +4 O +] O +, O +the O +formation O +of O +high B-Material +density I-Material +of I-Material +E′ I-Material +centres I-Material +without O +the O +corresponding O +density O +of O +positive B-Process +charge I-Process +[ O +5 O +] O +, O +and O +the O +absence O +of O +correlation O +between O +the O +decrease O +of O +the O +E′ B-Material +centre I-Material +density O +and O +the O +density O +of O +positive O +charge O +upon O +post-irradiation B-Process +electron I-Process +injection I-Process +in O +SiO2 B-Material +[ O +6 O +] O +. O + +Ge B-Material +( I-Material +100 I-Material +) I-Material +wafers I-Material +( O +n B-Material +- I-Material +and I-Material +p-type I-Material +) O +were O +cleaned B-Process +in I-Process +ultra I-Process +high I-Process +vacuum I-Process +(< O +10 O +− O +6mbar O +) O +at O +500 O +° O +C O +and O +600 O +° O +C O +for O +10min O +to O +evaporate B-Process +any I-Process +native I-Process +oxide I-Process +and O +so O +achieve O +an O +oxide B-Material +free I-Material +surface I-Material +. O +Subsequently O +, O +wafers B-Material +were O +exposed O +to O +an O +Al B-Process +flux I-Process +for O +a O +range O +of O +times O +to O +deposit O +ultrathin B-Material +Al I-Material +layers I-Material +. O +The O +samples B-Material +were O +then O +oxidized B-Process +at O +ambient O +temperatures O +in O +the O +MBE B-Material +load I-Material +lock I-Material +to O +produce B-Task +Al2O3 I-Task +layers I-Task +. O +The O +samples B-Material +were O +transferred O +within O +1min O +to O +an O +Oxford B-Material +Instruments I-Material +OpAL I-Material +reactor I-Material +and O +thin B-Material +films I-Material +of I-Material +HfO2 I-Material +were O +deposited O +on O +the O +Al2O3 B-Material +using O +atomic B-Process +layer I-Process +deposition I-Process +( O +ALD B-Process +) O +. O +The O +HfO2 B-Process +depositions I-Process +used O +a O +[( B-Material +CpMe I-Material +) I-Material +2HfOMeMe I-Material +] I-Material +precursor I-Material +coupled O +with O +an O +O2 B-Material +plasma I-Material +as O +the O +oxidizing B-Material +species I-Material +. O +Between O +30 O +and O +130 O +ALD O +cycles O +were O +used O +to O +grow B-Process +HfO2 I-Process +thicknesses I-Process +from O +1.6 O +to O +7nm O +at O +250 O +° O +C O +. O +For O +electrical B-Task +measurements I-Task +, O +circular B-Material +gold I-Material +contacts I-Material +of O +area O +1.96 O +× O +10 O +− O +3cm2 O +were O +deposited O +onto O +the O +films B-Material +to O +form O +MOS B-Material +gate I-Material +electrodes I-Material +and O +Al B-Material +was O +deposited O +on O +the O +back O +of O +the O +Ge B-Material +wafers I-Material +to O +provide O +an O +ohmic B-Material +contact I-Material +. O +After O +preliminary O +measurements O +, O +the O +samples B-Material +were O +annealed B-Process +in I-Process +forming I-Process +gas I-Process +( O +FGA B-Material +) O +at O +350 O +° O +C O +for O +30min O +. O +The O +oxide B-Material +leakage I-Material +current I-Material +was O +measured B-Process +using O +a O +Keithley B-Material +230B I-Material +voltage I-Material +source I-Material +and O +Keithley B-Material +617B I-Material +electrometer I-Material +. O +The O +HP B-Material +4192A I-Material +low I-Material +frequency I-Material +( I-Material +LF I-Material +) I-Material +impedance I-Material +analyzer I-Material +at O +small O +signal O +frequencies O +between O +100Hz O +to O +1MHz O +was O +used O +to B-Task +perform I-Task +high I-Task +frequency I-Task +capacitance I-Task +– I-Task +voltage I-Task +( I-Task +HF I-Task +CV I-Task +) I-Task +measurements I-Task +. O + +We O +have O +demonstrated O +a O +new O +approach O +to O +the O +manufacture B-Task +of I-Task +self-folding I-Task +hydrogel I-Task +scaffolds I-Task +by O +the O +use O +of O +readily B-Process +available I-Process +and I-Process +fast I-Process +throughput I-Process +methods I-Process +. O +The O +process O +shows O +effective B-Process +pattern I-Process +transfer I-Process +by O +first O +embossing B-Process +a I-Process +sacrificial I-Process +layer I-Process +and O +using B-Process +it I-Process +as I-Process +a I-Process +soluble I-Process +mould I-Process +in I-Process +the I-Process +fabrication I-Process +process I-Process +. O +The O +use O +of O +a O +sacrificial B-Material +layer I-Material +of I-Material +PAA I-Material +imparts O +environmental O +sensitivity O +to O +the O +hydrogel B-Material +film I-Material +on O +only O +one O +surface B-Material +. O +The O +subsequent O +swelling B-Process +of I-Process +the I-Process +PAA I-Process +inter-penetrating I-Process +network I-Process +( O +IPN B-Process +) O +in O +elevated B-Material +pH I-Material +causes O +a O +swelling B-Process +differential I-Process +across O +the O +film B-Material +, O +causing O +it O +to O +roll B-Process +to O +accommodate B-Task +the I-Task +difference I-Task +in I-Task +surface I-Task +area I-Task +between I-Task +the I-Task +two I-Task +surfaces I-Task +. O +The O +surface O +functionalization O +and O +patterning O +stages O +are O +thus O +combined O +into O +one O +photolithographic B-Process +operation I-Process +. O +The O +net O +result O +is O +a O +method O +of O +producing B-Process +environmentally I-Process +triggered I-Process +self-folding I-Process +all I-Process +hydrogel I-Process +scaffolds I-Process +by O +a O +, O +to O +the O +authors’ O +knowledge O +, O +novel B-Task +use I-Task +of I-Task +sacrificial I-Task +layer I-Task +embossing I-Task +. O +The O +patterned B-Material +hydrogel I-Material +films I-Material +can O +be O +triggered B-Process +consecutively I-Process +allowing O +for O +successive O +rolling B-Process +and O +unrolling B-Process +depending O +on O +the O +aqueous B-Material +pH I-Material +. O +The O +choice O +of O +PEGDMA B-Material +hydrogel I-Material +provides O +a O +versatile B-Material +platform I-Material +for I-Material +creating I-Material +a I-Material +variety I-Material +of I-Material +hydrogel I-Material +scaffolds I-Material +, O +and O +while O +being O +non-fouling O +and O +nontoxic O +it O +is O +permeable O +to O +proteins B-Material +. 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O +Since O +the O +pressure O +has O +a O +pronounced O +effect O +on O +etch O +characteristics O +, O +the O +pressure O +( O +p O +) O +was O +varied O +between O +20 O +and O +40mTorr O +. O +It O +should O +be O +noted O +that O +the O +system O +was O +run O +in O +automatic B-Process +pressure I-Process +control I-Process +mode O +, O +which O +continuously O +adjusts B-Process +the I-Process +throttle I-Process +valve I-Process +to O +keep O +a O +constant O +pressure O +during O +etch O +. O +The O +coil O +power O +( O +PC O +) O +was O +fixed O +at O +1000W O +, O +while O +the O +bias O +power O +( O +PB O +) O +was O +varied O +between O +0 O +and O +30W O +. O +Finally O +, O +the O +substrate O +chuck O +temperature O +( O +T O +) O +was O +controlled O +between O +10 O +and O +50 O +° O +C O +. O +This O +design O +resulted O +in O +a O +full O +factorial B-Process +screening I-Process +in O +four O +parameters O +, O +where O +three O +center O +points O +were O +used O +to O +check B-Process +for I-Process +quadratic I-Process +curvature I-Process +, O +where O +the O +quadratic O +term O +of O +a O +parameter O +is O +needed O +to O +generate O +a O +valid O +model O +. O +The O +total O +number O +of O +experiments O +in O +this O +setup O +is O +19 O +, O +which O +were O +processed O +for O +20min O +each O +. O +The O +experiments O +in O +the O +design O +were O +carried O +out O +in O +random O +order O +. O + +We O +used O +2μm O +of O +ultra-nanocrystalline B-Material +diamond I-Material +( O +UNCD B-Material +) O +grown O +by O +chemical B-Process +vapour I-Process +deposition I-Process +( O +CVD B-Process +) O +on O +a O +∼ O +520μm O +silicon O +carrier O +wafer O +from O +Advanced O +Diamond O +Technologies O +Ltd O +. O +Detailed O +information O +about O +the O +material O +and O +the O +stamp O +fabrication O +can O +be O +found O +in O +our O +earlier O +paper O +[ O +16 O +] O +. O +The O +UNCD B-Material +wafer I-Material +was O +scribed O +into O +1 O +× O +1cm2 O +samples O +and O +subjected O +to O +RCA B-Process +cleaning I-Process +( O +SC-1 O +) O +, O +followed O +by O +ultrasonic B-Process +solvent I-Process +cleaning I-Process +. O +Nanofeature B-Task +stamps I-Task +were I-Task +then I-Task +created I-Task +from I-Task +the I-Task +samples I-Task +using O +conventional B-Process +electron I-Process +beam I-Process +lithography I-Process +( O +EBL B-Process +) O +with O +negative B-Material +tone I-Material +electron I-Material +sensitive I-Material +resist I-Material +, O +hydrogen B-Material +silsesquioxane I-Material +( O +HSQ B-Material +) O +. O +An O +Al B-Material +discharge I-Material +layer I-Material +was O +required O +above O +the O +resist O +to O +prevent B-Task +e-beam I-Task +deflection I-Task +due I-Task +to I-Task +charge I-Task +build-up I-Task +on I-Task +the I-Task +surface I-Task +[ O +17 O +] O +. O +Several B-Task +stamps I-Task +were I-Task +produced I-Task +with O +this O +process O +and O +the O +pattern O +written O +varied O +in O +design O +but O +consisted O +of O +arrays O +of O +circular B-Material +pillars I-Material +. O +After O +EBL O +and O +HSQ O +development O +, O +the O +HSQ O +was O +used O +as O +an O +etch O +mask O +for O +RIE O +with O +a O +mixture O +of O +oxygen O +and O +argon O +gas O +. O +The O +etched O +diamond O +nanopillars O +were O +typically O +225nm O +high O +. O +Fig. O +1 O +displays O +a O +scanning O +electron O +micrograph O +of O +some O +typical O +stamp O +features O +. O + +Copper B-Task +electro-chemical I-Task +deposition I-Task +( I-Task +ECD I-Task +) I-Task +of I-Task +through I-Task +silicon I-Task +via I-Task +( I-Task +TSV I-Task +) I-Task +is O +a O +key O +challenge O +of O +3D B-Task +integration I-Task +. O +This O +paper O +presents O +a O +numerical B-Process +modeling I-Process +of I-Process +TSV I-Process +filling I-Process +concerning O +the O +influence O +of O +the O +accelerator B-Material +and I-Material +the I-Material +suppressor I-Material +. I-Material +The O +diffusion B-Process +– I-Process +adsorption I-Process +model I-Process +was O +used O +in O +the O +simulation B-Process +and I-Process +effects I-Process +of I-Process +the I-Process +additives I-Process +were O +incorporated O +in O +the O +model O +. O +The O +boundary O +conditions O +were O +derived O +from O +a O +set B-Material +of I-Material +experimental I-Material +Tafel I-Material +curves I-Material +with O +different O +concentrations O +of O +additives B-Material +, O +which O +provided O +a O +quick O +and O +accurate O +way O +for O +copper B-Process +ECD I-Process +process I-Process +prediction I-Process +without O +complicated O +surface O +kinetic O +parameters O +fitting O +. O +The O +level B-Process +set I-Process +method I-Process +( O +LSM B-Process +) O +was O +employed O +to O +track B-Task +the I-Task +copper I-Task +and I-Task +electrolyte I-Task +interface I-Task +. O +The O +simulation B-Process +results O +were O +in O +good O +agreement O +with O +the O +experiments O +. 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I-Process +Here O +, O +we O +present O +a O +new B-Task +method I-Task +to I-Task +assay I-Task +pollen I-Task +tube I-Task +growth I-Task +using O +poly-dimethylsiloxane B-Material +microchannel I-Material +device I-Material +to O +isolate B-Process +individual I-Process +pollen I-Process +tubes I-Process +. O +The O +growth O +of O +the O +pollen B-Material +tube I-Material +is O +confined O +to O +the O +microchannel O +and O +to O +the O +same O +focal O +plane O +, O +allowing O +accurate B-Task +microscopic I-Task +observations I-Task +. O +This O +methodology O +has O +the O +potential O +for O +analyses B-Task +of I-Task +pollen I-Task +tube I-Task +growth I-Task +in O +microfluidic O +environments O +in O +response O +to O +chemical B-Material +products I-Material +and O +signaling B-Material +molecules I-Material +, O +which O +paves O +the O +way O +for O +various O +experiments B-Task +on I-Task +plant I-Task +reproduction I-Task +. O + +In O +order O +to O +study B-Task +the I-Task +mechanical I-Task +behavior I-Task +of O +metal B-Material +films I-Material +on O +compliant O +polymer B-Material +substrates I-Material +, O +fragmentation B-Process +testing I-Process +is O +often O +employed O +[ O +8 O +– O +12 O +] O +. O +During O +fragmentation O +testing O +, O +the O +film-substrate B-Material +couple I-Material +is O +strained B-Process +under I-Process +uni-axial I-Process +tension I-Process +and O +observed O +with O +light B-Process +microscopy I-Process +( O +LM B-Process +) O +or O +scanning B-Process +electron I-Process +microscopy I-Process +( O +SEM B-Process +) O +. O +Brittle B-Material +metals I-Material +or O +ceramic B-Material +films I-Material +fracture B-Process +, O +forming O +through O +thickness O +cracks O +( O +channel O +cracks O +) O +at O +low O +strain O +perpendicular O +to O +the O +straining O +direction O +. O +On O +the O +other O +hand O +, O +ductile O +metal B-Material +films I-Material +will O +first O +deform B-Process +locally I-Process +in O +the O +form O +of O +necks O +at O +low O +strains O +( O +Fig. O +1a O +) O +and O +with O +increased O +strain B-Process +through O +thickness O +cracks O +( O +TTC O +) O +can O +evolve O +( O +Fig. O +1b O +) O +. O +Fragmentation B-Process +testing I-Process +is O +best O +performed B-Task +in-situ I-Task +with I-Task +LM I-Task +or I-Task +SEM I-Task +so O +that O +the O +strain O +when O +the O +first O +crack O +forms O +can O +be O +observed O +. O +The O +initial O +fracture B-Process +strain I-Process +of O +the O +film B-Material +, O +also O +known O +as O +the O +crack O +onset O +strain O +, O +can O +then O +be O +used O +to O +determine O +the O +interfacial O +fracture O +shear B-Process +stress I-Process +with O +knowledge O +of O +the O +crack O +spacing O +at O +saturation O +, O +λ O +, O +film B-Material +thickness O +, O +h O +, O +and O +the O +fracture O +stress O +, O +σf B-Process += I-Process +Efilmεf I-Process +, O +where O +εf O +is O +the O +fracture B-Process +strain I-Process +, O +using O +the O +shear B-Process +lag I-Process +model I-Process +[ O +8,13,14 O +] O +. O +In-situ O +fragmentation O +testing O +with O +LM B-Process +or O +SEM B-Process +allows O +for O +the O +crack B-Process +spacing I-Process +evolution I-Process +to O +be O +observed O +as O +a O +function B-Process +of I-Process +applied I-Process +strain I-Process +( O +Fig. O +1c O +) O +. O +Under O +tensile B-Process +straining I-Process +conditions O +, O +a O +brittle B-Material +film I-Material +will O +initially O +fracture B-Process +at O +very O +low O +strains O +(< O +1 O +%) O +and O +then O +with O +further O +strain O +continue O +to O +form B-Process +cracks I-Process +until O +the O +saturation O +crack O +spacing O +is O +reached O +. O +After O +the O +saturation O +spacing O +has O +been O +reached O +, O +cracks O +can O +no O +longer O +form O +between O +existing O +crack O +fragments O +and O +the O +film O +could O +delaminate B-Process +via O +buckling B-Process +. O + +PDMS B-Material +( O +Polydimethylsiloxane B-Material +) O +has O +become O +by O +far O +the O +most O +popular O +material O +in O +the O +academic O +microfluidics B-Material +community O +because O +it O +is O +inexpensive O +, O +easy O +to O +fabricate B-Task +by O +replication B-Process +of I-Process +molds I-Process +made O +using O +rapid B-Process +prototyping I-Process +or O +other O +techniques O +, O +flexible O +, O +optically O +transparent O +, O +biocompatible O +and O +its O +fabrication O +does O +not O +require O +high O +capital O +investment O +and O +cleanroom O +conditions O +. O +Various O +techniques O +have O +been O +adapted O +to O +fabricate B-Task +microfluidic I-Task +structures I-Task +in O +PDMS B-Material +, O +including O +wet B-Process +and I-Process +dry I-Process +etching I-Process +[ O +20 O +– O +22 O +] O +, O +photolithographic B-Process +patterning I-Process +of O +a O +photosensitive O +PDMS B-Material +[ O +23 O +] O +, O +and O +laser B-Process +ablation I-Process +[ O +24 O +] O +. O +But O +, O +it O +was O +the O +“ B-Process +soft-lithography I-Process +” I-Process +techniques I-Process +[ O +25 O +] O +introduced O +by O +Whitesides O +et O +al. O +that O +enabled O +the O +widespread O +use O +of O +PDMS B-Material +and O +opened O +up O +the O +era O +of O +PDMS-based B-Process +microfluidics I-Process +in O +the O +late O +1990s O +. O +Replica O +molding O +, O +which O +is O +the O +casting O +of O +prepolymer O +against O +a O +master O +and O +generating O +a O +replica O +of O +the O +master O +in O +PDMS B-Material +, O +has O +become O +a O +standard O +fabrication O +technique O +available O +in O +almost O +every O +research O +laboratory O +. O +Detailed O +overviews O +of O +soft-lithography O +techniques O +and O +their O +applications O +can O +be O +found O +from O +the O +reviews O +by O +McDonald O +et O +al O +. O +[ O +26 O +] O +and O +Sia O +et O +al O +. O +[ O +27 O +] O +. O +Nowadays O +, O +many O +tools O +dedicated O +for O +this O +purpose O +are O +available O +and O +can O +be O +purchased O +as O +a O +complete O +set O +( O +e.g. O +SoftLithoBox O +® O +provided O +by O +Elveflow O +( O +USA O +) O +[ O +28 O +]) O +. O +Moreover O +, O +companies O +, O +such O +as O +FlowJEM O +( O +Canada O +) O +[ O +29 O +] O +, O +Microfluidic O +Innovations O +( O +USA O +) O +[ O +30 O +] O +, O +and O +Scientific O +Device O +Laboratory O +( O +USA O +) O +[ O +31 O +] O +provide O +rapid O +prototyping O +service O +for O +PDMS-based O +LOC O +devices O +. O + +Unlike O +conventional O +materials O +used O +in O +nerve O +tissue O +engineering O +, O +PAs B-Material +can O +be O +directly O +injected B-Process +in I-Process +vivo I-Process +into I-Process +models I-Process +and I-Process +spontaneously I-Process +self-assemble I-Process +into I-Process +nanofibers I-Process +in I-Process +aqueous I-Process +solutions I-Process +. O +Furthermore O +, O +PAs B-Material +can O +function O +as O +biomimetic B-Material +materials I-Material +exemplified O +by O +collagen-mimetic B-Material +PAs I-Material +[ O +92 O +] O +. O +Conventional O +materials O +often O +rely O +on O +electrospinning B-Process +as O +a B-Process +manufacturing I-Process +method I-Process +to O +achieve B-Task +fiber-like I-Task +structures I-Task +suitable O +for O +use O +in O +nerve O +regeneration O +. O +The O +self-assembly O +nature O +of O +PAs B-Material +allows O +them O +to O +circumvent O +costly B-Process +manufacturing I-Process +methods I-Process +. O +However O +, O +in O +contrast O +to O +conventional B-Process +manufacturing I-Process +methods I-Process +like O +electrospinning B-Process +where O +quality O +and O +batch-to-batch O +variability O +can O +be O +tightly O +controlled O +, O +merely O +relying O +on O +self-assembly B-Process +as O +a O +method O +of O +large-scale B-Task +commercial I-Task +production I-Task +is O +still O +an O +experimental O +concept O +. O +Perhaps O +the O +next O +step O +would O +be O +to O +carefully O +compare B-Process +and I-Process +contrast I-Process +the O +robustness B-Task +of I-Task +self-assemled I-Task +PAs I-Task +to I-Task +electrospun I-Task +nanofibers I-Task +. O +Given O +that O +the O +constituent O +elements O +in O +PAs O +and O +external O +factors O +like O +pH O +can O +affect O +its O +structural O +assembly O +, O +parameters O +must O +be O +finely O +tuned B-Process +and I-Process +optimized I-Process +in O +order O +for O +PA B-Material +nanofibers I-Material +to O +be O +used O +as O +a B-Task +full-fledged I-Task +commercialized I-Task +medical I-Task +product I-Task +[ O +93 O +] O +. O + +Mice B-Task +bearing I-Task +the I-Task +orthotopic I-Task +model I-Task +were O +treated O +starting O +from O +day O +21 O +after O +NB O +cell O +implant O +; O +mice B-Task +with I-Task +the I-Task +pseudo-metastatic I-Task +model I-Task +received O +the O +first O +treatment O +4h O +after O +NB O +cell O +injection O +. O +These B-Task +therapeutic I-Task +schedules I-Task +were O +designed O +to O +test B-Process +the I-Process +effects I-Process +of O +our B-Material +targeted I-Material +formulations I-Material +against O +both O +established O +and O +pseudo-metastatic O +preclinical B-Material +models I-Material +of O +human O +NB O +, O +as O +described O +[ O +16,19 O +] O +. O +Animals B-Task +were O +treated O +i.v. O +once O +a O +week O +for O +3 O +weeks O +with O +untargeted B-Material +( O +SL O +[ O +DXR O +]) O +or O +peptide-targeted O +SL B-Material +[ I-Material +DXR I-Material +] I-Material +( O +5mg O +/ O +kg O +) O +. O +Scrambled O +peptide-functionalized O +liposomes O +were O +used O +as O +a O +control O +, O +and O +in O +every O +experiment O +a O +group O +of O +control O +mice O +received O +HEPES-buffered O +saline O +. O +Survival O +times O +were O +used O +as O +the O +main O +criterion O +for O +determining O +treatment O +efficacy O +. O +In O +the O +orthotopic O +model O +, O +time-dependent O +anti-tumor O +activity O +was O +also O +evaluated O +by O +bioluminescence O +imaging O +( O +BLI O +) O +and O +X-ray O +analyses O +. O +For O +this O +purpose O +, O +the O +GI-LI-N O +cell O +line O +was O +infected O +with O +a O +retrovirus O +expressing O +the O +firefly O +luciferase O +gene O +, O +as O +previously O +reported O +[ O +17 O +] O +; O +luciferase O +activity O +of O +retrovirally-transduced O +cells O +was O +visualized O +in O +vivo O +by O +BLI O +( O +IVIS O +Caliper O +Life O +Sciences O +, O +Hopkinton O +, O +MA O +) O +after O +a O +10min O +incubation O +with O +150μg O +/ O +mL O +of O +d-luciferin O +( O +Caliper O +Life O +Sciences O +) O +, O +as O +described O +[ O +17 O +] O +. O +X-ray O +analysis O +was O +superimposed O +to O +the O +luminescence O +for O +a O +better O +visualization O +of O +the O +tumors O +. O + +A O +limitation O +of O +the O +pharmacyte B-Process +approach I-Process +is O +the O +one-time O +nature O +of O +the O +intervention O +: O +ACT B-Material +T-cells I-Material +can O +only O +be O +loaded O +once O +with O +a O +cargo O +of O +adjuvant B-Material +drug I-Material +prior O +to O +transfer O +, O +and O +the O +duration O +of O +stimulation B-Process +is O +inherently O +limited O +by O +expansion B-Process +of I-Process +the I-Process +cell I-Process +population I-Process +in I-Process +vivo I-Process +, O +since O +cell-bound B-Material +particles I-Material +are O +diluted O +with O +each O +cell B-Process +division I-Process +. O +We O +hypothesized O +that O +a O +strategy O +to O +target O +supporting B-Material +drugs I-Material +to O +T-cells B-Material +with O +nanoparticle B-Material +drug I-Material +carriers I-Material +directly O +in O +vivo O +would O +enable O +transferred B-Material +lymphocytes I-Material +to O +be O +repeatedly O +stimulated O +with O +supporting B-Material +adjuvant I-Material +drugs I-Material +, O +and O +thereby O +provide O +continuous O +supporting O +signals O +over O +the O +prolonged O +durations O +that O +might O +be O +necessary O +for O +elimination B-Task +of I-Task +large I-Task +tumor I-Task +burdens I-Task +. O +Such O +“ B-Process +re-arming I-Process +” I-Process +of I-Process +T-cells I-Process +with I-Process +supporting I-Process +drugs I-Process +could O +be O +achieved O +by O +repeated O +administration B-Process +of I-Process +targeted I-Process +particles I-Process +, O +allowing O +adoptively-transferred B-Material +T-cells I-Material +to O +be O +restimulated O +multiple O +times O +directly O +in O +vivo O +, O +while O +the O +use O +of O +internalizing B-Material +targeting I-Material +ligands I-Material +would O +minimize O +the O +likelihood O +of O +immune O +responses O +against O +the O +nanoparticle B-Material +carrier I-Material +. O +To O +our O +knowledge O +, O +only O +two O +prior O +studies O +have O +attempted O +to O +target O +nanoparticles B-Material +to O +T-cells B-Material +in O +vivo O +[ O +17,18 O +] O +. O +In O +both O +of O +these O +studies O +, O +particles O +were O +targeted O +to O +T-cells O +via O +peptide-MHC B-Material +ligands I-Material +that O +bind O +to O +specific O +T-cell B-Material +receptors I-Material +. O +However O +, O +peptide-MHC-functionalized B-Material +nanoparticles I-Material +have O +recently O +been O +shown O +to O +deliver O +an O +anergizing O +/ O +tolerizing O +signal O +to O +T-cells B-Material +[ O +18,19 O +] O +— O +which O +is O +ideal O +for O +treating B-Task +graft I-Task +rejection I-Task +or I-Task +autoimmunity I-Task +, O +but O +runs O +counter O +to O +the O +goals O +of O +cancer B-Task +immunotherapy I-Task +. O + +The O +α-ω-aminohexylcarbamate B-Material +derivative I-Material +of I-Material +cyanocobalamin I-Material +was O +prepared O +using O +a O +method O +described O +previously O +[ O +18 O +] O +. O +Briefly O +, O +solid B-Material +CDI I-Material +( O +260mg O +, O +0.32mmol O +) O +was O +added O +to O +cyanocobalamin B-Material +( O +1.0g O +, O +0.148mmol O +) O +previously O +dissolved O +in O +anhydrous B-Material +dimethyl I-Material +sulfoxide I-Material +. O +The O +mixture O +was O +stirred O +for O +up O +to O +2h O +at O +30 O +° O +C O +, O +followed O +by O +the O +addition O +of O +dry B-Material +1,6-hexanediamine I-Material +( O +314mg O +, O +0.54mmol O +) O +and O +stirring O +of O +the O +mixture O +at O +room O +temperature O +over O +24h O +. O +The O +mixture O +was O +poured O +into O +ethyl B-Material +acetate I-Material +( O +30ml O +) O +and O +left O +to O +stand O +. O +Following O +centrifugation B-Process +and O +decanting B-Process +of O +the O +supernatant B-Material +, O +the O +residue B-Material +was O +sonicated O +for O +5min O +in O +acetone B-Material +( O +50ml O +) O +. O +The O +resulting O +precipitate B-Material +was O +filtered O +and O +the O +solid B-Material +washed O +in O +acetone B-Material +. O +The O +crude B-Material +product I-Material +was O +purified O +by O +silica B-Process +column I-Process +chromatography I-Process +( O +45 O +% O +v O +/ O +v O +2-propanol O +, O +30 O +% O +v O +/ O +v O +n-butanol O +, O +2 O +% O +v O +/ O +v O +ammonia O +and O +25 O +% O +v O +/ O +v O +water O +) O +followed O +by O +lyophilisation O +. O + +Immunopotentiators B-Material +activate B-Process +innate I-Process +immunity I-Process +directly O +( O +for O +example O +, O +cytokines O +) O +or O +through O +pattern-recognition B-Process +receptors I-Process +( O +PRRs B-Process +, O +such O +as O +those O +for O +bacterial O +components O +) O +. O +The O +Toll-like B-Process +receptors I-Process +( O +TLRs B-Process +) O +are O +a O +family O +of O +PRRs B-Process +that O +are O +an O +important O +link O +between O +innate O +and O +adaptive O +immunity O +. O +Some O +studies O +have O +shown O +that O +TLR B-Material +ligands I-Material +have O +adjuvant O +activity O +and O +enhance O +antigen-specific O +antibody O +and O +cell-mediated O +immune O +responses O +, O +especially O +when O +they O +are O +combined O +with O +delivery O +systems O +that O +promote O +their O +uptake O +and O +delivery O +into O +antigen-presenting B-Material +cells I-Material +[ O +22 O +– O +24 O +] O +. O +For O +clinical B-Task +studies I-Task +, O +TLR9 B-Material +is O +generally O +stimulated B-Process +with O +synthetic B-Material +oligodeoxynucleotides I-Material +containing O +one O +or O +more O +unmethylated B-Material +CpG I-Material +dinucleotides I-Material +. O +In O +humans O +, O +CpG O +has O +been O +used O +as O +an O +adjuvant B-Material +for O +infectious B-Task +disease I-Task +vaccination I-Task +[ O +25,26 O +] O +and O +in O +the O +development O +of O +cancer O +therapy O +[ O +27 O +] O +. O +In O +a O +mouse O +model O +, O +CpG O +has O +also O +been O +shown O +to O +induce O +T O +helper O +1 O +( O +Th1 O +) O +immune O +responses O +, O +which O +are O +characterized O +by O +the O +production O +of O +IFN-γ O +and O +the O +generation O +of O +IgG2a O +[ O +28,29 O +] O +. O +Moreover O +, O +a O +previous O +study O +had O +demonstrated O +that O +different O +liposomes O +with O +CpG O +ODN O +significantly O +increased O +Th1-biased O +cytokines O +and O +augmented O +cell O +mediated O +immune O +response O +[ O +30 O +] O +. O + +Two O +methods O +of O +formulating B-Task +anionic I-Task +nanocomplexes I-Task +were O +evaluated O +. O +In O +both O +, O +nanocomplexes O +were O +prepared B-Process +in O +water O +at O +a O +range O +of O +molar O +charge O +ratios O +of O +L O +to O +D O +while O +the O +peptide O +P O +to O +D O +molar O +charge O +ratio O +was O +maintained O +constant O +at O +3:1 O +. O +Method O +1 O +( O +L O +: O +D O +: O +P O +) O +: O +DNA B-Material +was O +first O +added B-Process +to O +an B-Material +anionic I-Material +liposome I-Material +( O +LA B-Material +, I-Material +LAP1 I-Material +or I-Material +LAP2 I-Material +) O +and O +incubated B-Process +for O +15min O +at O +room O +temperature O +and O +then O +the O +peptide O +was O +added B-Process +with O +rapid O +mixing O +and O +incubated B-Process +at O +room O +temperature O +for O +a O +further O +20min O +; O +Method O +2 O +( O +P O +: O +D O +: O +L O +) O +: O +the O +peptide B-Material +was O +added B-Process +to O +the O +DNA O +and O +incubated B-Process +for O +15min O +at O +room O +temperature O +and O +then O +liposome B-Material +was O +added B-Process +with O +rapid O +mixing O +and O +incubated B-Process +at O +room O +temperature O +for O +a O +further O +20min O +. O +Irrespective O +of O +the O +method O +of O +order O +of O +mixing O +, O +all O +molar O +charge O +ratios O +in O +this O +study O +refer O +to O +L O +: O +P O +: O +D O +. O +Cationic O +formulations O +LPD B-Material +and O +LCPRGPD B-Material +were O +prepared O +in O +the O +order O +L O +: O +P O +: O +D O +as O +described O +previously O +; O +first O +, O +the O +peptide O +was O +added B-Process +to O +the O +liposome O +DOTMA B-Material +/ O +DOPE B-Material +or O +LCPRG B-Material +followed O +by O +addition O +of O +the O +DNA B-Material +with O +rapid B-Process +mixing I-Process +and I-Process +incubated I-Process +for O +30min O +at O +room O +temperature O +to O +allow O +for O +complex O +formation O +[ O +30 O +] O +. O +The O +nanocomplexes O +prepared O +were O +termed O +LPD B-Material +( O +liposome B-Material +DOTMA I-Material +/ I-Material +DOPE I-Material +) O +, O +LADP B-Material +and O +PDLA B-Material +( O +liposome B-Material +LA I-Material +) O +, O +PDLAP1 B-Material +( O +liposome B-Material +LAP1 I-Material +) O +, O +PDLAP2 B-Material +( O +liposome B-Material +LAP2 I-Material +) O +, O +PDLAPRG B-Material +( O +liposome B-Material +LAPRG I-Material +) O +and O +LCPRGPD B-Material +( O +liposome B-Material +LCPRG I-Material +) O +. O + +The O +crack B-Process +band I-Process +approach I-Process +for O +producing O +mesh O +independent O +load O +– O +displacement O +curves O +for O +fracture O +in O +plain O +concrete O +is O +based O +on O +the O +idea O +that O +the O +crack O +opening O +is O +transformed O +into O +inelastic O +strain O +by O +distributing O +it O +over O +an O +element O +length O +dependent O +zone O +[ O +5 O +] O +. O +This O +approach O +will O +only O +produce O +mesh O +independent O +load O +– O +displacement O +curves O +, O +if O +the O +inelastic O +strain O +profiles O +in O +the O +finite O +element O +analysis O +are O +mesh O +size O +dependent O +. O +This O +requirement O +is O +an O +important O +difference O +to O +the O +nonlocal O +model O +which O +is O +designed O +to O +produce O +both O +mesh O +size O +independent O +load O +– O +displacement O +curves O +and O +strain O +profiles O +. O +In O +CDPM2 O +, O +the O +crack O +band O +approach O +is O +applied O +only O +to O +the O +tensile B-Material +part I-Material +of O +the O +damage O +algorithm O +by O +replacing O +the O +stress B-Process +– I-Process +inelastic I-Process +strain I-Process +law I-Process +shown O +in O +Fig. O +2 O +( O +b O +) O +by O +a O +stress B-Process +– I-Process +inelastic I-Process +displacement I-Process +law I-Process +of O +the O +form O +( B-Process +13 I-Process +) I-Process +σ I-Process += I-Process +ftexp I-Process +(− I-Process +ϵinhwft I-Process +) I-Process +if I-Process +( I-Process +ϵin I-Process +> I-Process +0 I-Process +) I-Process +Here O +, O +wft O +is O +a O +crack O +opening O +threshold O +used O +to O +control O +the O +slope O +of O +the O +softening O +curve O +and O +h O +is O +the O +width O +of O +the O +crack-band O +, O +which O +in O +the O +present O +study O +is O +equal O +to O +the O +maximum O +dimension O +of O +the O +element O +along O +the O +principal O +direction O +of O +the O +strain O +tensor O +corresponding O +to O +the O +maximum O +tensile O +principal O +strain O +at O +the O +onset O +of O +damage O +. O +For O +the O +compressive O +part O +, O +a O +stress B-Process +– I-Process +inelastic I-Process +strain I-Process +law I-Process +was O +used O +to O +determine O +the O +compressive O +damage O +parameter O +, O +since O +it O +was O +reported O +in O +[ O +14 O +] O +for O +columns O +subjected O +to O +eccentric O +compression O +that O +inelastic B-Material +strain I-Material +profiles I-Material +in O +compression O +do O +not O +exhibit O +a O +mesh O +dependence O +which O +would O +satisfy O +the O +assumptions O +of O +the O +crack-band B-Process +approach I-Process +. O +This O +approach O +of O +applying O +the O +crack-band O +approach O +only O +to O +the O +tensile B-Material +part I-Material +has O +already O +been O +successfully O +used O +in O +Grassl O +et O +al O +. O +[ O +16 O +] O +. O + +HOMO B-Material +– I-Material +LUMO I-Material +energy O +band O +gaps O +between O +ylides B-Material +and O +their O +pyrene B-Material +adducts I-Material +propose O +that O +the O +1,3-DC B-Material +of O +second B-Material +pyridinium I-Material +ylides I-Material +to O +ylidepyrene B-Material +adducts I-Material +are O +HOMOylide B-Material +– I-Material +LUMOylide I-Material +– I-Material +pyrene I-Material +controlled O +since O +the O +energy O +band O +gap O +is O +smaller O +than O +HOMOylide B-Material +– I-Material +pyrene I-Material +– I-Material +LUMOylide I-Material +. O +Regioselectivity B-Task +of I-Task +second I-Task +cycloaddition I-Task +was O +predicted O +using O +the O +atomic B-Process +orbital I-Process +coefficients I-Process +corresponding O +to O +HOMOylide B-Material +– I-Material +LUMOylide I-Material +– I-Material +pyrene I-Material +. O +According O +to O +Fukui O +[ O +33 O +] O +, O +reactions O +can O +be O +favorable O +in O +the O +direction O +of O +maximal B-Task +HOMO I-Task +– I-Task +LUMO I-Task +overlapping I-Task +of O +larger O +coefficients O +at O +the O +reactive O +sites O +. O +The O +most O +favorable O +interactions O +between O +corresponding O +ylides B-Material +and I-Material +ylidepyrene I-Material +adducts I-Material +to O +form O +the O +most B-Process +favorable I-Process +regioisomer I-Process +conformation I-Process +are O +given O +in O +Fig. O +3. O +Second O +ylide B-Material +addition O +to O +ylidepyrene B-Material +structure O +is O +therefore O +anticipated O +to O +proceed O +via O +ylideC2 B-Material +/ I-Material +C6 I-Material +– I-Material +ylidepyrene-C3 I-Material +and O +ylideC7 B-Material +– I-Material +ylidepyrene I-Material +/ I-Material +C2 I-Material +interactions O +to O +produce O +the O +same O +regioisomer B-Task +conformations I-Task +. O +Considering O +the O +theoretical B-Process +calculations I-Process +performed O +for O +pyrrolidine B-Material +attached I-Material +pyrene I-Material +structure O +, O +it O +is O +also O +expected O +that O +formation B-Process +of I-Process +the I-Process +same I-Process +type I-Process +of I-Process +regioisomers I-Process +are O +favorable O +for O +SWNTs B-Process +after O +the O +1,3-DC B-Material +of I-Material +pyridinium I-Material +ylides I-Material +, O +Fig. O +3 O +. O + +Gamma B-Material +titanium I-Material +aluminides I-Material +are O +a O +family O +of O +low O +density O +, O +high O +performance O +alloys B-Material +with O +the O +potential O +to O +replace O +current O +Ni-base B-Material +superalloys I-Material +used O +in O +the O +production B-Task +of I-Task +aero-engine I-Task +components I-Task +. O +Investment B-Process +casting I-Process +is O +one O +of O +the O +most O +economical O +methods O +to O +produce B-Task +titanium I-Task +and I-Task +titanium I-Task +aluminide I-Task +alloy I-Task +products I-Task +, O +increasing O +the O +components' O +integrity O +and O +mechanical O +properties O +, O +whilst O +reducing O +material O +waste O +and O +machining O +cost O +[ O +1 O +] O +. O +Titanium O +aluminides O +are O +difficult O +to O +process O +mainly O +due O +to O +the O +low O +fluidity O +of O +the O +TiAl O +alloy O +around O +its O +melting O +temperature O +[ O +2 O +] O +. O +Due O +to O +the O +high O +affinity O +of O +elements O +such O +as O +oxygen O +, O +nitrogen O +etc. O +, O +titanium O +and O +its O +alloys O +can O +easily O +interact O +with O +mould O +materials O +during O +the O +investment O +casting O +process O +, O +resulting O +in O +an O +interaction O +hardened O +layer O +being O +generated O +at O +the O +metal O +surface O +[ O +3,4 O +] O +. O +This O +hardened O +layer O +contains O +a O +large O +amount O +of O +dissolved O +oxygen O +, O +and O +it O +is O +very O +brittle O +and O +susceptible O +to O +crack O +generation O +and O +propagation O +[ O +5 O +] O +. O + +From O +this O +study O +where O +a O +commercial O +Al B-Material +– I-Material +12Si I-Material +alloy I-Material +was O +inoculated B-Process +with I-Process +different I-Process +level I-Process +of I-Process +Nb I-Process ++ I-Process +B I-Process +addition O +to O +assess O +the O +grain B-Task +refining I-Task +potency I-Task +of I-Task +Nb I-Task ++ I-Task +B I-Task +inoculation I-Task +it O +can O +be O +concluded O +that O +in-situ O +formed O +Nb-based B-Material +intermetallics I-Material +compounds I-Material +are O +potent O +heterogeneous B-Material +nucleation I-Material +substrates I-Material +with O +high O +potency O +for O +the O +refinement B-Process +of I-Process +Al I-Process +– I-Process +Si I-Process +cast I-Process +alloys I-Process +. O +The O +primary O +α-Al B-Material +dendritic I-Material +grain I-Material +size O +varies O +with O +the O +addition O +level O +of O +Nb B-Material +and O +B. O +Moreover O +, O +significant O +grain O +refinement O +over O +a O +wide O +range O +of O +cooling O +rates O +is O +obtained O +via O +enhanced O +heterogeneous O +nucleation O +making O +the O +grain O +size O +of O +the O +material O +less O +sensitive O +to O +the O +cooling O +rate O +. O +Nb O ++ O +B B-Material +inoculants O +are O +characterised O +by O +some O +fading O +which O +is O +still O +acceptable O +after O +4 O +h O +of O +contact O +time O +. O +Moreover O +, O +alloys O +refined O +by O +means O +of O +Nb O ++ O +B O +inoculants O +can O +be O +recycled O +obtaining O +a O +fine O +grain O +structure O +with O +small O +addition O +or O +no O +further O +addition O +of O +inoculants O +after O +the O +first O +initial O +addition O +. O +Concluding O +, O +Nb O ++ O +B O +inoculation O +is O +a O +promising O +candidate O +for O +the O +refinement O +of O +cast O +Al O +alloy O +which O +could O +lead O +to O +their O +wider O +employment O +in O +the O +automotive O +industry O +with O +the O +resultant O +intrinsic O +advantages O +of O +lighter O +structural O +component O +from O +an O +environmental O +point O +of O +view O +. O + +The O +observed B-Task +conductivity I-Task +of O +A2FeMoO6 B-Material +– I-Material +δ I-Material +( O +A O += O +Ca B-Material +, O +Sr B-Material +, O +Ba B-Material +) O +[ O +7 O +] O +was O +linked O +to O +a O +potential O +double B-Process +exchange I-Process +mechanism I-Process +, O +with O +conduction O +between O +Fe3 B-Material ++- I-Material +O-Mo-O-Fe2 I-Material ++ I-Material +. O +Double-exchange B-Process +mechanisms I-Process +, O +as O +proposed O +by O +Zener O +[ O +23 O +] O +, O +posit O +that O +electron B-Process +transfer I-Process +between O +ions B-Material +in O +different O +oxidation B-Process +states O +may O +be O +facilitated O +if O +the O +electron B-Material +does O +not O +have O +to O +alter O +its O +spin O +state O +. O +Replacement B-Process +of O +Mo B-Material +with O +Fe B-Material +in O +this O +mechanism O +would O +be O +expected O +to O +result O +in O +a O +reduction B-Process +of I-Process +the I-Process +conductivity I-Process +through O +reduction B-Process +of I-Process +the I-Process +available I-Process +percolation I-Process +pathways I-Process +, O +unless O +delocalisation B-Process +of I-Process +Fe I-Process +electrons I-Process +through O +Fe2 B-Process ++- I-Process +O-Fe3 I-Process ++ I-Process +exchange I-Process +could O +also O +occur O +. O +Double B-Process +exchange I-Process +mechanisms I-Process +have O +been O +observed O +previously O +for O +mixed O +valent O +iron B-Material +in I-Material +iron I-Material +oxides I-Material +[ O +24 O +] O +, O +and O +, O +as O +iron O +is O +known O +to O +exist O +in O +a O +mixed O +valent O +state O +for O +Ca2 B-Material +– I-Material +xSrxFeMoO6 I-Material +– I-Material +δ I-Material +[ O +25 O +] O +, O +this O +provides O +a O +plausible O +explanation O +for O +the O +observed O +metallic B-Task +conductivity I-Task +. O +Band B-Process +structure I-Process +calculations I-Process +and O +Mossbauer B-Process +spectroscopy I-Process +could O +be O +utilised O +to O +further O +elucidate O +the O +conduction B-Task +mechanism I-Task +for O +these O +compounds B-Material +, O +however O +this O +is O +outside O +the O +scope O +of O +this O +enquiry O +. O + +To O +address O +the O +vertical B-Task +displacement I-Task +estimation I-Task +of I-Task +conventional I-Task +pile I-Task +groups I-Task +subjected I-Task +to I-Task +mechanical I-Task +loads I-Task +, O +various O +numerical B-Process +and I-Process +analytical I-Process +methods I-Process +have O +been O +proposed O +. O +These O +methods O +include O +the O +finite B-Process +element I-Process +method I-Process +[ O +e.g. O +, O +2,3 O +] O +, O +the O +boundary B-Process +element I-Process +method I-Process +[ O +e.g. O +, O +4,5 O +] O +, O +the O +finite B-Process +difference I-Process +method I-Process +[ O +e.g. O +, O +6 O +] O +, O +the O +interaction B-Process +factor I-Process +method I-Process +[ O +e.g. O +, O +7,8 O +– O +11 O +] O +, O +the O +equivalent B-Process +pier I-Process +and I-Process +raft I-Process +methods I-Process +[ O +e.g. O +, O +12 O +– O +14 O +] O +, O +and O +the O +settlement B-Process +ratio I-Process +method I-Process +[ O +e.g. O +, O +15 O +] O +. O +The O +finite B-Process +element I-Process +method I-Process +, O +while O +providing O +the O +most O +rigorous O +and O +exhaustive O +representation O +of O +the O +pile B-Task +group-related I-Task +problem I-Task +, O +is O +generally O +computationally O +expensive O +and O +considered O +mainly O +a O +research B-Material +tool I-Material +rather O +than O +a O +design B-Material +tool I-Material +. O +Conversely O +, O +the O +versatility B-Process +of I-Process +simplified I-Process +( I-Process +approximate I-Process +) I-Process +methods I-Process +, O +such O +as O +the O +interaction B-Process +factor I-Process +approach I-Process +that O +allows O +capturing B-Process +the I-Process +( I-Process +e.g. I-Process +, I-Process +vertical I-Process +) I-Process +displacements I-Process +of I-Process +any I-Process +general I-Process +pile I-Process +group I-Process +by O +the O +analysis B-Process +of I-Process +the I-Process +displacement I-Process +interaction I-Process +between I-Process +two I-Process +identical I-Process +piles I-Process +and O +by O +the O +use O +of O +the O +elastic B-Process +principle I-Process +of I-Process +superposition I-Process +of I-Process +effects I-Process +, O +makes O +them O +attractive O +as O +design B-Material +tools I-Material +because O +they O +allow O +for O +the O +use O +of O +expedient B-Task +parametric I-Task +studies I-Task +under O +various O +design O +conditions O +. O + +The O +optimised B-Task +structure I-Task +at O +the O +B3LYP B-Process +/ I-Process +aug-cc-pVTZ I-Process +level O +was O +then O +used O +to O +perform O +calculations O +of O +the O +lowest B-Process +electronic I-Process +singlet I-Process +excited O +states O +with O +the O +coupled O +cluster O +linear B-Process +response I-Process +( O +LR B-Process +) O +coupled B-Process +cluster I-Process +hierarchy I-Process +CCS B-Process +, O +CC2 B-Process +, O +CCSD B-Process +and O +CC3 B-Process +, O +along O +with O +perturbative B-Process +corrected I-Process +methods I-Process +CIS B-Process +( I-Process +D I-Process +) I-Process +and O +CCSDR B-Process +( I-Process +3 I-Process +) I-Process +. O +The O +correlated B-Process +response I-Process +methods I-Process +were O +performed O +with O +an O +all-electron O +atomic B-Process +natural I-Process +orbital I-Process +( O +ANO B-Process +) O +basis O +set O +contracted O +to O +6s5p4d3f1g B-Process +on O +manganese B-Material +, O +[ O +47 O +] O +together O +with O +the O +cc-pVTZ B-Process +basis O +set O +on O +the O +oxygen B-Material +atoms O +. O +The O +all-electron B-Process +correlated I-Process +calculations I-Process +invoked O +a O +13 O +orbital O +frozen O +core O +( O +O B-Material +1s O +, O +Mn B-Material +1s2s2p3s3p O +) O +. O +Trial O +calculations O +correlating O +these O +orbitals O +only O +had O +a O +minor O +effect O +on O +excitation B-Task +energies I-Task +. O +For O +comparison O +the O +EOM-CCSD B-Process +method I-Process +with O +the O +cc-pVTZ B-Process +basis O +on O +all O +atoms O +was O +tested O +to O +compare O +with O +LR-CCSD B-Process +. O +These O +formally O +give O +exactly O +the O +same O +excitation B-Task +energies I-Task +, O +although O +the O +transition B-Task +moments I-Task +are O +more O +accurate O +for O +LR-CCSD B-Process +. O +Abelian B-Process +symmetry I-Process +( O +D2 B-Process +) O +was O +used O +in O +all O +correlated O +excited B-Process +state I-Process +calculations I-Process +. O + +Arrays O +of O +TFTs B-Material +and O +circuits B-Material +were O +fabricated O +on O +precleaned O +, O +5cm O +× O +5cm O +, O +125μm O +thick O +polyethylene B-Material +naphthalate I-Material +( O +PEN B-Material +) O +substrates O +( O +Dupont-Teijin O +) O +. O +Full O +details O +of O +our O +vacuum-fabrication B-Process +procedures I-Process +have O +been O +given O +in O +previous O +publications O +[ O +17 O +– O +19,23 O +] O +. O +Briefly O +, O +aluminium B-Material +gate I-Material +electrodes I-Material +and O +associated O +tracks B-Material +were O +vacuum B-Process +evaporated I-Process +onto O +the O +substrates B-Material +through O +shadow B-Material +masks I-Material +. O +Subsequently O +, O +the O +substrates B-Material +were O +attached O +to O +a O +cooled O +web-coater B-Material +drum I-Material +( O +Aerre O +Machines O +) O +. O +With O +the O +drum O +rotating O +at O +a O +linear O +speed O +of O +25m O +/ O +min O +under O +vacuum O +, O +flash-evaporated B-Material +TPGDA I-Material +monomer I-Material +vapour I-Material +which O +condensed O +onto O +the O +substrates B-Material +was O +cross-linked B-Process +by O +exposure B-Process +, O +in O +situ O +, O +to O +a O +plasma B-Material +. O +The O +resulting O +smooth O +, O +pinhole-free O +films B-Material +were O +typically O +500nm O +to O +1μm O +thick O +with O +a O +measured O +dielectric O +constant O +varying O +in O +the O +range O +4 O +– O +5 O +. O +For O +circuit B-Task +fabrication I-Task +, O +the O +insulator B-Material +was O +patterned O +using O +shadow B-Material +masks I-Material +to O +define O +rectangular O +areas O +separated O +by O +1mm O +gaps O +to O +act O +as O +vias O +for O +inter-layer B-Process +metallic I-Process +connections I-Process +. O +The O +substrates B-Material +were O +then O +transferred O +into O +an O +evaporator B-Material +( O +Minispectros O +, O +Kurt O +Lesker O +) O +integrated O +into O +a O +nitrogen B-Material +glovebox I-Material +for O +the O +vacuum-deposition O +( O +2.4nm O +/ O +min O +) O +of O +DNTT O +onto O +the O +insulator O +. O +Without O +exposing O +the O +substrates O +to O +ambient O +air O +, O +the O +gold O +source O +/ O +drain O +metallisation O +layer O +was O +deposited O +through O +a O +shadow O +mask O +in O +the O +same O +evaporator O +. O + +For O +decades O +, O +vibronic B-Process +coupling I-Process +models I-Process +[ O +1 O +– O +4 O +] O +have O +served O +as O +bridges O +connecting O +nuclear B-Task +dynamics I-Task +studies I-Task +with O +the O +static O +studies O +of O +electronic B-Task +structure I-Task +calculations I-Task +[ O +5 O +] O +. O +The O +vibronic B-Process +coupling I-Process +model I-Process +is O +a O +simple O +polynomial B-Task +expansion I-Task +of O +diabatic B-Task +potential I-Task +energy I-Task +surfaces I-Task +and I-Task +couplings I-Task +. O +The O +expansion B-Process +coefficients I-Process +are O +chosen O +so O +that O +the O +eigenvalues O +of O +the O +potential O +operator O +map O +on O +to O +the O +adiabatic O +potential O +surfaces O +. O +This O +diabatisation B-Process +by O +ansatz O +circumvents O +many O +of O +the O +problems O +of O +describing O +non-adiabatic B-Task +systems I-Task +. O +It O +is O +also O +the O +inspiration O +for O +a O +diabatisation B-Process +scheme I-Process +that O +is O +used O +in O +modern O +, O +direct-dynamic B-Process +methods I-Process +that O +include O +non-adiabatic O +effects O +[ O +6 O +] O +. O +For O +a O +model B-Process +Hamiltonian I-Process +to O +correctly O +approximate O +the O +eigenvectors O +of O +the O +true B-Process +Hamiltonian I-Process +it O +has O +to O +span O +the O +totally O +symmetric O +irreducible B-Process +representation I-Process +( O +IrRep B-Process +) O +of O +the O +point O +groups O +the O +molecule O +belongs O +to O +, O +at O +the O +appropriate O +symmetric B-Process +geometries I-Process +[ O +7 O +] O +. O +In O +recent O +times O +, O +many O +articles O +have O +demonstrated O +the O +advantages O +of O +using O +symmetry O +when O +constructing O +analytic B-Process +model I-Process +potentials I-Process +[ O +8 O +– O +12 O +] O +, O +most O +often O +in O +the O +context O +of O +permutation-inversion B-Process +groups I-Process +[ O +13 O +] O +. O + +In O +the O +present O +work O +, O +a O +LIF B-Process +technique I-Process +is O +applied O +for O +investigation O +of O +gas-sheared B-Task +film I-Task +flow I-Task +in O +horizontal O +rectangular O +duct B-Material +. O +The O +technique O +makes O +it O +possible O +to O +perform O +field B-Process +measurements I-Process +of I-Process +local I-Process +film I-Process +thickness I-Process +, O +resolved O +in O +both O +space O +and O +time O +, O +similar O +to O +the O +work O +of O +Alekseenko O +et O +al O +. O +( O +2009 O +) O +. O +The O +flat O +shape O +and O +large O +transverse O +size O +of O +the O +duct B-Material +allow O +us O +to O +resolve B-Process +the I-Process +film I-Process +thickness I-Process +in O +transverse O +coordinate O +as O +well O +. O +Alekseenko O +et O +al O +. O +( O +2012 O +) O +attempted O +to O +do O +this O +in O +annular B-Process +downward I-Process +flow I-Process +, O +but O +, O +for O +technical O +reasons O +, O +the O +sampling B-Process +frequency I-Process +was O +not O +high O +enough O +in O +their O +experiments O +. O +More O +recently O +Alekseenko O +et O +al O +. O +( O +2014a O +) O +showed O +that O +the O +LIF B-Process +technique I-Process +can O +also O +detect B-Task +entrained I-Task +droplets I-Task +. O +The O +technique O +allows O +the O +simultaneous O +study O +of O +three-dimensional B-Material +wavy I-Material +structures I-Material +and O +liquid B-Task +entrainment I-Task +, O +and O +can O +improve B-Task +understanding I-Task +of I-Task +the I-Task +entrainment I-Task +phenomenon I-Task +. O + +In O +general O +, O +liquid B-Process +film I-Process +flows I-Process +of O +practical O +relevance O +are O +turbulent O +and O +, O +hence O +, O +are O +associated O +with O +the O +presence O +of O +broadband B-Material +interfacial I-Material +waves I-Material +on O +the O +film B-Material +surface I-Material +. O +A O +thorough O +understanding B-Task +of I-Task +the I-Task +characteristic I-Task +profiles I-Task +, I-Task +scales I-Task +and I-Task +dynamics I-Task +of I-Task +these I-Task +interfacial I-Task +waves I-Task +is O +of O +essential O +importance O +in O +making O +accurate O +and O +reliable O +predictions O +of O +heat O +and O +mass O +transfer O +rates O +( O +Mathie O +and O +Markides O +, O +2013a O +; O +Mathie O +et O +al. O +, O +2013 O +) O +. O +Previous O +efforts O +in O +downwards B-Process +annular I-Process +flow I-Process +have O +focused O +on O +the O +spatio B-Process +/ I-Process +temporal I-Process +measurement I-Process +of O +liquid B-Process +film I-Process +thickness I-Process +, O +followed O +by O +in-depth O +statistical B-Process +analyses I-Process +of O +this O +film B-Material +thickness O +( O +Webb O +and O +Hewitt O +, O +1975 O +; O +Belt O +et O +al. O +, O +2010 O +; O +Alekseenko O +et O +al. O +, O +2012 O +; O +Zhao O +et O +al. O +, O +2013 O +) O +. O +These O +efforts O +have O +contributed O +to O +a O +much O +improved O +understanding O +of O +the O +interfacial B-Task +topology I-Task +observed O +in O +downwards B-Process +annular I-Process +flows I-Process +and O +also O +to O +the O +subsequent O +proposal O +of O +a O +series O +of O +correlations O +for O +the O +quantification B-Task +of I-Task +the I-Task +mean I-Task +film I-Task +thickness I-Task +, I-Task +wave I-Task +amplitudes I-Task +and I-Task +liquid I-Task +entrainment I-Task +rates I-Task +into O +the O +gas B-Material +phase O +( O +Ambrosini O +et O +al. O +, O +1991 O +; O +Karapantsios O +and O +Karabelas O +, O +1995 O +; O +Azzopardi O +, O +1997 O +) O +. O +On O +the O +other O +hand O +, O +less O +has O +been O +published O +on O +the O +velocity B-Process +distribution I-Process +and O +the O +flow B-Process +structure I-Process +within I-Process +the I-Process +liquid I-Process +films I-Process +, O +underneath O +the O +film B-Material +surface I-Material +. O +This O +can O +be O +related O +to O +the O +relative O +difficulty O +of O +these O +measurements O +caused O +by O +: O +( O +i O +) O +the O +extremely O +restricted O +measurement O +space O +, O +due O +to O +the O +small O +thickness B-Task +of I-Task +the I-Task +liquid I-Task +films I-Task +( O +in O +the O +order O +of O +and O +often O +sub-mm O +) O +, O +( O +ii O +) O +the O +highly O +disturbed O +and O +intermittent O +nature O +of O +the O +gas B-Process +– I-Process +liquid I-Process +interface I-Process +, O +( O +iii O +) O +the O +entrainment B-Process +of I-Process +gas I-Process +inside O +the O +liquid B-Material +film I-Material +and O +of O +liquid O +into O +the O +gas B-Material +core I-Material +, O +and O +( O +iv O +) O +the O +relatively O +high B-Task +velocities I-Task +of O +both O +the O +gas B-Material +and O +liquid B-Material +phases O +. O + +There O +is O +also O +a O +lack O +of O +agreement O +as O +to O +what O +constitutes O +churn B-Process +flow I-Process +. O +It O +is O +fairly O +certainly O +a O +gas B-Process +continuous I-Process +flow I-Process +. O +There O +is O +growing O +agreement O +that O +there O +are O +huge B-Material +waves I-Material +present O +and O +some O +of O +the O +liquid B-Material +is O +carried O +as O +drops O +. O +Sekoguchi O +and O +Mori O +( O +1997 O +) O +and O +Sawai O +et O +al O +. O +( O +2004 O +) O +using O +measurements O +from O +their O +multiple O +probes B-Material +( O +92 O +over O +an O +axial O +length O +of O +2.325 O +m O +) O +obtained O +time B-Process +/ I-Process +axial I-Process +position I-Process +/ I-Process +void I-Process +fraction I-Process +information I-Process +. O +From O +this O +they O +were O +able O +to O +identify B-Process +huge I-Process +wave I-Process +from O +amongst O +disturbance B-Material +waves I-Material +and O +slugs B-Material +. O +They O +classified O +individual O +structures O +as O +huge B-Material +waves I-Material +from O +their O +size O +together O +with O +the O +fact O +that O +their O +velocities O +depended O +significantly O +on O +the O +corresponding O +axial O +length O +. O +This O +was O +in O +contrast O +to O +disturbance B-Material +waves I-Material +where O +the O +velocity B-Process +of I-Process +individual I-Process +waves I-Process +only O +increased O +slightly O +with O +the O +axial O +extent O +of O +these O +waves O +. O +They O +also O +found O +that O +the O +frequency B-Process +of I-Process +huge I-Process +waves I-Process +first O +increased O +and O +then O +decrease O +with O +increasing O +gas B-Material +superficial O +velocity O +. O +Similarly O +, O +their O +velocities O +were O +found O +to O +deviate O +from O +the O +line O +for O +slug B-Process +flow I-Process +velocities I-Process +and O +pass O +through O +a O +maximum O +and O +then O +a O +minimum O +. O + +The O +scheduling B-Process +process I-Process +we O +adopt O +matches O +a O +multiple B-Process +stage I-Process +stochastic I-Process +programming I-Process +approach I-Process +. O +Standard O +two-stage B-Process +stochastic I-Process +programs I-Process +with O +linear B-Process +or I-Process +convex I-Process +functions I-Process +are O +often O +solved O +using O +the O +L-shaped B-Process +method I-Process +or O +Bender B-Process +'s I-Process +decomposition I-Process +[ O +44,6,7 O +] O +. O +However O +, O +our O +recourse B-Process +decision I-Process +( O +scheduled B-Process +cancellations I-Process +) O +is O +still O +anticipative O +to O +further O +uncertainty O +, O +namely O +the O +second O +shift O +surgery O +durations O +, O +unavailability O +and O +cancellations O +. O +As O +such O +, O +the O +decision B-Task +problem I-Task +can O +be O +viewed O +as O +a O +three-stage B-Process +recourse I-Process +model I-Process +[ O +5,6 O +] O +. O +Solving O +the O +scheduling B-Task +problem I-Task +is O +further O +complicated O +because O +the O +recourse B-Process +function I-Process +is O +integer O +. O +Laporte O +and O +Louveaux O +[ O +26 O +] O +propose O +modified B-Process +L-shaped I-Process +decomposition I-Process +with O +adjusted O +optimal O +cuts O +for O +two B-Process +stage I-Process +stochastic I-Process +program I-Process +with O +integer B-Process +recourse I-Process +. O +Angulo O +et O +al O +. O +[ O +1 O +] O +alternately O +generate B-Process +optimal I-Process +cuts I-Process +of I-Process +the I-Process +linear I-Process +sub-problem I-Process +and I-Process +the I-Process +integer I-Process +sub-problem I-Process +, O +which O +improves O +the O +practical O +convergence O +( O +see O +also O +[ O +15,8 O +]) O +. O +We O +follow O +a O +sample B-Process +average I-Process +approximation I-Process +approach I-Process +( O +SAA B-Process +) O +which O +uses O +this O +framework O +. O +Moreover O +, O +we O +prove O +and O +exploit O +a O +specific O +relationship O +between O +the O +first-stage B-Process +realization I-Process +and O +the O +optimal O +number O +of O +scheduled O +cancellations O +to O +speed O +up O +the O +computation O +of O +integer B-Process +cuts I-Process +. O +We O +use O +Jensen B-Process +'s I-Process +inequality I-Process +[ O +17 O +] O +to O +upper B-Task +bound I-Task +the I-Task +minus I-Task +second I-Task +( I-Task +and I-Task +third I-Task +) I-Task +stage I-Task +cost I-Task +, O +a O +technique O +that O +was O +proposed O +by O +Batun O +et O +al O +. O +[ O +3 O +] O +. O + +Modeling B-Task +collaboration I-Task +processes I-Task +is O +a O +challenging O +task O +. O +Existing O +modeling B-Process +approaches I-Process +are O +not O +capable O +of O +expressing O +the O +unpredictable O +, O +non-routine O +nature O +of O +human B-Process +collaboration I-Process +, O +which O +is O +influenced O +by O +the O +social O +context O +of O +involved O +collaborators O +. O +We O +propose O +a O +modeling B-Process +approach I-Process +which O +considers O +collaboration B-Process +processes I-Process +as O +the O +evolution B-Process +of I-Process +a I-Process +network I-Process +of I-Process +collaborative I-Process +documents I-Process +along I-Process +with I-Process +a I-Process +social I-Process +network I-Process +of I-Process +collaborators I-Process +. O +Our O +modeling B-Process +approach I-Process +, O +accompanied O +by O +a O +graphical B-Process +notation I-Process +and I-Process +formalization I-Process +, O +allows O +to O +capture O +the O +influence B-Process +of I-Process +complex I-Process +social I-Process +structures I-Process +formed O +by O +collaborators O +, O +and O +therefore O +facilitates O +such O +activities O +as O +the O +discovery B-Task +of I-Task +socially I-Task +coherent I-Task +teams I-Task +, O +social O +hubs O +, O +or O +unbiased O +experts O +. O +We O +demonstrate O +the O +applicability O +and O +expressiveness O +of O +our O +approach O +and O +notation O +, O +and O +discuss O +their O +strengths O +and O +weaknesses O +. O + +We O +start O +by O +outlining O +the O +motivation O +, O +structure O +and O +content O +of O +the O +review O +. O +It O +has O +long O +been O +known O +that O +cardiovascular B-Process +signals I-Process +contain O +a O +number O +of O +oscillatory B-Process +components I-Process +that O +are O +not O +exactly O +periodic O +. O +To O +put O +it O +differently O +, O +their O +periods B-Process +( O +frequencies B-Process +) O +fluctuate O +with O +time O +. O +For O +example O +, O +heart B-Process +rate I-Process +variability I-Process +( O +HRV B-Process +) O +has O +in O +itself O +provided O +a O +major O +topic O +of O +discussion O +. O +We O +introduce B-Task +one I-Task +of I-Task +the I-Task +statistical I-Task +approaches I-Task +to I-Task +HRV I-Task +in O +Section O +3 O +. O +However O +, O +in O +order O +to O +understand B-Task +the I-Task +variability I-Task +of I-Task +the I-Task +cardiovascular I-Task +system I-Task +, O +discussion O +of O +a O +single O +source O +is O +insufficient O +because O +the O +cardiovascular O +system O +is O +composed O +of O +many O +different O +physiological B-Material +components I-Material +( O +subsystems B-Material +) O +and O +it O +is O +the O +effects O +of O +their O +mutual O +interaction O +that O +combine O +to O +produce O +HRV B-Task +. O +This O +is O +demonstrated O +in O +Section O +4 O +, O +revealed O +by O +results O +obtained O +using O +the O +wavelet B-Process +transform I-Process +. O +In O +Section O +5 O +, O +we O +discuss B-Task +the I-Task +cardio-respiratory I-Task +interaction I-Task +in O +terms O +of O +phase B-Process +synchronization I-Process +. O +To O +set O +the O +scene O +for O +these O +later O +discussions O +, O +we O +summarize B-Task +the I-Task +basic I-Task +principles I-Task +of I-Task +phase I-Task +dynamics I-Task +in O +Section O +2 O +. O +For O +readers O +who O +are O +unfamiliar O +with O +the O +physiological O +aspects O +of O +the O +research O +, O +we O +provide O +Appendices O +A O +on O +the O +cardiovascular B-Material +system I-Material +and O +B O +on O +how O +measurements B-Process +of I-Process +cardiovascular I-Process +signals I-Process +are O +conducted O +. O +Appendix O +C O +provides O +details O +of O +the O +statistical B-Process +methods I-Process +used O +in O +the O +group B-Task +data I-Task +analyses I-Task +. O + +By O +the O +early O +1970s O +, O +and O +following O +the O +‘ O +golden O +age’ O +of O +general B-Task +relativity I-Task +that O +took O +place O +in O +the O +1960s O +, O +there O +was O +a O +wide O +array O +of O +candidate O +theories B-Task +of I-Task +gravity I-Task +in O +existence O +that O +could O +rival O +Einstein O +’s O +. O +A O +formalism O +was O +needed O +to O +deal O +with O +this O +great O +abundance O +of O +possibilities O +, O +and O +this O +was O +provided O +in O +the O +form O +of O +the O +Parameterised B-Process +Post-Newtonian I-Process +( O +PPN B-Process +) O +formalism O +by O +Kenneth O +Nordtvedt O +, O +Kip O +Thorne O +and O +Clifford O +Will O +. O +The O +PPN B-Process +formalism I-Process +was O +built O +on O +the O +earlier O +work O +of O +Eddington O +and O +Dicke O +, O +and O +allowed O +for O +the O +numerous O +theories O +available O +at O +the O +time O +to O +be O +compared O +to O +cutting B-Task +edge I-Task +astrophysical I-Task +observations I-Task +such O +as O +lunar B-Task +laser I-Task +ranging I-Task +, O +radio B-Task +echo I-Task +, O +and O +, O +in O +1974 O +, O +the O +Hulse B-Task +– I-Task +Taylor I-Task +binary I-Task +pulsar I-Task +. O +The O +PPN B-Process +formalism I-Process +provided O +a O +clear O +structure O +within O +which O +one O +could O +compare B-Process +and I-Process +assess I-Process +various O +theories O +, O +and O +has O +been O +the O +benchmark B-Process +for I-Process +how I-Process +theories I-Process +of I-Process +gravity I-Process +should I-Process +be I-Process +evaluated I-Process +ever O +since O +. O +We O +will O +give O +an O +outline O +of O +the O +PPN B-Process +formalism I-Process +, O +and O +the O +constraints O +available O +within O +it O +today O +, O +in O +Section O +2 O +. O + +Despite O +the O +ubiquity O +of O +time-dependent B-Task +dynamical I-Task +systems I-Task +in O +nature O +, O +there O +has O +been O +relatively O +little O +work O +done O +on O +the O +analysis B-Task +of I-Task +time I-Task +series I-Task +from O +such O +systems O +. O +Mathematically O +they O +are O +known O +as O +non-autonomous B-Task +systems I-Task +, O +which O +are O +named O +as O +such O +because O +, O +unlike O +autonomous B-Task +systems I-Task +, O +in O +addition O +to O +the O +points O +in O +space O +over O +which O +they O +are O +observed O +they O +are O +also O +influenced O +by O +the O +points O +in O +time O +. O +Recently O +there O +has O +been O +much O +work O +on O +the O +direct O +‘ B-Process +bottom-up’ I-Process +approach I-Process +to O +these O +systems O +, O +which O +includes O +the O +introduction O +of O +a O +subclass O +known O +as O +chronotaxic B-Task +systems I-Task +that O +are O +able O +to O +model B-Process +the I-Process +stable I-Process +but I-Process +time-varying I-Process +frequencies I-Process +of O +oscillations O +in O +living B-Task +systems I-Task +[ O +8,9 O +] O +. O +In O +contrast O +, O +the O +time B-Process +series I-Process +analysis I-Process +of O +these O +systems O +, O +referred O +to O +as O +the O +inverse B-Process +or O +‘ B-Process +top-down’ I-Process +approach O +, O +has O +not O +been O +studied O +in O +detail O +before O +. O +This O +is O +partly O +because O +non-autonomous B-Task +systems I-Task +can O +still O +be O +analysed O +in O +the O +same O +way O +as O +other O +types O +of O +systems O +in O +both O +the O +deterministic B-Process +[ O +10 O +] O +and O +the O +stochastic B-Process +[ O +11 O +] O +regime O +. O +However O +, O +it O +is O +now O +argued O +that O +this O +type O +of O +analysis O +is O +insufficient O +and O +that O +an O +entirely O +new O +analytical B-Task +framework I-Task +is O +required O +to O +provide O +a O +more O +useful O +picture O +of O +such O +systems O +. O +In O +the O +case O +of O +chronotaxic B-Task +systems I-Task +some O +methods O +have O +already O +been O +developed O +for O +the O +inverse B-Process +approach I-Process +and O +they O +have O +shown O +to O +be O +useful O +in O +analysing O +heart B-Task +rate I-Task +variability I-Task +[ O +12 O +] O +. O +A O +general O +and O +dedicated O +procedure O +for O +analysing O +non-autonomous B-Task +systems I-Task +has O +still O +not O +been O +tackled O +though O +. O + +The O +purpose O +of O +this O +Letter O +is O +to O +answer O +the O +above O +question O +and O +to O +confront B-Task +those I-Task +six-zero I-Task +textures I-Task +of I-Task +lepton I-Task +mass I-Task +matrices I-Task +with O +the O +latest O +experimental B-Material +data I-Material +. O +First O +, O +we O +shall O +present O +a O +concise O +analysis O +of O +the O +lepton B-Material +mass I-Material +matrices I-Material +in O +Table O +1 O +and O +reveal B-Task +their I-Task +isomeric I-Task +features I-Task +, O +namely O +, O +they O +have O +the O +same O +phenomenological O +consequences O +, O +although O +their O +structures O +are O +apparently O +different O +. O +Second O +, O +we O +shall O +examine B-Task +the I-Task +predictions I-Task +of I-Task +these I-Task +lepton I-Task +mass I-Task +matrices I-Task +by O +comparing O +them O +with O +the O +2σ O +and O +3σ O +intervals O +of O +two O +neutrino B-Process +mass-squared I-Process +differences I-Process +and O +three O +lepton O +flavor O +mixing O +angles,22To O +be O +specific O +, O +we O +make O +use O +of O +the O +2σ O +and O +3σ O +intervals O +of O +two O +neutrino O +mass-squared O +differences O +and O +three O +lepton B-Process +flavor I-Process +mixing I-Process +angles I-Process +given O +by O +M. O +Maltoni O +et O +al. O +in O +Ref O +. O +[ O +5 O +] O +. O +which O +are O +obtained O +from O +a O +global O +analysis O +of O +the O +latest O +solar O +, O +atmospheric O +, O +reactor O +( O +KamLAND O +and O +CHOOZ O +[ O +10 O +]) O +and O +accelerator O +( O +K2K O +) O +neutrino O +data O +. O +We O +find O +no O +parameter O +space O +allowed O +for O +six O +isomeric O +lepton O +mass O +matrices O +at O +the O +2σ O +level O +. O +At O +the O +3σ O +level O +, O +however O +, O +their O +results O +for O +neutrino O +masses O +and O +lepton O +flavor O +mixing O +angles O +can O +be O +compatible O +with O +current O +data O +. O +Third O +, O +we O +incorporate O +the O +seesaw O +mechanism O +and O +the O +Fukugita O +– O +Tanimoto O +– O +Yanagida O +hypothesis O +[ O +9 O +] O +in O +the O +charged O +lepton O +and O +Dirac O +neutrino O +mass O +matrices O +with O +six O +texture O +zeros O +. O +It O +turns O +out O +that O +their O +predictions O +, O +including O +θ23 O +≈ O +45 O +° O +, O +are O +in O +good O +agreement O +with O +the O +present O +experimental O +data O +even O +at O +the O +2σ O +level O +. O + +The O +aim O +of O +this O +note O +is O +nothing O +more O +than O +to O +bring B-Task +both I-Task +approaches I-Task +on I-Task +equal I-Task +footing I-Task +and O +to O +relax B-Task +the I-Task +assumptions I-Task +under O +which O +the O +results O +of O +[ O +11,13 O +] O +have O +been O +derived O +using O +the O +first O +approach O +. O +More O +concretely O +, O +we O +generalize B-Process +the I-Process +one-loop I-Process +partition I-Process +functions I-Process +, I-Process +as O +derived O +in O +[ O +11,13 O +] O +for O +levels O +being O +odd O +, O +to O +the O +case O +of O +even O +levels O +. O +Moreover O +, O +on O +the O +level O +of O +partition O +functions O +we O +implement O +additional B-Process +dressings I-Process +of I-Process +the I-Process +world-sheet I-Process +parity I-Process +symmetry I-Process +and O +identify O +them O +with O +the O +dressings O +introduced O +in O +[ O +12 O +] O +in O +the O +crosscap B-Process +state I-Process +approach I-Process +. O +As O +expected O +, O +all O +the O +physical O +information O +can O +be O +read O +off O +entirely O +from O +the O +various O +amplitudes O +. O +We O +will O +end O +up O +with O +a O +collection O +of O +very O +explicit O +and O +general O +one-loop B-Process +partition I-Process +functions I-Process +and O +tadpole B-Process +cancellation I-Process +conditions I-Process +covering O +simple O +current B-Process +extensions I-Process +of I-Process +all I-Process +168 I-Process +Gepner I-Process +models I-Process +with O +additional O +dressings B-Process +of O +the O +parity B-Process +symmetry I-Process +. O +In O +fact O +providing O +a O +compact O +collection O +of O +the O +main O +relevant O +formulas O +for O +constructing B-Task +supersymmetric I-Task +Gepner I-Task +model I-Task +orientifolds I-Task +was O +one O +of O +the O +motivations O +for O +writing O +this O +Letter O +. O +We O +hope O +that O +these O +expressions O +turn O +out O +to O +be O +useful O +for O +a O +systematic B-Task +search I-Task +for I-Task +Standard-like I-Task +models I-Task +respectively O +for O +providing B-Task +a I-Task +statistical I-Task +ensemble I-Task +in I-Task +the I-Task +spirit I-Task +of I-Task +[ I-Task +29 I-Task +] I-Task +. O + +Absorption B-Task +events I-Task +through I-Task +the I-Task +charged I-Task +current I-Task +reactions I-Task +( O +2 O +) O +νe O ++ O +40Ar O +→ O +e O +−+ O +40K O +∗ O +andν O +̄ O +e O ++ O +40Ar O +→ O +e O +++ O +40Cl O +∗ O +. O +There O +is O +some O +uncertainty O +in O +predicting B-Task +e I-Task +−( I-Task +e I-Task ++) I-Task +event I-Task +rates I-Task +for O +these O +processes O +which O +arise O +due O +to O +the O +nuclear B-Process +model I-Process +dependencies I-Process +of O +the O +absorption O +cross O +section O +and O +the O +treatment B-Process +of I-Process +the I-Process +Coulomb I-Process +distortion I-Process +of O +electron B-Material +( O +positron B-Material +) O +in O +the O +field O +of O +the O +residual B-Task +nucleus I-Task +. O +The O +nuclear B-Task +absorption I-Task +cross I-Task +section I-Task +for I-Task +the I-Task +charged I-Task +current I-Task +neutrino I-Task +reactions I-Task +in O +40Ar O +relevant O +to O +supernova B-Material +neutrino I-Material +energies I-Material +was O +first O +calculated O +by O +Raghavan O +[ O +10 O +] O +and O +Bahcall O +et O +al O +. O +[ O +11 O +] O +for O +Fermi O +transitions O +leading O +to O +isobaric B-Process +analogue I-Process +state I-Process +( O +IAS B-Process +) O +at O +4.38 B-Process +MeV I-Process +in I-Process +40K I-Process +∗ O +. O +Later O +Ormand O +et O +al O +. O +[ O +12 O +] O +used O +a O +shell B-Process +model I-Process +to O +calculate O +the B-Task +Fermi I-Task +and I-Task +Gamow I-Task +– I-Task +Teller I-Task +transitions I-Task +. O +In O +these O +calculations O +Fermi O +function O +F O +( O +Z,Ee O +) O +was O +used O +to O +take O +into O +account O +the O +Coulomb B-Process +effects I-Process +. O +In O +a O +recent O +paper O +Bueno O +et O +al O +. O +[ O +13 O +] O +make O +use O +of O +a O +calculation B-Process +by I-Process +Martinez-Pinedo I-Process +et I-Process +al I-Process +. I-Process +[ O +14 O +] O +who O +use O +a O +shell B-Process +model I-Process +for I-Process +Fermi I-Process +and I-Process +Gamow I-Process +– I-Process +Teller I-Process +transitions I-Process +and O +a O +continuum B-Process +random I-Process +phase I-Process +approximation I-Process +( O +CRPA B-Process +) O +for O +forbidden O +transitions O +to O +calculate O +the B-Task +absorption I-Task +cross I-Task +sections I-Task +. O +In O +this O +calculation O +the O +Coulomb O +distortion O +of O +the O +produced O +electron O +is O +treated O +with O +a O +hybrid O +model O +where O +a O +Fermi O +function O +is O +used O +for O +lower O +electron O +energies O +and O +modified B-Process +effective I-Process +momentum I-Process +approximation I-Process +( O +MEMA B-Process +) O +for O +higher O +electron O +energies O +[ O +14 O +– O +17 O +] O +. O +In O +a O +recent O +work O +Bhattacharya O +et O +al O +. O +[ O +18 O +] O +have O +measured O +the O +Fermi B-Process +and I-Process +Gamow I-Process +– I-Process +Teller I-Process +transition I-Process +strengths I-Process +leading O +to O +excited O +states O +up O +to O +6 O +MeV O +in O +40K O +∗ O +and O +obtained O +the O +neutrino B-Task +absorption I-Task +cross I-Task +section I-Task +for O +supernova O +neutrinos O +in O +40Ar O +. O + +Classical O +, O +two-dimensional B-Task +sigma I-Task +models I-Task +on I-Task +compact I-Task +symmetric I-Task +spaces I-Task +G I-Task +/ I-Task +H I-Task +are O +integrable O +by O +virtue O +of O +conserved O +quantities O +which O +can O +arise O +as O +integrals B-Process +of I-Process +local I-Process +or I-Process +non-local I-Process +functions I-Process +of O +the O +underlying O +fields O +( O +the O +accounts O +in O +[ O +1 O +– O +5 O +] O +contain O +references O +to O +the O +extensive O +literature O +) O +. O +Since O +these O +models O +are O +asymptotically O +free O +and O +strongly O +coupled O +in O +the O +infrared O +, O +their O +quantum O +properties O +are O +not O +straightforward O +to O +determine O +. O +Nevertheless O +, O +following O +Lüscher O +[ O +6 O +] O +, O +Abdalla O +, O +Forger O +and O +Gomes O +showed O +[ O +7 O +] O +that O +, O +in O +a O +G O +/ O +H O +sigma O +model O +with O +H O +simple,11Here O +, O +and O +throughout O +this O +Letter O +, O +we O +shall O +use O +‘ O +simple’ O +to O +mean O +that O +the O +corresponding O +Lie O +algebra O +has O +no O +non-trivial O +ideals O +. O +Hence O +U O +( O +1 O +) O +is O +simple O +in O +our O +terminology O +, O +in O +addition O +to O +the O +usual O +non-Abelian O +simple O +groups O +of O +the O +Cartan O +– O +Killing O +classification O +[ O +13 O +] O +. O +the O +first O +conserved O +non-local O +charge O +survives O +quantization O +( O +after O +an O +appropriate O +renormalization O +[ O +6 O +– O +8 O +]) O +, O +which O +suffices O +to O +ensure O +quantum O +integrability O +of O +the O +theory O +. O +By O +contrast O +, O +calculations O +using O +the O +1 O +/ O +N O +expansion O +reveal O +anomalies O +that O +spoil O +the O +conservation O +of O +the O +quantum O +non-local O +charges O +in O +the O +CPN O +− O +1 O += O +SU O +( O +N O +)/ O +SU O +( O +N O +− O +1 O +)× O +U O +( O +1 O +) O +models O +for O +N O +> O +2 O +, O +and O +in O +the O +wider O +class O +of O +theories O +based O +on O +the O +complex O +Grassmannians O +SU O +( O +N O +)/ O +SU O +( O +n O +)× O +SU O +( O +N O +− O +n O +)× O +U O +( O +1 O +) O +for O +N O +> O +n O +> O +1 O +[ O +9 O +] O +. O + +We O +propose O +a O +method O +for O +the O +lattice B-Task +QCD I-Task +computation I-Task +of I-Task +nucleon I-Task +– I-Task +nucleon I-Task +low-energy I-Task +interactions I-Task +. O +It O +consists O +in O +simulating B-Process +QCD I-Process +in O +the O +background O +of O +a O +“ O +electromagnetic B-Material +” I-Material +field I-Material +whose O +potential O +is O +non-vanishing O +, O +but O +whose O +field B-Process +strength I-Process +is I-Process +zero I-Process +. O +By O +tuning B-Process +the I-Process +background I-Process +field I-Process +, O +phase-shifts B-Task +at I-Task +any I-Task +( I-Task +but I-Task +small I-Task +) I-Task +momenta I-Task +can O +be O +determined O +by O +measuring B-Process +the I-Process +shift I-Process +of I-Process +the I-Process +ground I-Process +state I-Process +energy I-Process +. O +Lattice B-Material +sizes I-Material +as O +small O +as O +5 O +Fermi O +can O +be O +sufficient O +for O +the O +calculation B-Task +of I-Task +phase I-Task +shifts I-Task +up O +to O +momenta O +of O +order O +of O +mπ O +/ O +2 O +. O + +In O +our O +study O +we O +illustrate O +the O +properties O +of O +gauge O +invariant B-Task +extensions I-Task +of I-Task +local I-Task +functionals I-Task +. O +We O +aim O +at O +clarifying O +, O +via O +specific O +examples O +, O +the O +relation O +between O +a O +functional B-Task +which I-Task +is I-Task +local I-Task +in I-Task +a I-Task +particular I-Task +gauge I-Task +( O +but O +not O +necessarily O +gauge O +invariant O +) O +, O +and O +its B-Task +gauge I-Task +invariant I-Task +extension I-Task +( O +which O +is O +not O +necessarily O +local O +) O +. O +We O +show O +that O +the O +non-localities B-Process +found I-Process +are O +not O +perturbatively O +local O +because O +they O +cannot O +be O +expressed O +in O +terms O +of O +an O +infinite O +derivative O +expansion O +. O +We O +believe O +that O +the O +implications O +of O +this O +observation O +have O +not O +been O +clearly O +emphasised O +in O +the O +literature O +, O +as O +attested O +by O +the O +absence O +of O +any O +debate O +about O +it O +in O +recent O +works O +. O +It O +is O +precisely O +these O +dangerous O +infrared O +modes O +that O +make O +it O +hard O +to O +define O +a O +gauge O +independent O +renormalisation O +for O +the O +gauge O +invariant O +extensions O +of O +local O +functionals O +. O +This O +observation O +supports O +the O +remark O +in O +[ O +2 O +] O +that O +the O +expectation O +value O +receives O +important O +contributions O +from O +both O +large O +and O +small O +distances O +. O +Our O +arguments O +on O +renormalisability O +are O +based O +on O +the O +notion O +of O +renormalisation O +in O +the O +modern O +sense O +[ O +8 O +] O +which O +relies O +on O +BRST O +cohomology O +theorems O +. O +The O +BRST O +terminology O +will O +therefore O +be O +frequently O +used O +here O +, O +even O +though O +it O +is O +not O +always O +necessary O +. O + +Certainly O +therefore O +the O +see-saw B-Process +mechanism I-Process +is O +an O +attractive O +explanation O +of O +why O +the O +light B-Task +neutrino I-Task +masses I-Task +are O +so O +small O +. O +However O +, O +it O +is O +not O +without O +its O +faults O +. O +In O +particular O +, O +there O +is O +a O +tension O +between O +the O +strongly O +hierarchical O +nature O +of O +the O +observed O +Yukawa B-Task +couplings I-Task +in I-Task +the I-Task +quark I-Task +and I-Task +charged I-Task +lepton I-Task +sectors I-Task +, O +and O +the O +essentially O +hierarchy-free B-Task +masses I-Task +implied I-Task +by I-Task +the I-Task +Δm2 I-Task +'s I-Task +. O +Moreover O +, O +both O +the O +θ12 B-Task +and I-Task +θ23 I-Task +mixing I-Task +angles I-Task +are O +large O +while O +the B-Task +angle I-Task +θ13 I-Task +is O +small O +which O +is O +in O +sharp O +contrast O +with O +the O +corresponding O +mixings O +in O +the O +quark B-Process +sector I-Process +which O +are O +all O +small O +. O +These O +problems O +can O +be O +solved O +in O +specific O +models O +, O +for O +example O +, O +the O +Δm2 B-Process +values I-Process +can I-Process +be I-Process +fitted I-Process +by I-Process +taking I-Process +the I-Process +spectrum I-Process +of I-Process +rhd I-Process +neutrino I-Process +masses I-Process +to O +be O +hierarchical O +in O +such O +a O +way O +as O +to O +almost O +compensate O +for O +the O +hierarchical B-Process +neutrino I-Process +Yukawa I-Process +couplings I-Process +. O +But O +this O +has O +the O +price O +of O +introducing O +a O +wide O +range O +of O +rhd B-Material +neutrino I-Material +masses I-Material +MR B-Material +∼ I-Material +1010 I-Material +– I-Material +1015 I-Material +which O +then O +require O +explanation O +. O + +We O +analyze O +the O +diagonal B-Task +and I-Task +transition I-Task +magnetic I-Task +and I-Task +electric I-Task +dipole I-Task +moments I-Task +of I-Task +charged I-Task +leptons I-Task +in O +extended B-Process +technicolor I-Process +( O +ETC B-Process +) O +models O +, O +taking O +account O +of O +the O +multiscale O +nature O +of O +the O +ETC O +gauge B-Process +symmetry I-Process +breaking I-Process +, O +conformal B-Process +( I-Process +walking I-Process +) I-Process +behavior I-Process +of I-Process +the I-Process +technicolor I-Process +theory I-Process +, O +and O +mixing B-Process +in I-Process +the I-Process +charged-lepton I-Process +mass I-Process +matrix I-Process +. O +We O +show O +that O +mixing B-Task +effects I-Task +dominate O +the O +ETC B-Process +contributions O +to O +charged B-Task +lepton I-Task +electric I-Task +dipole I-Task +moments I-Task +and O +that O +these O +can O +yield O +a O +value B-Process +of I-Process +| I-Process +de I-Process +| I-Process +comparable O +to O +the O +current O +limit O +. O +The O +rate B-Process +for I-Process +μ I-Process +→ I-Process +eγ I-Process +can O +also O +be O +close O +to O +its O +limit O +. O +From O +these O +and O +other O +processes O +we O +derive O +constraints O +on O +the O +charged B-Task +lepton I-Task +mixing I-Task +angles I-Task +. O +The O +constraints O +are O +such O +that O +the O +ETC B-Process +contribution O +to O +the O +muon B-Task +anomalous I-Task +magnetic I-Task +moment I-Task +, O +which O +includes O +a O +significant O +lepton B-Process +mixing I-Process +term I-Process +, O +can O +approach O +, O +but O +does O +not O +exceed O +, O +the O +current O +sensitivity O +level O +. O + +It O +is O +well O +known O +that O +one O +of O +the O +long O +standing O +problems O +in O +physics O +is O +understanding B-Task +the I-Task +confinement I-Task +physics I-Task +from I-Task +first I-Task +principles I-Task +. O +Hence O +the O +challenge O +is O +to O +develop B-Task +analytical I-Task +approaches I-Task +which O +provide O +valuable O +insight O +and O +theoretical O +guidance O +. O +According O +to O +this O +viewpoint O +, O +an O +effective O +theory O +in O +which O +confining O +potentials O +are O +obtained O +as O +a O +consequence O +of O +spontaneous B-Process +symmetry I-Process +breaking I-Process +of I-Process +scale I-Process +invariance I-Process +has O +been O +developed O +[ O +1 O +] O +. O +In O +particular O +, O +it O +was O +shown O +that O +a O +such O +theory O +relies O +on O +a O +scale-invariant B-Process +Lagrangian I-Process +of O +the O +type O +[ O +2 O +] O +( O +1 O +) O +L O += O +14w2 O +− O +12w O +− O +FμνaFaμν O +, O +where O +Fμνa O +=∂ O +μAνa O +−∂ O +νAμa O ++ O +gfabcAμbAνc O +, O +and O +w O +is O +not O +a O +fundamental O +field O +but O +rather O +is O +a O +function B-Process +of I-Process +4-index I-Process +field I-Process +strength I-Process +, O +that O +is O +, O +( B-Process +2 I-Process +) I-Process +w I-Process += I-Process +εμναβ I-Process +∂ I-Process +μAναβ I-Process +. O +The O +Aναβ B-Process +equation I-Process +of I-Process +motion I-Process +leads I-Process +to O +( O +3 O +) O +εμναβ B-Process +∂ I-Process +βw I-Process +−− I-Process +FγδaFaγδ I-Process += I-Process +0 I-Process +, O +which O +is O +then O +integrated B-Process +to I-Process +( I-Process +4 I-Process +) I-Process +w I-Process +=− I-Process +FμνaFaμν I-Process ++ I-Process +M I-Process +. O +It O +is O +easy O +to O +verify O +that O +the O +Aaμ B-Process +equation I-Process +of I-Process +motion I-Process +leads O +us O +to O +( O +5 O +)∇ O +μFaμν O ++ O +MFaμν O +− O +FαβbFbαβ O += O +0 O +. O +It O +is O +worth O +stressing O +at O +this O +stage O +that O +the O +above O +equation O +can O +be O +obtained O +from O +the B-Process +effective I-Process +Lagrangian I-Process +( O +6 O +) O +Leff B-Process +=− I-Process +14FμνaFaμν I-Process ++ I-Process +M2 I-Process +− I-Process +FμνaFaμν I-Process +. O +Spherically B-Task +symmetric I-Task +solutions I-Task +of O +Eq O +. O +( O +5 O +) O +display O +, O +even O +in O +the O +Abelian O +case O +, O +a O +Coulomb B-Material +piece I-Material +and O +a O +confining B-Material +part I-Material +. O +Also O +, O +the O +quantum B-Task +theory I-Task +calculation I-Task +of I-Task +the I-Task +static I-Task +energy I-Task +between I-Task +two I-Task +charges I-Task +displays O +the O +same O +behavior O +[ O +1 O +] O +. O +It O +is O +well O +known O +that O +the O +square O +root O +part O +describes O +string B-Process +like I-Process +solutions I-Process +[ O +3,4 O +] O +. O + +In O +the O +supersymmetric O +case O +, O +such O +a O +small B-Task +coupling I-Task +for I-Task +quartic I-Task +interaction I-Task +cannot O +be O +realized O +if O +the O +potential O +is O +lifted O +by O +the O +gauge B-Process +D-term I-Process +interactions I-Process +, O +since O +, O +if O +so O +, O +the B-Material +coupling I-Material +constant I-Material +λ I-Material +becomes O +of O +the O +order O +O O +( O +g2 O +) O +where O +g O +is O +the O +gauge B-Material +coupling I-Material +constant I-Material +in O +the O +standard B-Process +model I-Process +. O +Therefore O +, O +we O +focus O +our O +attention O +on O +the O +D-flat B-Task +directions I-Task +. O +For O +D-flat O +directions O +, O +we O +have O +to O +be O +more O +careful O +since O +behaviors B-Task +of I-Task +the I-Task +potential I-Task +depend O +on O +which O +flat O +direction O +we O +consider O +. O +In O +the O +MSSM O +, O +Yukawa B-Task +interactions I-Task +exist O +in O +the O +superpotential O +to O +generate O +the O +fermion O +masses O +. O +Such O +Yukawa O +interactions O +lift O +some O +of O +the O +D-flat B-Task +directions I-Task +. O +In O +addition O +, O +we O +can O +also O +find O +several O +D-flat O +directions O +which O +are O +not O +affected O +by O +the O +Yukawa B-Task +interactions I-Task +associated O +with O +the O +fermion O +masses O +; O +without O +R-parity O +violation O +, O +such O +D-flat B-Task +directions I-Task +are O +only O +lifted O +by O +the O +effects O +of O +supersymmetry O +breaking.33Here O +, O +we O +assume O +that O +coefficients B-Task +of I-Task +non-renormalizable I-Task +terms I-Task +are O +suppressed O +enough O +to O +be O +neglected O +. O +This O +may O +be O +explained O +by O +the O +R-symmetry B-Process +, O +assigning O +R-charge B-Process +23 I-Process +to O +each O +MSSM B-Process +chiral I-Process +superfields I-Process +. O +( O +See O +Ref. O +[ O +6 O +] O +for O +the O +details O +. O +) O + +Some O +non-standard B-Task +couplings I-Task +, O +which O +should O +be O +determined O +here O +, O +could O +also O +be O +studied O +in O +the O +standard B-Process +e I-Process ++ I-Process +e I-Process +− I-Process +option I-Process +of O +a O +linear B-Material +collider I-Material +. O +Therefore O +, O +it O +is O +worth O +while O +to O +compare O +the O +potential B-Task +power I-Task +of O +the O +two O +options O +. O +As O +far O +as O +the O +parameter B-Task +αγ1 I-Task +is O +concerned O +, O +the O +γγ B-Material +collider I-Material +does O +not O +allow O +for O +its O +determination O +, O +while O +it O +could O +be O +determined O +at O +e B-Process ++ I-Process +e I-Process +− I-Process +. O +The O +second O +tt O +̄ O +γ O +coupling B-Task +αγ2 I-Task +, O +which O +is O +proportional O +to O +the O +real O +part O +of O +the O +top-quark O +electric O +dipole O +moment,44See O +[ O +23 O +] O +taking O +into O +account O +that O +the O +operators O +OuB O +, O +OqB O +and O +OqW O +are O +redundant O +. O +can O +be O +measured O +here O +. O +It O +should O +be O +recalled O +that O +energy O +and O +polar-angle B-Task +distributions I-Task +of I-Task +leptons I-Task +and I-Task +b-quarks I-Task +in O +e B-Material ++ I-Material +e I-Material +− I-Material +colliders I-Material +are O +sensitive O +only O +to O +the O +imaginary O +part O +of O +the O +electric O +dipole O +moment,55However O +, O +it O +should O +be O +emphasized O +that O +there O +exist O +observables O +sensitive O +also O +to O +the O +real O +part O +of O +the O +top-quark O +electric O +dipole O +moment O +, O +see O +[ O +24 O +] O +. O +while O +here O +the O +real O +part O +could O +be O +determined O +. O +For O +the O +measurement O +of O +γγH O +couplings O +, O +e O ++ O +e O +− O +colliders O +are O +, O +of O +course O +, O +useless O +, O +while O +here O +, O +for O +the O +bX O +final O +state O +both O +αh1 O +and O +αh2 O +could O +be O +measured O +. O +In O +the O +case O +of O +the O +decay O +form O +factor O +αd O +measurement O +, O +the O +e O ++ O +e O +− O +option O +seems O +to O +be O +a O +little O +more O +advantageous O +, O +especially O +if O +e O ++ O +e O +− O +polarization O +can O +be O +tuned O +appropriately O +[ O +25 O +] O +. O + +In O +contrast O +to O +the O +H O +particle O +, O +the O +situation O +for O +the O +Θ B-Task ++ I-Task +baryon I-Task +is O +very O +promising O +. O +Thus O +, O +in O +this O +Letter O +we O +explore O +the B-Task +formation I-Task +of I-Task +the I-Task +Θ I-Task ++- I-Task +baryon I-Task +within O +a O +new O +approach O +called O +parton-based B-Process +Gribov I-Process +– I-Process +Regge I-Process +theory I-Process +. O +It O +is O +realized O +in O +the O +Monte B-Material +Carlo I-Material +program I-Material +NEXUS B-Material +3.97 I-Material +[ O +22,23 O +] O +. O +In O +this O +model O +high B-Process +energy I-Process +hadronic I-Process +and I-Process +nuclear I-Process +collisions I-Process +are O +treated O +within O +a O +self-consistent B-Process +quantum I-Process +mechanical I-Process +multiple I-Process +scattering I-Process +formalism I-Process +. O +Elementary B-Process +interactions I-Process +, O +happening O +in O +parallel O +, O +correspond O +to O +underlying O +microscopic B-Process +( I-Process +predominantly I-Process +soft I-Process +) I-Process +parton I-Process +cascades I-Process +and O +are O +described O +effectively O +as O +phenomenological B-Process +soft I-Process +pomeron I-Process +exchanges I-Process +. O +A O +pomeron O +can O +be O +seen O +as O +layers O +of O +a O +( B-Material +soft I-Material +) I-Material +parton I-Material +ladder I-Material +, O +which O +is O +attached O +to O +projectile B-Material +and I-Material +target I-Material +nucleons I-Material +via O +leg B-Material +partons I-Material +. O +At O +high O +energies O +one O +accounts O +also O +for O +the O +contribution O +of O +perturbative B-Material +( I-Material +high I-Material +pt I-Material +) I-Material +partons I-Material +described O +by O +a O +so-called O +“ O +semihard O +pomeron O +”— O +a O +piece O +of O +the O +QCD O +parton O +ladder O +sandwiched O +between O +two O +soft O +pomerons O +which O +are O +connected O +to O +the O +projectile O +and O +to O +the O +target O +in O +the O +usual O +way O +. O +The O +spectator O +partons O +of O +both O +projectile O +and O +target O +nucleons O +, O +left O +after O +pomeron O +emissions O +, O +form O +nucleon O +remnants O +. O +The O +legs O +of O +the O +pomerons O +form O +color O +singlets O +, O +such O +as O +q O +– O +q O +̄ O +, O +q O +– O +qq O +or O +q O +̄– O +q O +̄ O +q O +̄ O +. O +The O +probability O +of O +q O +– O +qq O +and O +q O +̄– O +q O +̄ O +q O +̄ O +is O +controlled O +by O +the O +parameter O +Pqq O +and O +is O +fixed O +by O +the O +experimental O +yields O +on O +( O +multi O +-) O +strange O +baryons O +[ O +23 O +] O +. O + +I O +also O +could O +not O +resist O +mentioning O +another O +wild O +speculation O +[ O +10 O +] O +. O +Many O +years O +ago O +, O +inspired O +by O +the O +almost O +exact O +correspondence O +between O +Einstein B-Process +'s I-Process +post-Newtonian I-Process +equations I-Process +of I-Process +gravity I-Process +and O +Maxwell B-Process +'s I-Process +equations I-Process +of I-Process +motion I-Process +I O +proposed O +the O +gravitipole B-Process +in O +analogy O +with O +Dirac B-Process +'s I-Process +magnetic I-Process +monopole I-Process +. O +After O +Dirac O +there O +was O +considerable O +debate O +on O +how O +a O +field B-Task +theory I-Task +of I-Task +magnetic I-Task +monopoles I-Task +may O +be O +formulated O +. O +Eventually O +, O +' O +t O +Hooft O +and O +Polyakov O +showed O +that O +the O +magnetic B-Task +monopole I-Task +exists O +as O +an O +extended O +solution O +in O +certain O +non-abelian B-Process +gauge I-Process +theories I-Process +. O +Most O +theorists O +now O +believe O +that O +electromagnetism B-Process +is O +merely O +a O +piece O +of O +a O +grand O +unified O +theory O +and O +that O +magnetic B-Process +monopoles I-Process +exist O +. O +Might O +it O +not O +turn O +out O +that O +Einstein O +'s O +theory O +is O +but O +a O +piece O +of O +a O +bigger O +theory O +and O +that O +gravitipoles B-Process +exist O +? O +In O +grand O +unified O +theory O +the O +electromagnetic B-Process +field I-Process +is O +a O +component O +of O +a O +multiplet O +. O +Could O +it O +be O +that O +the O +gravitational B-Process +field I-Process +also O +somehow O +carries O +an O +internal O +index O +and O +that O +the O +field O +we O +observe O +is O +just O +a O +component O +of O +a O +multiplet O +? O +Throwing O +caution O +to O +the O +wind O +, O +I O +also O +asked O +in O +[ O +10 O +] O +if O +the O +gravitipole B-Process +and O +the O +graviton B-Process +might O +not O +form O +a O +representation O +under O +some O +dual O +group O +just O +as O +the O +magnetic B-Process +monopole I-Process +and O +the O +photon B-Material +form O +a O +triplet O +under O +the O +dual O +group O +of O +Montonen O +and O +Olive O +[ O +11 O +] O +. O + +In O +summary O +, O +we O +have O +shown O +that O +one O +can O +describe B-Task +the I-Task +experimental I-Task +data I-Task +of I-Task +the I-Task +HERMES I-Task +Collaboration I-Task +for I-Task +hadron I-Task +attenuation I-Task +on I-Task +nuclei I-Task +without O +invoking O +any O +changes O +in O +the O +fragmentation B-Process +function I-Process +due O +to O +gluon B-Process +radiation I-Process +. O +In O +our O +dynamical B-Task +studies I-Task +, O +that O +include O +the O +most O +relevant O +FSI B-Process +, O +we O +employ O +only O +the O +‘ B-Process +free’ I-Process +fragmentation I-Process +function I-Process +on O +a O +nucleon B-Material +and O +attribute O +the O +hadron B-Material +attenuation O +to O +the O +deceleration O +of O +the O +produced B-Material +( I-Material +pre I-Material +-) I-Material +hadrons I-Material +due O +to O +FSI B-Process +in O +the O +surrounding B-Material +medium I-Material +. O +We O +find O +that O +in O +particular O +the B-Process +z-dependence I-Process +of I-Process +RMh I-Process +is O +very O +sensitive O +to O +the O +interaction O +cross O +section O +of O +leading B-Material +prehadrons I-Material +and O +can O +be O +used O +to O +determine B-Task +σlead I-Task +. O +The O +interaction B-Process +of I-Process +the I-Process +leading I-Process +prehadrons I-Process +during I-Process +the I-Process +formation I-Process +time I-Process +could O +be O +interpreted O +as O +an O +in-medium B-Process +change I-Process +of I-Process +the I-Process +fragmentation I-Process +function I-Process +, O +which O +however O +could O +not O +be O +given O +in O +a O +closed O +form O +. O +The O +extracted O +average O +hadron B-Material +formation O +times O +of O +τf O +≳ O +0.3 O +fm O +/ O +c O +are O +compatible O +with O +the O +analysis B-Task +of I-Task +antiproton I-Task +attenuation I-Task +in O +p B-Process ++ I-Process +A I-Process +reactions I-Process +at O +AGS O +energies O +[ O +17 O +] O +. O +In O +an O +upcoming O +work O +we O +will O +investigate O +in O +detail B-Task +the I-Task +spectra I-Task +for I-Task +different I-Task +particle I-Task +species I-Task +( I-Task +π I-Task +± I-Task +, I-Task +K I-Task +± I-Task +, I-Task +p,p I-Task +̄) I-Task +to O +examine O +, O +if O +the O +formation O +times O +of O +mesons O +and O +antibaryons O +are O +about O +equal O +. O +In O +addition O +we O +will O +improve O +our O +model O +to O +describe O +the O +primary O +photon O +– O +nucleon O +reaction O +below O +the O +PYTHIA O +threshold O +of O +W O +⩾ O +4 O +GeV O +. O + +Solitons B-Material +present O +the O +possibility O +of O +extended O +objects O +as O +stable O +states O +within O +Quantum O +Field O +Theory O +. O +Although O +these O +solutions O +are O +obtained O +from O +semi-classical B-Process +arguments I-Process +in I-Process +weak I-Process +coupling I-Process +limit I-Process +, O +their O +validity O +as O +quantal B-Task +states I-Task +is O +justified O +based O +on O +the O +associated B-Process +topological I-Process +conservation I-Process +laws I-Process +. O +A O +more O +curious O +occurrence O +is O +that O +of O +fermionic B-Task +zero-energy I-Task +modes I-Task +trapped I-Task +on I-Task +such I-Task +solutions I-Task +. O +Their O +presence O +requires O +, O +according O +to O +well-known O +arguments O +[ O +1,2 O +] O +, O +an O +assignment B-Process +of I-Process +half-integer I-Process +fermion I-Process +number I-Process +to I-Process +the I-Process +solitonic I-Process +states I-Process +. O +In O +the O +usual O +treatment O +, O +the B-Task +back I-Task +reaction I-Task +of I-Task +the I-Task +fermion I-Task +zero-modes I-Task +on I-Task +the I-Task +soliton I-Task +itself O +is O +ignored O +. O +However O +, O +the O +fractional B-Task +values I-Task +of I-Task +the I-Task +fermionic I-Task +charge I-Task +have O +interesting O +consequence O +for O +the B-Task +fate I-Task +of I-Task +the I-Task +soliton I-Task +if O +the O +latter O +is O +not O +strictly O +stable O +. O +The O +reason O +for O +this O +is O +that O +if O +the O +configuration O +were O +to O +relax O +to O +trivial O +vacuum B-Material +in O +isolation O +, O +there O +is O +no O +particle-like O +state O +available O +for O +carrying B-Task +the I-Task +fractional I-Task +value I-Task +of I-Task +the I-Task +fermionic I-Task +charge I-Task +. O +Dynamical B-Task +stability I-Task +of I-Task +such I-Task +objects I-Task +was O +pointed O +out O +in O +[ O +3 O +] O +, O +in O +cosmological O +context O +in O +[ O +4,5 O +] O +and O +more O +recently O +in O +[ O +6 O +– O +8 O +] O +. O +Fractional O +fermion O +number O +phenomenon O +also O +occurs O +in O +condensed B-Material +matter I-Material +systems I-Material +and O +its O +wide O +ranging O +implications O +call O +for O +a O +systematic B-Task +understanding I-Task +of I-Task +the I-Task +phenomenon I-Task +. O + +The O +charmonium B-Process +production I-Process +has O +long O +been O +considered O +as O +a O +good O +process O +for O +investigating B-Task +both I-Task +perturbative I-Task +and I-Task +nonperturbative I-Task +properties I-Task +of I-Task +quantum I-Task +chromodynamics I-Task +( I-Task +QCD I-Task +) O +, O +because O +of O +the O +relatively O +large O +difference O +between O +the O +scale O +at O +which O +the O +charm O +– O +quark O +pair O +is O +produced O +at O +the O +parton O +level O +and O +the O +scale O +at O +which O +it O +evolves O +into O +a O +quarkonium O +. O +In O +particular O +, O +comparing O +to O +hadron O +colliders O +, O +e B-Material ++ I-Material +e I-Material +− I-Material +colliders I-Material +, O +provide O +a O +cleaner O +environment O +to O +study B-Task +the I-Task +charmonium I-Task +productions I-Task +and I-Task +decays I-Task +. 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O +[ O +16 O +] O +in O +the O +framework O +of O +the O +NJL B-Process +model I-Process +that O +neutral B-Material +2SC I-Material +matter I-Material +could O +be O +the O +most O +favored O +quark B-Process +phase I-Process +in O +a O +certain O +regime O +. O +However O +, O +the O +authors O +argued O +that O +this O +interval O +might O +disappear O +if O +the O +hadronic B-Process +phase I-Process +is O +included O +more O +properly O +. O +This O +is O +indeed O +what O +we O +found O +for O +parameter O +set O +RKH O +, O +while O +for O +parameter O +set O +HK O +the O +2SC O +phase O +survives O +only O +in O +a O +tiny O +window O +. O +Nevertheless O +, O +if O +Nature O +chooses O +to O +be O +similar O +to O +this O +equation O +of O +state O +, O +it O +will O +be O +this O +tiny O +window O +which O +gives O +rise O +to O +hybrid B-Material +stars I-Material +, O +whereas O +the O +CFL B-Process +phase I-Process +would O +be O +never O +present O +in O +compact B-Material +stars I-Material +. O + +We O +investigate B-Task +the I-Task +density I-Task +behavior I-Task +of I-Task +the I-Task +symmetry I-Task +energy I-Task +with I-Task +respect I-Task +to I-Task +isospin I-Task +equilibration I-Task +in O +the O +combined B-Process +systems I-Process +Ru B-Process +( I-Process +Zr I-Process +)+ I-Process +Zr I-Process +( I-Process +Ru I-Process +) I-Process +at O +relativistic B-Process +energies I-Process +of O +0.4 O +and O +1.528A O +GeV O +. 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O +Calculations B-Process +in I-Process +the I-Process +maximally I-Process +extended I-Process +N I-Process += I-Process +4 I-Process +SYM I-Process +, I-Process +where I-Process +the I-Process +coupling I-Process +constant I-Process +is I-Process +not I-Process +renormalized I-Process +, O +give O +even O +more O +remarkable O +results O +. O +Namely O +, O +it O +turns O +out O +, O +that O +here O +all O +twist-2 B-Task +operators I-Task +enter O +in O +the O +same O +multiplet O +, O +their O +anomalous B-Task +dimension I-Task +matrix I-Task +is O +fixed O +completely O +by O +the O +super-conformal B-Process +invariance I-Process +and O +its O +universal O +anomalous O +dimension O +in O +LLA O +is O +proportional O +to O +Ψ O +( O +j O +− O +1 O +)− O +Ψ O +( O +1 O +) O +, O +which O +means O +, O +that O +the O +evolution B-Task +equations I-Task +for I-Task +the I-Task +matrix I-Task +elements I-Task +of I-Task +quasi-partonic I-Task +operators I-Task +in I-Task +the I-Task +multicolor I-Task +limit I-Task +Nc I-Task +→∞ I-Task +are O +equivalent O +to O +the O +Schrödinger O +equation O +for O +an O +integrable O +Heisenberg O +spin O +model O +[ O +11,12 O +] O +. O +In O +QCD O +the O +integrability O +remains O +only O +in O +a O +small O +sector O +of O +the O +quasi-partonic O +operators O +[ O +13 O +] O +. O +In O +the O +case O +of O +N B-Task += I-Task +4 I-Task +SYM I-Task +the O +equations O +for O +other O +sets O +of O +operators O +are O +also O +integrable O +[ O +14 O +– O +16 O +] O +. O +Evolution B-Task +equations I-Task +for I-Task +quasi-partonic I-Task +operators I-Task +are O +written O +in O +an O +explicitly O +super-conformal O +form O +in O +Ref O +. O +[ O +17 O +] O +. O + +Thus O +, O +the O +extension B-Process +to I-Process +the I-Process +charmed I-Process +analogue I-Process +Θc I-Process +( I-Process +3099 I-Process +) I-Process +provides O +an O +interesting O +test O +for O +the O +SDO B-Task +sum I-Task +rule I-Task +and I-Task +lattice I-Task +calculations I-Task +[ O +17 O +] O +. O +Here O +, O +the O +charm B-Material +quark I-Material +is O +quite O +heavy O +so O +that O +the O +constituent-quark B-Process +picture I-Process +may O +fit O +well O +and O +the O +JW B-Process +prediction I-Process +for O +the O +parity O +is O +expected O +to O +be O +reproduced O +from O +QCD B-Material +. O +In O +fact O +, O +quenched B-Task +lattice I-Task +calculation I-Task +finds O +the O +parity O +of O +Θc O +( O +3099 O +) O +to O +be O +positive O +[ O +28 O +] O +. O +In O +the O +extension O +to O +the O +Θc O +( O +3099 O +) O +sum O +rules O +, O +there O +are O +two O +important O +aspects O +, O +which O +make O +this O +sum B-Task +rule I-Task +different O +from O +the O +SDO B-Process +sum I-Process +rule I-Process +. O +First O +of O +all O +, O +since O +the O +charm B-Material +quark I-Material +is O +too O +heavy O +to O +form O +quark B-Material +condensate I-Material +, O +it O +gives O +non-perturbative O +effects O +only O +by O +radiating B-Material +gluons I-Material +. O +The O +quark B-Material +– I-Material +gluon I-Material +mixed I-Material +condensate I-Material +〈 O +s B-Material +̄ I-Material +gsσ I-Material +· I-Material +Gs I-Material +〉 O +, O +which O +was O +the O +important O +contribution O +in O +the O +Θ B-Process ++ I-Process +sum I-Process +rule I-Process +, O +is O +replaced B-Process +by I-Process +gluonic I-Process +operators I-Process +in I-Process +the I-Process +heavy I-Process +quark I-Process +expansion I-Process +that O +are O +normally O +suppressed O +. O +Secondly O +, O +the O +charm B-Process +quark I-Process +mass I-Process +has I-Process +to I-Process +be I-Process +kept I-Process +finite I-Process +in I-Process +the I-Process +OPE I-Process +, O +which O +can O +be O +done O +by O +using O +the O +momentum B-Process +space I-Process +expression I-Process +for O +the O +charm-quark B-Material +propagator I-Material +. O +This O +is O +different O +from O +the B-Process +light-quark I-Process +sum I-Process +rule I-Process +where O +the O +calculation O +is O +performed O +in O +the O +coordinate O +space O +and O +all O +the O +quark B-Material +propagators I-Material +are O +obtained O +based O +on O +the O +expansion O +with O +the O +small B-Material +quark I-Material +mass O +. O +Keeping O +these O +two O +aspects O +in O +mind O +, O +we O +construct O +QCD B-Process +sum I-Process +rules I-Process +for O +Θc O +( O +3099 O +) O +and O +see B-Task +how I-Task +they I-Task +are I-Task +different I-Task +from I-Task +the I-Task +Θ I-Task ++( I-Task +1540 I-Task +) I-Task +sum I-Task +rule I-Task +. O + +Including O +the O +O O +( O +αs O +) O +corrections O +, O +all O +the O +operators B-Task +listed I-Task +in I-Task +( I-Task +9 I-Task +) I-Task +and I-Task +( I-Task +10 I-Task +) I-Task +have I-Task +to I-Task +be I-Task +included I-Task +. O +A O +convenient O +framework O +to O +carry O +out O +these O +calculations O +is O +the O +QCD B-Process +factorization I-Process +framework I-Process +[ O +14 O +] O +which O +allows O +to O +express B-Process +the I-Process +hadronic I-Process +matrix I-Process +elements I-Process +in I-Process +the I-Process +schematic I-Process +form I-Process +: I-Process +( O +11 O +)〈 O +Vγ O +| O +Oi O +| O +B O +〉= O +FB O +→ O +VTiI O ++∫ O +dk O ++ O +2π O +∫ O +01duφB O +,+( O +k O ++) O +TiII O +( O +k O ++ O +, O +u O +) O +φV O +⊥( O +u O +) O +, O +where O +FB O +→ O +V O +are O +the O +transition O +form O +factors O +defined O +through O +the O +matrix O +elements O +of O +the O +operator O +O7 O +, O +φB O +,+( O +k O ++) O +is O +the O +leading-twist O +B-meson O +wave-function O +with O +k O ++ O +being O +a O +light-cone O +component O +of O +the O +spectator O +quark O +momentum O +, O +φ O +⊥ O +V O +( O +u O +) O +is O +the O +leading-twist O +light-cone O +distribution O +amplitude O +( O +LCDA O +) O +of O +the O +transversely-polarized O +vector O +meson O +V O +, O +and O +u O +is O +the O +fractional O +momentum O +of O +the O +vector O +meson O +carried O +by O +one O +of O +the O +two O +partons O +. O +The O +quantities O +TiI O +and O +TiII O +are O +the O +hard-perturbative O +kernels O +calculated O +to O +order O +αs O +, O +with O +the O +latter O +containing O +the O +so-called O +hard-spectator O +contributions O +. O +The O +factorization O +formula O +( O +11 O +) O +holds O +in O +the O +heavy O +quark O +limit O +, O +i.e. O +, O +to O +order O +ΛQCD O +/ O +MB O +. O +This O +factorization O +framework O +has O +been O +used O +to O +calculate O +the O +branching O +fractions O +and O +related O +quantities O +for O +the O +decays O +B O +→ O +K O +∗ O +γ O +[ O +15 O +– O +17 O +] O +and O +B O +→ O +ργ O +[ O +15,17 O +] O +. O +The O +isospin O +violation O +in O +the O +B O +→ O +K O +∗ O +γ O +decays O +in O +this O +framework O +have O +also O +been O +studied O +[ O +18 O +] O +. O +( O +For O +applications O +to O +B O +→ O +K O +∗ O +γ O +∗ O +, O +see O +Refs. O +[ O +16,19,20 O +].) O +Very O +recently O +, O +the O +hard-spectator O +contribution O +arising O +from O +the O +chromomagnetic O +operator O +O8 O +have O +also O +been O +calculated O +in O +next-to-next-to-leading O +order O +( O +NNLO O +) O +in O +αs O +showing O +that O +the O +spectator O +interactions O +factorize O +in O +the O +heavy O +quark O +limit O +[ O +21 O +] O +. O +However O +, O +the O +numerical O +effect O +of O +the O +resummed O +NNLO O +contributions O +is O +marginal O +and O +we O +shall O +not O +include O +this O +in O +our O +update O +. O + +Several O +methods O +based O +on O +dynamical O +assumptions O +were O +suggested O +for O +determination B-Task +of I-Task +the I-Task +P-parity I-Task +of O +the O +Θ O ++ O +[ O +13 O +] O +. O +According O +to O +a O +general B-Process +theorem I-Process +[ O +14 O +] O +, O +in O +order O +to O +determine B-Task +the I-Task +parity I-Task +of O +one O +particle B-Material +in O +a O +binary B-Process +reaction I-Process +one O +has O +to O +know O +polarizations O +at O +least O +of O +two O +fermions B-Material +participating O +in O +this B-Process +reaction I-Process +. O +Model B-Process +independent I-Process +methods I-Process +for O +determination B-Task +of I-Task +the I-Task +P-parity I-Task +of O +the O +Θ O ++ O +were O +suggested O +recently O +in O +Refs O +. O +[ O +15,16 O +] O +for O +pp-collision B-Process +, O +and O +in O +Ref O +. O +[ O +17 O +] O +for O +photoproduction B-Process +of O +the O +Θ O ++ O +. O +The O +method O +of O +Refs O +. O +[ O +15,16 O +] O +, O +based O +on O +the O +assumption O +that O +the O +spin O +of O +the O +Θ O ++ O +equals O +12 O +, O +suggests O +to O +measure B-Process +the I-Process +spin I-Process +– I-Process +spin I-Process +correlation I-Process +parameter I-Process +in O +the O +reaction O +p O +→ O +p O +→→ O +Σ O ++ O +Θ O ++ O +near O +the O +threshold O +. O +We O +generalize O +here O +this O +method O +for O +an O +arbitrary O +spin O +of O +the O +Θ O ++ O +and O +both O +isospins O +T O += O +0 O +and O +T O += O +1 O +of O +the O +NN O +channel O +of O +the O +NN O +→ O +YΘ O ++ O +reaction O +. O +Furthermore O +, O +we O +consider O +a O +polarization B-Process +transfer I-Process +from O +a O +nucleon B-Material +to O +the B-Material +hyperon I-Material +Y I-Material +in O +this O +reaction O +. O +Our O +consideration O +is O +model O +independent O +, O +since O +it O +is O +based O +only O +on O +conservation B-Process +of I-Process +the I-Process +P-parity I-Process +, O +total B-Process +angular I-Process +momentum I-Process +and O +isospin B-Process +in O +the O +reaction B-Process +and O +the O +generalized O +Pauli O +principle O +for O +nucleons B-Material +. O + +A O +central O +question O +from O +the O +point O +of O +view O +of O +nuclear O +physics O +involves O +the O +changes B-Task +to I-Task +the I-Task +quark I-Task +and I-Task +antiquark I-Task +distributions I-Task +of I-Task +a I-Task +bound I-Task +proton I-Task +. O +Since O +one O +must O +develop B-Task +a I-Task +reliable I-Task +model I-Task +of I-Task +both I-Task +the I-Task +free I-Task +proton I-Task +and I-Task +the I-Task +binding I-Task +of I-Task +nucleons I-Task +starting I-Task +from I-Task +the I-Task +quark I-Task +level I-Task +[ O +8 O +] O +, O +this O +problem O +is O +rather O +complicated O +. O +We O +intend O +to O +report O +on O +our O +investigation O +of O +that O +problem O +in O +future O +work O +. O +For O +the O +present O +, O +we O +have O +chosen O +to O +illustrate B-Process +the I-Process +formal I-Process +ideas I-Process +developed I-Process +here I-Process +by I-Process +applying I-Process +them I-Process +to I-Process +a I-Process +toy I-Process +model I-Process +, O +namely O +the O +quark B-Material +distributions I-Material +of I-Material +isospin I-Material +symmetric I-Material +quark I-Material +matter I-Material +in O +which O +each B-Process +quark I-Process +feels I-Process +a I-Process +scalar I-Process +potential I-Process +, I-Process +− I-Process +Vsq I-Process +, I-Process +and I-Process +a I-Process +vector I-Process +potential I-Process +, I-Process +Vvq I-Process +. O +This O +is O +the O +premise O +of O +the O +Quark B-Process +– I-Process +Meson I-Process +Coupling I-Process +( O +QMC B-Process +) O +model O +[ O +9 O +] O +which O +has O +been O +used O +successfully O +to O +calculate B-Task +the I-Task +properties I-Task +of I-Task +nuclear I-Task +matter I-Task +as I-Task +well I-Task +as I-Task +finite I-Task +nuclei I-Task +[ O +10,11 O +] O +. O +Most O +recently O +it O +has O +also O +been O +used O +to O +derive O +an O +effective B-Task +nuclear I-Task +force I-Task +which O +is O +very O +close O +to O +the O +widely O +used O +Skyrme O +III O +force O +[ O +12 O +] O +. O +( O +Except O +that O +in O +QMC O +the O +quarks O +are O +confined O +by O +the O +MIT O +bag O +, O +as O +well O +as O +feeling O +the O +mean-field O +scalar O +and O +vector O +potentials O +generated O +by O +the O +surrounding O +nucleons O +. O +) O +In O +the O +mean B-Process +field I-Process +approximation I-Process +, O +the O +Dirac B-Task +equation I-Task +for I-Task +the I-Task +quark I-Task +in I-Task +infinite I-Task +quark I-Task +matter I-Task +is O +written O +as O +: O +( B-Task +30 I-Task +) I-Task +iγ I-Task +·∂− I-Task +m I-Task +− I-Task +Vqs I-Task +− I-Task +γ0VqvψQMq I-Task +( I-Task +x I-Task +)= I-Task +0 I-Task +. O + +Within O +a O +coalescence B-Process +approach I-Process +as O +successfully O +applied O +earlier O +in O +the O +light-quark B-Task +sector I-Task +, O +we O +have O +evaluated B-Process +transverse-momentum I-Process +dependencies I-Process +of O +charmed B-Material +hadrons I-Material +in O +central B-Process +heavy-ion I-Process +reactions I-Process +at O +RHIC O +. O +For O +the O +charm-quark B-Task +distributions I-Task +at O +hadronization O +we O +have O +considered O +two O +limiting O +scenarios O +, O +i.e. O +, O +no O +reinteractions O +( O +using O +spectra O +from O +PYTHIA O +) O +and O +complete O +thermalization O +with O +transverse O +flow O +of O +the O +bulk O +matter O +. O +The O +resulting O +J O +/ O +ψ O +( O +mT O +-) O +spectra O +differ O +in O +slope O +by O +up O +to O +a O +factor O +of O +2 O +( O +harder O +for O +pQCD O +c-quarks O +) O +, O +and O +the O +integrated O +yield O +is O +about O +a O +factor O +of O +3 O +larger O +in O +the O +thermal O +case O +. O +For O +D-mesons O +, O +we O +found O +that O +the O +difference O +in O +the O +slope O +parameters O +of O +the O +pT-spectra O +in O +the O +two O +scenarios O +is O +less O +pronounced O +, O +but O +their O +elliptic O +flow O +is O +about O +a O +factor O +of O +2 O +larger O +for O +pT O +⩾ O +1.5 O +GeV O +in O +the O +thermalized O +case O +. O +The O +elliptic O +flow O +pattern O +of O +D-mesons O +was O +found O +to O +be O +essentially O +preserved O +in O +the O +single-electron O +decay O +spectra O +, O +rendering O +the O +latter O +a O +very O +promising O +observable O +to O +address O +the O +strength O +of O +charm O +reinteractions O +in O +the O +QGP O +. O +The O +present O +study O +can O +be O +straightforwardly O +generalized O +to O +charmed O +baryons O +( O +Λc O +) O +, O +which O +may O +serve O +as O +a O +complimentary O +probe O +for O +charm-quark O +reinteractions O +in O +the O +QGP O +. O + +One O +of O +the O +challenges O +in O +quantum B-Task +chromodynamics I-Task +( O +QCD B-Task +) O +is O +the O +relativistic B-Task +bound I-Task +state I-Task +problem I-Task +. O +In O +the O +light-cone B-Process +Hamiltonian I-Process +approach I-Process +[ O +1 O +] O +light-cone B-Task +wave I-Task +functions I-Task +can O +be O +constructed O +in O +a O +boost O +invariant O +way O +. O +It O +is O +necessary O +to O +have O +reliable B-Material +light-cone I-Material +wave I-Material +functions I-Material +if O +one O +wants O +to O +calculate B-Task +high I-Task +energy I-Task +scattering I-Task +, O +especially O +exclusive O +reactions B-Process +. O +Many O +parametrizations O +assume O +separability O +of O +the O +dependence O +on O +the O +longitudinal O +momentum O +fraction O +and O +transverse O +momentum O +which O +is O +very O +unlikely O +since O +the O +two O +momenta O +are O +coupled O +in O +the O +kinetic O +energy O +operator O +. O +Various O +approaches O +have O +been O +tried O +to O +compute O +such O +wave O +functions O +. O +One O +can O +use O +the O +usual O +equal B-Process +time I-Process +Hamiltonian I-Process +[ O +2 O +] O +and O +transform B-Process +the I-Process +resulting I-Process +wave I-Process +functions I-Process +into I-Process +light-cone I-Process +form I-Process +with O +the O +help O +of O +kinematical B-Process +on-shell I-Process +equations I-Process +. O +The O +light-cone O +Hamiltonian O +in O +a O +string O +picture O +is O +formulated O +in O +Ref O +. O +[ O +3 O +] O +. O +More O +ambitious O +is O +the O +construction B-Task +of I-Task +an I-Task +effective I-Task +Hamiltonian I-Task +including I-Task +the I-Task +gauge I-Task +degrees I-Task +of I-Task +freedom I-Task +explicitly I-Task +and O +then O +solving B-Process +the I-Process +bound I-Process +state I-Process +problem I-Process +. O +For O +mesons B-Material +this O +approach O +[ O +4,5 O +] O +still O +needs O +many O +parameters O +to O +be O +fixed O +. O +Attempts O +have O +been O +made O +to O +solve B-Task +the I-Task +valence I-Task +quark I-Task +wave I-Task +function I-Task +for I-Task +mesons I-Task +in O +a O +simple B-Process +Hamiltonian I-Process +with I-Process +a I-Process +two-body I-Process +potential I-Process +[ O +6 O +] O +. O + +The O +microwave B-Process +background I-Process +is O +not O +the O +only O +universal B-Material +photon I-Material +field I-Material +that O +has O +to O +be O +taken B-Process +in I-Process +consideration I-Process +. O +Especially O +interesting O +is O +the O +isotropic B-Process +infrared I-Process +and I-Process +optical I-Process +background I-Process +( O +IRB B-Process +) O +. O +The O +number O +density O +of O +IRB O +is O +smaller O +than O +that O +of O +MBR B-Process +by O +more O +that O +two O +orders O +of O +magnitude O +. O +On O +the O +other O +hand O +, O +protons B-Material +of O +lower O +energy O +can O +interact O +on O +the O +IRB B-Process +, O +and O +the B-Process +smaller I-Process +number I-Process +density I-Process +has I-Process +to I-Process +be I-Process +weighted I-Process +with I-Process +the I-Process +higher I-Process +flux I-Process +of I-Process +interacting I-Process +protons I-Process +. O +The O +present B-Task +Universe I-Task +is O +optically O +thin O +to O +1019 O +eV O +and O +lower B-Material +energy I-Material +protons I-Material +, O +but O +even O +at O +low O +redshifts O +the O +proton B-Material +interaction O +rate O +quickly O +increases O +. O +This O +is O +different O +from O +the O +interactions B-Task +on I-Task +MBR I-Task +, O +where O +the O +interacting B-Material +protons I-Material +quickly B-Process +lose I-Process +their I-Process +energy I-Process +even I-Process +at I-Process +z I-Process += I-Process +0 I-Process +. O +The O +cosmological B-Process +evolution I-Process +of I-Process +UHECR I-Process +injection I-Process +is O +thus O +of O +major O +importance O +for O +the O +contribution O +of O +such O +interactions O +to O +the O +flux B-Task +of I-Task +cosmogenic I-Task +neutrinos I-Task +. O + +In O +this O +Letter O +, O +we O +extend B-Task +the I-Task +McVittie I-Task +'s I-Task +solution I-Task +into I-Task +charged I-Task +black I-Task +holes I-Task +. O +We O +first O +deduce B-Process +the I-Process +metric I-Process +for I-Process +a I-Process +Reissner I-Process +– I-Process +Nordström I-Process +black I-Process +hole I-Process +in I-Process +the I-Process +expanding I-Process +universe I-Process +; O +several O +special O +cases O +of O +our O +solution O +are O +exactly O +the O +same O +as O +some O +solutions O +discovered O +previously O +. O +In O +the O +previous O +work O +[ O +6 O +] O +we O +have O +applied B-Task +the I-Task +asymptotic I-Task +conditions I-Task +to I-Task +derive I-Task +the I-Task +Schwarzschild I-Task +metric I-Task +in I-Task +the I-Task +expanding I-Task +universe I-Task +, O +which O +is O +exactly O +the O +same O +as O +that O +derived O +by O +McVittie O +by O +solving B-Process +the I-Process +full I-Process +Einstein I-Process +equations I-Process +. O +That O +demonstrates O +the O +power O +of O +this O +simple O +and O +straight-forward O +approach O +. O +In O +this O +Letter O +we O +follow B-Process +the I-Process +same I-Process +procedure I-Process +to I-Process +derive I-Process +the I-Process +metric I-Process +for O +the O +Reissner B-Task +– I-Task +Nordström I-Task +black I-Task +holes I-Task +in I-Task +Friedman I-Task +– I-Task +Robertson I-Task +– I-Task +Walker I-Task +universe I-Task +. O +We O +then O +study B-Task +the I-Task +influences I-Task +of I-Task +the I-Task +evolution I-Task +of I-Task +the I-Task +universe I-Task +on I-Task +the I-Task +size I-Task +of I-Task +the I-Task +black I-Task +hole I-Task +. O +Finally O +, O +in O +order O +to O +study B-Task +the I-Task +motion I-Task +of I-Task +the I-Task +planet I-Task +, O +we O +rewrite B-Process +the I-Process +metric I-Process +from I-Process +the I-Process +cosmic I-Process +coordinates I-Process +system I-Process +to I-Process +the I-Process +Schwarzschild I-Process +coordinates I-Process +system I-Process +. O + +The O +ART B-Process +model I-Process +is O +a O +hadronic B-Process +transport I-Process +model I-Process +that O +includes O +baryons B-Material +such O +as O +N B-Material +, I-Material +Δ I-Material +( I-Material +1232 I-Material +) I-Material +, O +N B-Material +∗( I-Material +1440 I-Material +) I-Material +, O +N B-Material +∗( I-Material +1535 I-Material +) I-Material +, O +Λ B-Material +, O +Σ B-Material +, O +and O +mesons B-Material +such O +as O +π B-Material +, O +ρ B-Material +, O +ω B-Material +, O +η B-Material +, O +K B-Material +, O +K B-Material +∗ I-Material +. O +Both O +elastic B-Task +and I-Task +inelastic I-Task +collisions I-Task +among O +most O +of O +these B-Material +particles I-Material +are O +included O +by O +using O +the O +experimental B-Material +data I-Material +from I-Material +hadron I-Material +– I-Material +hadron I-Material +collisions I-Material +. O +The O +ART B-Process +model I-Process +has O +been O +quite O +successful O +in O +explaining B-Task +many I-Task +experimental I-Task +observations I-Task +, O +including O +the O +surprisingly O +large O +kaon B-Process +antiflow I-Process +[ O +11,12 O +] O +in O +heavy B-Material +ion I-Material +collisions O +at O +AGS B-Process +energies I-Process +. O +The O +ART B-Process +model I-Process +also O +allows O +us O +to O +understand B-Task +whether I-Task +or I-Task +not I-Task +the I-Task +strongly I-Task +interacting I-Task +matter I-Task +formed I-Task +in I-Task +these I-Task +collisions I-Task +reaches I-Task +chemical I-Task +and I-Task +/ I-Task +or I-Task +thermal I-Task +equilibrium I-Task +. O +In O +the O +present O +study O +, O +we O +extend B-Task +the I-Task +ART I-Task +model I-Task +to I-Task +include I-Task +perturbatively I-Task +the I-Task +Ξ I-Task +particle I-Task +as O +in O +the O +studies O +for O +other O +rare B-Material +particles I-Material +using O +the O +transport B-Material +model I-Material +[ O +6,13,14 O +] O +. O + +Though O +, O +in O +this O +Letter O +we O +have O +constructed B-Task +the I-Task +Born I-Task +– I-Task +Infeld I-Task +black I-Task +holes I-Task +in I-Task +the I-Task +presence I-Task +of I-Task +a I-Task +cosmological I-Task +constant I-Task +and O +discussed B-Task +their I-Task +thermodynamical I-Task +properties I-Task +, O +many O +issues O +however O +still O +remain O +to O +be O +investigated O +. O +We O +know O +that O +Reissner B-Material +– I-Material +Nordström I-Material +AdS I-Material +black I-Material +holes I-Material +undergo O +Hawking B-Process +– I-Process +Page I-Process +phase I-Process +transition I-Process +. O +This O +transition O +gets O +modified O +as O +we O +include O +Born B-Process +– I-Process +Infeld I-Process +corrections I-Process +into O +account O +. O +We O +hope O +to O +carry O +out O +a O +detail O +study O +on O +this O +issue O +in O +the O +future O +. O +Furthermore O +, O +in O +the O +context O +of O +brane B-Task +world I-Task +cosmology I-Task +, O +it O +was O +found O +that O +a O +brane O +moving O +in O +a O +Reissner B-Process +– I-Process +Nordström I-Process +AdS I-Process +background I-Process +generates O +non-singular B-Task +cosmology I-Task +[ O +14 O +] O +. O +However O +, O +as O +shown O +in O +[ O +15 O +] O +, O +the O +brane B-Material +always O +crosses B-Process +the I-Process +inner I-Process +horizon I-Process +of I-Process +the I-Process +bulk I-Process +geometry I-Process +, O +creating O +an O +instability B-Process +. O +It O +would O +be O +interesting O +to O +study B-Task +cosmology I-Task +on I-Task +the I-Task +brane I-Task +when I-Task +it I-Task +is I-Task +moving I-Task +in I-Task +the I-Task +charged I-Task +black I-Task +hole I-Task +backgrounds I-Task +that O +we O +have O +constructed O +. O +Note O +that O +since O +these O +charged B-Material +holes I-Material +does O +not O +have O +inner O +horizon O +for O +certain O +range O +of O +parameters O +, O +we O +may O +generate B-Task +non-singular I-Task +cosmology I-Task +without I-Task +creating I-Task +the I-Task +instabilities I-Task +that O +we O +have O +just O +mentioned O +. O + +We O +prove B-Process +the I-Process +uniqueness I-Process +of O +the O +supersymmetric O +Salam O +– O +Sezgin O +( O +Minkowski O +) O +4 O +× O +S2 O +ground O +state O +among O +all O +non-singular B-Task +solutions I-Task +with I-Task +a I-Task +four-dimensional I-Task +Poincaré I-Task +, O +de B-Task +Sitter I-Task +or I-Task +anti-de I-Task +Sitter I-Task +symmetry I-Task +. O +We O +construct B-Process +the I-Process +most I-Process +general I-Process +solutions I-Process +with O +an O +axial B-Task +symmetry I-Task +in I-Task +the I-Task +two-dimensional I-Task +internal I-Task +space I-Task +, I-Task +and O +show O +that O +included O +amongst O +these O +is O +a O +family O +that O +is O +non-singular B-Process +away I-Process +from I-Process +a I-Process +conical I-Process +defect I-Process +at O +one O +pole O +of O +a O +distorted O +2-sphere O +. O +These O +solutions O +admit O +the O +interpretation B-Process +of I-Process +3-branes I-Process +with I-Process +negative I-Process +tension I-Process +. O + +Longitudinal B-Task +beam I-Task +and I-Task +target I-Task +single-spin I-Task +asymmetries I-Task +have O +been O +at O +the O +center O +of O +the O +attention O +lately O +, O +since O +they O +have O +been O +measured O +by O +the O +HERMES B-Process +and I-Process +CLAS I-Process +experimental I-Process +Collaborations I-Process +[ O +1 O +– O +4 O +] O +and O +more O +measurements O +are O +planned O +. O +They O +were O +originally O +believed O +to O +be O +signals O +of O +the O +so-called O +T-odd B-Process +fragmentation I-Process +functions I-Process +[ O +5 O +] O +, O +in O +particular O +, O +of O +the O +Collins B-Process +function I-Process +[ O +6 O +– O +12 O +] O +. O +However O +, O +both O +types O +of O +asymmetry O +can O +receive B-Process +contributions I-Process +also I-Process +from I-Process +T-odd I-Process +distribution I-Process +functions I-Process +[ O +13 O +– O +16 O +] O +, O +a O +fact O +that O +has O +often O +been O +neglected O +in O +analyses O +. O +An O +exhaustive B-Task +treatment I-Task +of I-Task +the I-Task +contributions I-Task +of I-Task +T-odd I-Task +distribution I-Task +functions I-Task +has O +not O +been O +carried O +out O +completely O +so O +far O +, O +especially O +up O +to O +subleading B-Process +order I-Process +in I-Process +an I-Process +expansion I-Process +in I-Process +1 I-Process +/ I-Process +Q I-Process +, O +Q2 O +being O +the O +virtuality O +of O +the O +incident B-Material +photon I-Material +and O +the O +only O +hard O +scale O +of O +the O +process O +, O +and O +including O +quark B-Material +mass O +corrections O +. O +It O +is O +the O +purpose O +of O +the O +present O +work O +to O +describe B-Task +the I-Task +longitudinal I-Task +beam I-Task +and I-Task +target I-Task +spin I-Task +asymmetries I-Task +in O +a O +complete O +way O +in O +terms O +of O +leading O +and O +subleading O +twist B-Process +distribution I-Process +and O +fragmentation B-Process +functions I-Process +. O +We O +consider O +both O +single-particle B-Process +inclusive I-Process +DIS I-Process +, O +e B-Process ++ I-Process +p I-Process +→ I-Process +e′ I-Process ++ I-Process +h I-Process ++ I-Process +X I-Process +, O +and O +single-jet B-Process +inclusive I-Process +DIS I-Process +, O +e B-Process ++ I-Process +p I-Process +→ I-Process +e′ I-Process ++ I-Process +jet I-Process ++ I-Process +X I-Process +. O +We O +assume O +factorization B-Process +holds O +for O +these O +processes O +, O +even O +though O +at O +present O +there O +is O +no O +factorization B-Task +proof I-Task +for I-Task +observables I-Task +containing I-Task +subleading-twist I-Task +transverse-momentum I-Task +dependent I-Task +functions I-Task +( O +only O +recently O +proofs B-Task +for I-Task +the I-Task +leading-twist I-Task +case I-Task +have O +been O +presented O +in O +Refs. O +[ O +17,18 O +]) O +. O + +There O +are O +many O +possible O +applications B-Task +for I-Task +this I-Task +mechanism I-Task +. O +In O +this O +Letter O +, O +we O +have O +concentrated O +on O +its B-Task +contribution I-Task +to I-Task +leptogenesis I-Task +and I-Task +baryogenesis I-Task +. O +Our O +calculation O +is O +applicable O +in B-Process +the I-Process +phase I-Process +when I-Process +the I-Process +fields I-Process +are I-Process +rolling I-Process +. O +This O +rolling B-Process +phase I-Process +will O +start O +when O +the O +Hubble B-Process +constant I-Process +drops I-Process +to I-Process +a I-Process +value I-Process +comparable I-Process +to I-Process +the I-Process +mass I-Process +of I-Process +the I-Process +scalar I-Process +fields I-Process +. O +It O +is O +at O +this O +time O +in O +the O +cosmological B-Process +evolution I-Process +that O +CP B-Process +violation I-Process +is O +most O +efficient O +. O +After O +the O +fields B-Process +have I-Process +relaxed I-Process +to I-Process +their I-Process +vacuum I-Process +values I-Process +, O +our O +CP B-Process +violation I-Process +mechanism I-Process +turns O +off O +. O +We O +plan O +to O +discuss O +more O +details O +, O +in O +particular O +applications B-Task +to I-Task +concrete I-Task +baryogenesis I-Task +models I-Task +, O +in O +a O +future O +publication O +[ O +20 O +] O +. O +Note O +that O +string B-Task +cosmology I-Task +and O +brane B-Task +world I-Task +scenarios I-Task +may O +provide O +natural O +settings O +for O +the O +origin O +of O +the O +scalar B-Material +fields I-Material +required O +for O +our B-Process +mechanism I-Process +( O +e.g. O +see O +Ref O +. O +[ O +30 O +] O +for O +a O +recent O +paper O +on O +how B-Task +scalar I-Task +fields I-Task +from I-Task +brane I-Task +world I-Task +scenarios I-Task +can I-Task +play I-Task +a I-Task +new I-Task +role I-Task +in I-Task +spontaneous I-Task +baryogenesis I-Task +) O +. O + +In O +the O +brane B-Material +system I-Material +appearing O +in O +string B-Process +/ I-Process +D-brane I-Process +theory I-Process +, O +the O +stableness B-Task +is O +the O +most O +important O +requirement O +. O +We O +find O +some O +stable B-Process +brane I-Process +configurations I-Process +in O +the O +SUSY B-Process +bulk-boundary I-Process +theory I-Process +. O +We O +systematically O +solve B-Task +the I-Task +singular I-Task +field I-Task +equation I-Task +using O +a O +general B-Process +mathematical I-Process +result I-Process +about I-Process +the I-Process +free-wave I-Process +solution I-Process +in O +S1 O +/ O +Z2-space O +. O +The O +two O +scalars O +, O +the O +extra-component B-Process +of I-Process +the I-Process +bulk-vector I-Process +( O +A5 B-Process +) O +and O +the O +bulk-scalar B-Process +( O +Φ B-Process +) O +, O +constitute O +the O +solutions O +. O +Their O +different B-Task +roles I-Task +are I-Task +clarified I-Task +. O +The O +importance O +of O +the O +“ O +parallel O +” O +configuration O +is O +disclosed O +. O +The O +boundary B-Process +condition I-Process +( O +of O +A5 O +) O +and O +the O +boundary O +matter O +fields O +are O +two O +important O +elements O +for O +making O +the O +localized O +configuration O +. O +Among O +all O +solutions O +, O +the O +solution B-Process +( O +c1 B-Process +=− I-Process +1 I-Process +, I-Process +c2 I-Process +=− I-Process +1 I-Process +) O +is O +expected O +to O +be O +the O +thin-wall B-Process +limit I-Process +of O +a O +kink B-Process +solution I-Process +. O +We O +present O +a O +bulk B-Process +Higgs I-Process +model I-Process +corresponding O +to O +the O +non-singular B-Process +solution I-Process +. O +The O +model O +is O +expected O +to O +give O +a O +non-singular B-Process +and I-Process +stable I-Process +brane I-Process +solution I-Process +in O +the O +SUSY B-Process +bulk-boundary I-Process +theory I-Process +. O + +The O +spins B-Task +and I-Task +parities I-Task +of I-Task +Θ I-Task ++ I-Task +and I-Task +Ξ I-Task +−− I-Task +are O +not O +yet O +known O +experimentally O +. O +In O +this O +new B-Task +wave I-Task +of I-Task +pentaquark I-Task +research I-Task +, O +most O +theoretical O +papers O +take B-Process +the I-Process +spin I-Process +equal I-Process +to I-Process +1 I-Process +/ I-Process +2 I-Process +. O +The O +parity O +is O +more O +controversial O +. O +In O +chiral B-Process +soliton I-Process +or O +Skyrme B-Process +models I-Process +the O +parity O +is O +positive O +[ O +4 O +] O +. O +In O +constituent B-Process +quark I-Process +models I-Process +it O +is O +usually O +positive O +. O +In O +the O +present O +approach O +, O +the O +parity B-Task +of I-Task +the I-Task +pentaquark I-Task +is O +given O +by O +P B-Task +=(−) I-Task +ℓ I-Task ++ I-Task +1 I-Task +, O +where O +ℓ O +is O +the O +angular B-Task +momentum I-Task +associated I-Task +with I-Task +the I-Task +relative I-Task +coordinates I-Task +of I-Task +the I-Task +q4 I-Task +subsystem I-Task +. O +We O +analyze O +the O +case O +where O +the O +subsystem B-Task +of I-Task +four I-Task +light I-Task +quarks I-Task +is I-Task +in I-Task +a I-Task +state I-Task +of I-Task +orbital I-Task +symmetry I-Task +[ O +31 O +] O +O O +and O +carries O +an O +angular O +momentum O +ℓ O += O +1 O +. O +Although O +the O +kinetic B-Process +energy I-Process +of O +such O +a O +state O +is O +higher O +than O +that O +of O +the O +totally B-Process +symmetric I-Process +[ I-Process +4 I-Process +] I-Process +O I-Process +state I-Process +, O +the O +[ O +31 O +] O +O B-Process +symmetry I-Process +is O +the O +most O +favourable O +both O +for O +the O +flavour B-Process +– I-Process +spin I-Process +interaction I-Process +[ O +12 O +] O +and O +the O +colour B-Process +– I-Process +spin I-Process +interaction I-Process +[ O +13 O +] O +. O +In O +the O +first O +case O +the O +statement O +is O +confirmed O +by O +the O +comparison B-Task +between I-Task +the I-Task +realistic I-Task +calculations I-Task +for I-Task +positive I-Task +parity I-Task +[ I-Task +12 I-Task +] I-Task +and I-Task +negative I-Task +parity I-Task +[ I-Task +14 I-Task +] I-Task +, I-Task +based I-Task +on I-Task +the I-Task +same I-Task +quark I-Task +model I-Task +[ I-Task +15 I-Task +] I-Task +. O +In O +Ref O +. O +[ O +12 O +] O +the O +antiquark B-Material +was O +heavy O +, O +c O +or O +b O +, O +and O +accordingly O +the O +interaction B-Process +between I-Process +light I-Process +quarks I-Process +and I-Process +the I-Process +heavy I-Process +antiquark I-Process +was I-Process +neglected I-Process +, I-Process +consistent I-Process +with I-Process +the I-Process +heavy I-Process +quark I-Process +limit I-Process +. O +In O +Ref O +. O +[ O +16 O +] O +an O +attractive O +spin B-Process +– I-Process +spin I-Process +interaction I-Process +between O +s B-Material +̄ I-Material +and O +the O +light B-Material +quarks I-Material +was O +incorporated O +and O +shown O +that O +a O +stable O +or O +narrow O +positive O +parity O +uudds B-Material +̄ I-Material +pentaquark I-Material +can O +be O +accommodated O +within O +such O +a O +model O +. O +This O +interaction O +has O +a O +form O +that O +corresponds O +to O +η B-Process +meson I-Process +exchange I-Process +[ O +17 O +] O +and O +its O +role O +is O +to O +lower B-Process +the I-Process +energy I-Process +of I-Process +the I-Process +whole I-Process +system I-Process +. O + +There O +exist O +some O +interesting O +cases O +where O +the O +deformation B-Process +structure I-Process +becomes O +simple O +. O +One O +is O +the O +limit O +to O +the O +N B-Process += I-Process +1 I-Process +/ I-Process +2 I-Process +superspace I-Process +[ O +5 O +] O +, O +where O +the O +action O +should O +reduce O +to O +N B-Process += I-Process +1 I-Process +/ I-Process +2 I-Process +super-Yang I-Process +– I-Process +Mills I-Process +theory I-Process +with I-Process +adjoint I-Process +matter I-Process +. O +Another O +interesting O +case O +is O +the O +singlet B-Task +deformation I-Task +[ O +10,11 O +] O +, O +where O +the O +deformation B-Process +parameters I-Process +belongs O +to O +the O +singlet B-Process +representation I-Process +of O +the O +R-symmetry B-Process +group I-Process +SU B-Process +( I-Process +2 I-Process +) I-Process +R I-Process +. O +In O +this O +Letter O +, O +we O +will O +study O +N B-Task += I-Task +2 I-Task +supersymmetric I-Task +U I-Task +( I-Task +1 I-Task +) I-Task +gauge I-Task +theory I-Task +in O +the O +harmonic B-Process +superspace I-Process +with O +singlet B-Process +deformation I-Process +. O +In O +this O +case O +, O +the B-Task +gauge I-Task +and I-Task +supersymmetry I-Task +transformations I-Task +get O +correction B-Process +linear I-Process +in O +the O +deformation B-Process +parameter I-Process +. O +Therefore O +we O +can O +easily O +perform O +the O +field B-Process +redefinition I-Process +such O +that O +the O +component O +fields O +transform O +canonically O +under O +the O +gauge B-Process +transformation I-Process +. O +In O +the O +case O +of O +N B-Task += I-Task +1 I-Task +/ I-Task +2 I-Task +super-Yang I-Task +– I-Task +Mills I-Task +theory I-Task +, O +such O +field B-Process +redefinition I-Process +is O +also O +possible O +[ O +5 O +] O +. O +But O +in O +this O +case O +the O +component B-Task +fields I-Task +do O +not O +transform O +canonically O +under O +the O +deformed B-Process +supersymmtery I-Process +transformation I-Process +. O +In O +the O +singlet B-Task +case I-Task +, O +we O +will O +show O +that O +there O +is O +a O +field B-Process +redefinition I-Process +such O +that O +the O +redefined O +fields O +also O +transform B-Process +canonically I-Process +under I-Process +the I-Process +deformed I-Process +supersymmetry I-Process +. O +We O +will O +construct O +a O +deformed B-Process +Lagrangian I-Process +which O +is O +invariant O +under O +both O +the O +gauge B-Process +and I-Process +supersymmetry I-Process +transformations I-Process +. O +We O +find O +that O +the O +deformed B-Process +Lagrangian I-Process +is O +characterized O +by O +a O +single B-Process +function I-Process +of O +an O +antiholomorphic B-Process +scalar I-Process +field I-Process +. O + +We O +consider O +finite-time B-Process +, I-Process +future I-Process +( I-Process +sudden I-Process +or I-Process +Big I-Process +Rip I-Process +type I-Process +) I-Process +singularities I-Process +which O +may O +occur O +even O +when O +strong B-Process +energy I-Process +condition I-Process +is O +not O +violated O +but O +equation O +of O +state O +parameter O +is O +time-dependent O +. O +Recently O +, O +example B-Task +of I-Task +such I-Task +singularity I-Task +has O +been O +presented O +by O +Barrow O +, O +we B-Task +found I-Task +another I-Task +example I-Task +of I-Task +it I-Task +. O +Taking O +into O +account O +back B-Task +reaction I-Task +of I-Task +conformal I-Task +quantum I-Task +fields I-Task +near I-Task +singularity I-Task +, O +it O +is O +shown O +explicitly O +that O +quantum B-Process +effects I-Process +may O +delay O +( O +or O +make O +milder O +) O +the O +singularity B-Process +. O +It O +is O +argued O +that O +if O +the O +evolution B-Task +to I-Task +singularity I-Task +is O +realistic O +, O +due O +to O +quantum B-Process +effects I-Process +the B-Process +universe I-Process +may I-Process +end I-Process +up I-Process +in I-Process +de I-Process +Sitter I-Process +phase I-Process +before O +scale B-Process +factor I-Process +blows I-Process +up I-Process +. O +This O +picture O +is O +generalized O +for O +braneworld B-Material +where O +sudden B-Process +singularity I-Process +may O +occur O +on O +the O +brane B-Material +with O +qualitatively B-Process +similar I-Process +conclusions I-Process +. O + +One O +of O +the O +great O +successes O +of O +the O +experimental O +program O +carried O +out O +at O +LEP O +has O +been O +to O +put B-Process +a I-Process +firm I-Process +lower I-Process +bound I-Process +on I-Process +the I-Process +Higgs I-Process +mass I-Process +, O +mH B-Process +> I-Process +114 I-Process +GeV I-Process +[ O +1 O +] O +, O +and O +at O +the O +same O +time O +, O +together O +with O +the O +information O +coming O +from O +SLD B-Material +, O +to O +give O +a O +strong O +indirect O +evidence O +that O +the O +Higgs B-Material +boson I-Material +, O +the O +still O +missing O +particle B-Material +of O +the O +Standard B-Process +Model I-Process +( O +SM B-Process +) O +, O +should O +be O +relatively O +light O +with O +a O +high O +probability O +for O +its O +mass O +to O +be O +below O +200 O +GeV O +. 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I-Process +method I-Process +by O +Hill O +[ O +36 O +] O +results O +in O +more B-Process +appropriate I-Process +behavior I-Process +of O +the O +upper O +limit O +when O +the O +observed O +number O +of O +events O +is O +less O +than O +the O +estimated O +background O +, O +as O +is O +the O +case O +for O +the O +present O +measurement B-Process +. O +We O +have O +adopted O +this O +method O +but O +note O +that O +Table O +2 O +contains O +all O +of O +the O +numbers O +needed O +to O +calculate B-Task +an I-Task +upper I-Task +limit I-Task +using O +any O +of O +the O +methods O +in O +the O +papers O +cited O +above O +. O +We O +assume O +that O +the O +probability B-Process +density I-Process +functions I-Process +of O +Fsens O +and O +background B-Process +estimates I-Process +are O +Gaussian-distributed B-Process +. 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O +Defining O +( O +1 O +) O +δn O +=∫−∞ O +En O ++ O +1ρ O +˜( O +E O +) O +dE O +− O +n O +, O +with O +ρ O +˜( O +E O +) O +the O +mean O +level O +density O +which O +allows O +the O +mapping B-Process +to I-Process +dimensionless I-Process +levels I-Process +with O +unitary B-Process +average I-Process +level I-Process +density I-Process +, O +and O +analyzing B-Process +the I-Process +energy I-Process +fluctuations I-Process +as O +a O +discrete B-Process +time I-Process +series I-Process +, O +they O +found O +that O +nuclear B-Task +power I-Task +spectra I-Task +behave O +like O +1f O +noise O +, O +postulating O +that O +this O +might O +be O +a O +characteristic O +signature O +of O +generic O +quantum B-Task +chaotic I-Task +systems I-Task +. 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O +We O +used O +experimental O +rates O +of O +light B-Material +neutral I-Material +mesons I-Material +and O +resonances B-Process +where O +available O +( O +Table O +1 O +) O +for O +normalization B-Process +purposes O +. O +The O +uncertainty O +introduced O +by O +the O +JETSET B-Material +parameter B-Process +settings I-Process +( O +which O +amounts O +to O +20 O +% O +at O +most O +) O +affects O +only O +the O +production O +of O +the O +η′ O +and O +ϕ O +for O +which O +no O +experimental B-Material +data I-Material +are O +available O +. O +This O +uncertainty O +is O +reflected O +in O +the O +error O +quoted O +in O +the O +table O +. O +However O +, O +since O +the O +contribution O +from O +η′ O +and O +ϕ O +is O +small O +, O +the O +overall O +effect O +is O +less O +important O +. O + +In O +this O +Letter O +, O +we O +present O +results O +of O +a O +relativistic B-Task +calculation I-Task +of I-Task +decay I-Task +constants I-Task +in O +the O +framework B-Process +of I-Process +full I-Process +Salpeter I-Process +equation I-Process +. O +The O +full O +Salpeter O +equation O +is O +a O +relativistic B-Process +equation I-Process +describing O +a O +bound O +state O +. O +Since O +this O +method O +has O +a O +very O +solid O +basis O +in O +quantum B-Process +field I-Process +theory I-Process +, O +it O +is O +very O +good O +in O +describing B-Task +a I-Task +bound I-Task +state I-Task +which O +is O +a O +relativistic B-Process +system I-Process +. O +In O +a O +previous O +paper O +[ O +16 O +] O +, O +we O +solved B-Task +the I-Task +instantaneous I-Task +Bethe I-Task +– I-Task +Salpeter I-Task +equation I-Task +[ O +17 O +] O +, O +which O +is O +also O +called O +full B-Process +Salpeter I-Process +equation I-Process +[ O +18 O +] O +. O +After O +we O +solved B-Task +the I-Task +full I-Task +Salpeter I-Task +equation I-Task +, O +we O +obtained O +the O +relativistic B-Process +wave I-Process +function I-Process +of I-Process +the I-Process +bound I-Process +state I-Process +. O +We O +used O +this O +wave O +function O +to O +calculate B-Task +the I-Task +average I-Task +kinetic I-Task +energy I-Task +of O +the O +heavy B-Material +quark I-Material +inside O +a O +heavy B-Material +meson I-Material +in O +0 O +− O +state O +, O +and O +obtained B-Process +values I-Process +which O +agree O +very O +well O +with O +recent O +experiments O +. O +We O +also O +found O +there O +that O +the O +relativistic B-Process +corrections I-Process +are I-Process +quite I-Process +large I-Process +and O +cannot O +be O +ignored O +[ O +16 O +] O +. O +In O +this O +Letter O +we O +use B-Process +this I-Process +method I-Process +to O +predict B-Task +the I-Task +values I-Task +of I-Task +decay I-Task +constants I-Task +of O +heavy B-Material +mesons I-Material +in O +0 O +− O +state O +. O + +Our O +aim O +is O +to O +introduce B-Task +vector I-Task +mesons I-Task +in O +terms O +of O +a O +Lagrangian B-Process +which O +satisfies O +the O +low B-Process +energy I-Process +current I-Process +algebra I-Process +. O +One O +consistent O +method O +is O +in O +terms O +of O +a O +non-linear B-Process +chiral I-Process +Lagrangian I-Process +with O +a O +hidden B-Process +local I-Process +symmetry I-Process +[ O +6 O +] O +. O +In O +this O +theory O +the O +vector B-Material +mesons I-Material +emerge O +as O +dynamical B-Material +vector I-Material +mesons I-Material +. O +The O +three O +point O +vector-pseudo B-Process +scalar I-Process +interaction I-Process +is O +given O +by O +( O +11 O +) O +ih4 B-Process +〈 I-Process +Vμ I-Process +( I-Process +P I-Process +∂ I-Process +μP I-Process +−∂ I-Process +μPP I-Process +)〉 I-Process +, O +where O +h B-Process +stands O +for O +the O +vector-pseudoscalar B-Process +coupling I-Process +. O +Some O +typical O +vertices B-Process +of I-Process +ρ I-Process +'s I-Process +to I-Process +pseudoscalar I-Process +mesons I-Process +are O +( O +12 O +) O +π O ++( O +p1 O +) O +π O +−( O +p2 O +) O +ρ0 O +: O +h O +( O +p1 O +− O +p2 O +) O +μεμ,π O ++( O +p1 O +) O +π0 O +( O +p2 O +) O +ρ O +− O +: O +h O +( O +p1 O +− O +p2 O +) O +μεμ,K O ++( O +p1 O +) O +K O +¯ O +0 O +( O +p2 O +) O +ρ O +− O +: O +h2 O +( O +p1 O +− O +p2 O +) O +μεμ,etc. O +, O +which O +is O +directly O +related O +to O +the O +ρ O +decay O +width O +: O +Γ O +( O +ρ O +)= O +h2 O +(| O +pπ O +|) O +3 O +/( O +6πmρ2 O +) O +, O +where O +pπ O +is O +the O +momentum O +of O +final O +state O +pions O +in O +the O +ρ O +rest O +frame O +. O +With O +Γ O +( O +ρ O +)= O +149.2MeV O +, O +we O +find O +h O += O +5.95 O +. O +We O +note O +in O +passing O +that O +the O +Kawarabayashi O +– O +Suzuki O +– O +Riazuddin O +– O +Fayyazuddin O +relation O +gives O +the O +value O +h O += O +mρ O +/( O +2fπ O +)[ O +12 O +] O +. O +Thus O +the O +value O +of O +h O +in O +Eq O +. O +( O +4 O +) O +and O +the O +two O +values O +in O +this O +paragraph O +differ O +by O +small O +amounts O +(∼ O +19 O +%) O +. O +The O +strong O +four-point O +vertices O +involving O +pions O +are O +obtained O +from O +the O +first O +two O +terms O +of O +Eq O +. O +( O +5 O +) O +. O +The O +weak O +vertices O +are O +obtained O +from O +the O +definitions O +of O +Q6 O +and O +Q8 O +. O +In O +the O +numerical O +work O +we O +shall O +use O +the O +value O +of O +h O +from O +Eq O +. O +( O +4 O +) O +and O +also O +h O += O +5.95 O +obtained O +from O +the O +decay O +width O +. O + +On O +the O +other O +hand O +, O +the O +other O +local O +fields O +except O +the O +gravitational O +field O +are O +not O +always O +localized B-Task +on I-Task +the I-Task +brane I-Task +even O +in O +the O +warped B-Process +geometry I-Process +. O +Indeed O +, O +in O +the O +Randall B-Material +– I-Material +Sundrum I-Material +model I-Material +in O +five B-Task +dimensions I-Task +[ O +2 O +] O +, O +the O +following O +facts O +are O +well O +known O +: O +spin B-Process +0 I-Process +field I-Process +is I-Process +localized I-Process +on I-Process +a I-Process +brane I-Process +with O +positive B-Process +tension I-Process +which O +also O +localizes B-Process +the I-Process +graviton I-Process +while O +the O +spin O +1 O +/ O +2 O +and O +3 O +/ O +2 O +fields O +are O +localized O +not O +on O +a O +brane O +with O +positive B-Process +tension I-Process +but O +on O +a O +brane O +with O +negative B-Process +tension I-Process +[ O +6 O +] O +. O +Spin O +1 O +field O +is O +not O +localized O +neither O +on O +a O +brane O +with O +positive B-Process +tension I-Process +nor O +on O +a O +brane O +with O +negative B-Process +tension I-Process +[ O +7 O +] O +. O +In O +six B-Process +space I-Process +– I-Process +time I-Process +dimensions I-Process +, O +the O +spin O +1 O +gauge O +field O +is O +also O +localized B-Process +on I-Process +the I-Process +brane I-Process +[ O +8 O +] O +. O +Thus O +, O +in O +order O +to O +fulfill O +the O +localization B-Task +of O +Standard B-Material +Model I-Material +particles O +on O +a O +brane O +with O +positive B-Process +tension I-Process +, O +it O +seems O +that O +some O +additional O +interactions O +except O +the O +gravitational O +interaction O +must O +be O +also O +introduced B-Process +in I-Process +the I-Process +bulk I-Process +. O +There O +is O +a O +lot O +of O +papers O +devoted O +to O +the O +different O +localization B-Process +mechanisms I-Process +of O +the O +bulk O +fields O +in O +various O +brane B-Process +world I-Process +models I-Process +. O + +First-principles B-Process +calculations I-Process +have O +clarified O +the O +electronic B-Task +structure I-Task +and I-Task +stability I-Task +of O +the O +W B-Material +@ I-Material +Si12 I-Material +cluster I-Material +under O +O2 B-Material +molecule O +adsorption B-Process +and O +reaction B-Process +. O +Our O +results O +show O +that O +the O +W-encapsulated B-Process +Si12 I-Process +hexagonal I-Process +prism I-Process +cage I-Process +is O +very O +inert O +to O +oxidation B-Task +. O +The O +O2 B-Material +molecule O +only O +weakly O +adsorbs O +onto O +the O +cluster B-Material +at O +relatively O +low B-Process +temperatures I-Process +, O +in O +the O +range O +of O +several O +tens O +meV O +. O +However O +, O +significant B-Task +reaction I-Task +barriers I-Task +( O +0.593 B-Task +– I-Task +1.118 I-Task +eV I-Task +) O +for O +the O +O2 B-Material +molecule O +on O +the O +cluster B-Material +are O +identified O +on O +different O +adsorption B-Process +sites O +, O +nevertheless O +, O +these O +reaction B-Process +paths O +are O +spin B-Task +forbidden I-Task +reactions I-Task +according O +to O +Winger B-Process +ʼs I-Process +spin I-Process +selection I-Process +rule I-Process +. O +These O +results O +imply O +that O +O2 B-Material +readily O +desorb O +from O +the O +cluster B-Material +surface O +rather O +than O +dissociate O +and O +oxide O +the O +W B-Material +@ I-Material +Si12 I-Material +cluster I-Material +upon O +excitations O +. O +In O +high B-Process +temperature I-Process +and I-Process +high I-Process +pressure I-Process +conditions I-Process +, O +the O +O2 B-Material +molecules O +may O +dissociate O +on O +the O +preferential O +edge O +site O +by O +overcoming B-Process +a I-Process +significantly I-Process +large I-Process +energy I-Process +barrier I-Process +. O + +The O +length B-Task +effect I-Task +is O +always O +important O +in O +nanodevices B-Material +. O +So O +we O +investigate O +the O +length B-Task +dependence I-Task +of I-Task +electronic I-Task +transport I-Task +properties I-Task +in O +M3 O +by O +increasing B-Process +the I-Process +number I-Process +of I-Process +carbon I-Process +unit I-Process +cells I-Process +in O +the O +scattering O +region O +. O +Here O +we O +present O +the O +transport O +results O +when O +the O +numbers O +of O +carbon O +unit O +cells O +in O +the O +scattering O +region O +are O +10 O +and O +12 O +, O +which O +are O +called O +M4 O +and O +M5 O +, O +respectively O +. O +The O +current B-Process +– I-Process +voltage I-Process +characteristics I-Process +shown O +in O +Fig. O +8. O +We O +can O +see O +that O +the O +large B-Process +rectifying I-Process +ratio I-Process +still O +can O +be O +observed O +irrespective O +of O +the O +length O +of O +heterojunctions O +. O +This O +is O +due O +to O +the O +fact O +that O +the O +electronic B-Task +transport I-Task +properties I-Task +for O +M3 O +are O +mainly O +determined O +by O +the O +parity O +of O +the O +π B-Process +and I-Process +π I-Process +⁎ I-Process +subbands I-Process +of O +left O +and O +right O +electrodes O +. O +Thees O +results O +indicate O +that O +the O +lengths O +of O +the O +two O +parts O +in O +the O +scattering O +regions O +have O +no O +affects O +on O +the O +qualitative B-Task +charge I-Task +transport I-Task +in O +M3 O +. O + +Topological B-Process +insulators I-Process +( O +TIs B-Process +) O +are O +promising O +candidates O +of O +spintronics B-Material +materials I-Material +because O +of O +their O +robust O +helical O +surface O +states O +and O +the O +extremely O +strong O +spin B-Process +– I-Process +orbit I-Process +interaction I-Process +[ O +1 O +– O +3 O +] O +. O +Initially O +, O +binary B-Material +chalcogenides I-Material +Bi2Te3 B-Material +, O +Sb2Te3 B-Material +and O +Bi2Se3 B-Material +have O +been O +identified O +as O +three-dimensional O +TIs B-Process +by O +surface B-Process +sensitive I-Process +probes I-Process +such O +as O +angle B-Process +resolved I-Process +photoemission I-Process +spectroscopy I-Process +and O +scanning B-Process +tunneling I-Process +microscopy I-Process +/ I-Process +spectroscopy I-Process +. O +Later O +, O +ternary B-Material +chalcogenide I-Material +( B-Material +BixSb1 I-Material +− I-Material +x I-Material +) I-Material +2Te3 I-Material +[ O +4,5 O +] O +, O +which O +has O +similar O +tetradymite O +structure O +to O +the O +parent O +compounds O +Bi2Te3 B-Material +and O +Sb2Te3 B-Material +, O +was O +predicted O +by O +ab B-Process +initio I-Process +calculations I-Process +and O +confirmed O +by O +ARPES B-Process +measurements I-Process +as O +a O +tunable O +topological B-Process +insulator I-Process +whose O +Fermi O +energy O +and O +carrier O +density O +can O +be O +adjusted O +via O +changing B-Process +the I-Process +Bi I-Process +/ I-Process +Sb I-Process +composition I-Process +ratio I-Process +with O +stable O +topological O +surface O +state O +for O +the O +entire O +composition O +range O +. O +Combined O +with O +magnetism B-Process +or O +superconductivity B-Process +, O +TIs B-Process +have O +attracted O +great O +attention O +due O +to O +the O +rich O +variety O +of O +new O +physics O +and O +applications O +. O +The O +ferromagnetism B-Process +in O +several O +transition B-Material +metal I-Material +( O +TM B-Material +) O +doped O +TIs B-Process +, O +which O +breaks O +the O +time-reversal O +symmetry O +, O +has O +been O +reported O +[ O +6 O +– O +13 O +] O +. O +Ferromagnetism B-Process +in O +TIs B-Process +is O +important O +because O +the O +combination O +of O +magnetism B-Process +with O +TIs B-Process +makes O +a O +good O +platform O +to O +study O +fundamental B-Task +physical I-Task +phenomena I-Task +, O +such O +as O +the O +quantum O +anomalous O +Hall B-Task +effect I-Task +[ O +14 O +– O +17 O +] O +, O +Majorana B-Task +fermions I-Task +[ O +18 O +] O +, O +image B-Task +magnetic I-Task +monopole I-Task +effect I-Task +[ O +19 O +] O +, O +and O +topological O +contributions O +to O +the O +Faraday B-Task +and I-Task +Kerr I-Task +magneto-optical I-Task +effect I-Task +[ O +20 O +] O +. O + +Observations B-Process +show O +that O +in O +the O +same O +area O +with O +dimensions O +of O +a O +few O +tenths O +of O +a O +parsec O +could O +be O +many O +sources O +, O +some O +of O +which O +only O +emits O +OH B-Material +lines I-Material +, O +and O +some O +– O +only O +lines O +H2O B-Material +. O +The O +only O +known O +in O +physics O +the O +emission B-Process +mechanism I-Process +that O +can O +give O +tremendous O +power O +within O +a O +narrow O +range O +of O +the O +spectrum O +, O +is O +coherent O +( O +i.e. O +the O +same O +phase O +and O +direction O +) O +light B-Process +lasers I-Process +, O +which O +are O +called O +optical B-Process +lasers I-Process +, O +and O +radio-masers B-Process +. O +Cosmic B-Material +maser I-Material +radio I-Material +sources I-Material +emitting O +in O +the O +lines O +of O +the O +molecules O +have O +an O +extremely O +high O +brightness O +temperature O +radiation O +Tb O +. O +In O +the O +molecules O +of O +methanol B-Material +masers I-Material +( O +CH3OH B-Material +) O +Tb O +value O +can O +reach O +109 O +K O +, O +with O +masers B-Material +hydroxyl I-Material +molecules I-Material +( O +OH B-Material +) O +6 O +× O +1012 O +K O +. O +The O +typical O +size O +of O +the O +maser B-Material +clusters I-Material +is O +about O +1014 O +– O +1015 O +m O +and O +the O +neutron B-Material +star I-Material +radius O +is O +of O +the O +order O +of O +10 O +km O +. O +Thus O +, O +the O +radiation B-Process +dilution I-Process +coefficient I-Process +is O +equaled O +approximately O +( O +2.5 O +× O +10 O +− O +23 O +)–( O +2.5 O +× O +10 O +− O +21 O +) O +and O +, O +therefore O +, O +μB2B2 O +/ O +4 O +( O +hν O +) O +2 O +∼( O +2.4 O +× O +10 O +− O +5 O +)–( O +2.4 O +× O +10 O +− O +7 O +) O +for O +the O +hydrogen B-Material +line I-Material +21 O +cm O +and O +of O +the O +order O +10 O +− O +5 O +– O +10 O +− O +7 O +for O +the O +OH O +18 O +cm O +line O +or O +the O +same O +order O +as O +Eq O +. O +( O +1 O +) O +. O + +In O +exploring O +the O +WKB B-Task +limit I-Task +of I-Task +quantum I-Task +theory I-Task +, O +Bohm O +[ O +2 O +] O +was O +the O +first O +to O +notice O +that O +although O +one O +starts O +with O +all O +the O +ambiguities O +about O +the O +nature O +of O +a O +quantum O +system O +, O +the O +first O +order O +approximation O +fits O +the O +ordinary O +classical O +ontology O +. O +By O +that O +we O +mean O +that O +the O +real O +part O +of O +the O +Schrödinger B-Process +equation I-Process +under I-Process +polar I-Process +decomposition I-Process +of I-Process +the I-Process +wave I-Process +function I-Process +becomes O +the O +classical O +Hamilton B-Process +– I-Process +Jacobi I-Process +equation I-Process +in O +the O +limit O +where O +terms O +involving O +ℏ O +are O +neglected O +. O +In O +contrast O +to O +this O +approach O +, O +in O +this O +Letter O +we O +show O +that O +the O +classical O +trajectories O +arise O +from O +a O +short-time B-Process +quantum I-Process +propagator I-Process +when O +terms O +of O +O O +( O +Δt2 O +) O +can O +be O +neglected O +. O +This O +fact O +was O +actually O +already O +observed O +by O +Holland O +some O +twenty O +years O +ago O +: O +In O +page O +269 O +of O +his O +book O +[ O +6 O +] O +infinitesimal B-Material +time I-Material +intervals I-Material +are O +considered O +whose O +sequence O +constructs O +a O +finite O +path O +. O +It O +is O +shown O +that O +along O +each O +segment O +the O +motion O +is O +classical O +( O +negligible O +quantum O +potential O +) O +, O +and O +that O +it O +follows O +that O +the O +quantum O +path O +may O +be O +decomposed O +into O +a O +sequence O +of O +segments O +along O +each O +of O +which O +the O +classical O +action O +is O +a O +minimum O +. O +The O +novel O +contribution O +of O +the O +present O +Letter O +is O +an O +improved O +proof O +of O +Holland O +ʼs O +result O +using O +an O +improved O +version O +of O +the O +propagator B-Process +due O +to O +Makri O +and O +Miller O +[ O +9,10 O +] O +. O +( O +See O +also O +de O +Gosson O +[ O +3 O +] O +for O +a O +further O +discussion O +. O +) O + +The O +goal O +of O +the O +glued B-Process +trees I-Process +( O +GT B-Process +) O +algorithm O +for O +quantum B-Task +search I-Task +is O +the O +following O +: O +beginning O +from O +the O +left-most O +vertex O +of O +a O +given O +GT B-Material +graph I-Material +, O +traverse O +the O +graph O +and O +reach O +the O +right-most O +vertex O +, O +referred O +to O +as O +the O +target O +vertex O +. O +Childs O +et O +al O +. O +[ O +1 O +] O +use O +this O +algorithm O +to O +show O +quantum B-Task +walk I-Task +search I-Task +to O +be O +fundamentally O +more O +effective O +than O +classical B-Task +random I-Task +walk I-Task +search I-Task +by O +presenting O +a O +class B-Material +of I-Material +graphs I-Material +( O +the O +GT B-Material +graphs I-Material +) O +that O +force O +classical B-Task +random I-Task +walks I-Task +to O +make O +exponentially O +many O +queries O +to O +an O +oracle O +encoding O +the O +structure O +of O +the O +graph O +, O +but O +that O +are O +traversable O +by O +quantum O +walks O +with O +a O +polynomial O +number O +of O +queries O +to O +such O +an O +oracle O +. O +In O +order O +to O +study O +the O +robustness O +of O +the O +algorithm O +to O +the O +detrimental O +effects O +of O +decoherence O +, O +we O +shall O +determine O +how O +effectively O +it O +achieves O +its O +goal O +when O +subjected O +to O +an O +increasing B-Process +degree I-Process +of I-Process +phase I-Process +damping I-Process +noise I-Process +. O +For O +this O +reason O +, O +we O +will O +focus O +on O +the O +probability O +that O +the O +walker O +is O +on O +the O +target O +vertex O +at O +the O +end O +of O +the O +walk O +. O +We O +thus O +consider O +GT B-Material +graphs I-Material +such O +as O +the O +one O +illustrated O +in O +Fig. O +1 O +( O +b O +) O +, O +i.e. O +consisting O +of O +n O +layers O +before O +the O +gluing B-Process +stage I-Process +, O +and O +thus O +labelled O +as O +G′n O +. O + +Another O +remarkable O +feature O +of O +the O +quantum B-Task +field I-Task +treatment I-Task +can O +be O +revealed O +from O +the O +investigation O +of O +the O +vacuum B-Material +state I-Material +. O +For O +a O +classical O +field O +, O +vacuum O +is O +realized O +by O +simply O +setting O +the O +potential O +to O +zero O +resulting O +in O +an O +unaltered O +, O +free O +evolution O +of O +the O +particle B-Material +'s I-Material +plane I-Material +wave I-Material +(| O +ψI O +〉=| O +ψIII O +〉=| O +k0 O +〉) O +. O +In O +the O +quantized B-Task +treatment I-Task +, O +vacuum B-Material +is O +represented O +by O +an O +initial O +Fock O +state O +| O +n0 O += O +0 O +〉 O +which O +still O +interacts O +with O +the O +particle O +and O +yields O +as O +final O +state O +| O +ΨIII O +〉 O +behind O +the O +field O +region O +( O +19 O +)| O +ΨI O +〉=| O +k0 O +〉⊗| O +0 O +〉⇒| O +ΨIII O +〉=∑ O +n O += O +0 O +∞ O +t0n O +| O +k O +− O +n O +〉⊗| O +n O +〉 O +with O +a O +photon O +exchange O +probability O +( O +20 O +) O +P0,n O +=| O +t0n O +| O +2 O += O +1n O +! O +e O +− O +Λ2Λ2n O +The O +particle O +thus O +transfers O +energy O +to O +the O +vacuum O +field O +leading O +to O +a O +Poissonian O +distributed O +final O +photon O +number O +. O +Let O +'s O +consider O +, O +for O +example O +, O +a O +superconducting B-Material +resonant I-Material +circuit I-Material +as O +source O +of O +the O +field O +. O +The O +magnetic B-Material +field I-Material +along O +the O +axis O +of O +a O +properly B-Material +shaped I-Material +coil I-Material +is O +well O +approximated O +by O +the O +rectangular O +form O +. O +A O +particle B-Material +with O +a O +magnetic O +dipole O +moment O +passing O +through O +the O +coil O +then O +interacts O +with O +the O +circuit O +and O +excites O +it O +with O +a O +measurable O +loss O +of O +kinetic O +energy O +even O +if O +the O +circuit O +is O +initially O +uncharged O +and O +there O +is O +classically O +no O +field O +it O +can O +couple O +to O +. O +The O +phenomenon O +that O +vacuum B-Material +in O +quantum O +field O +theory O +does O +not O +mean O +to O +“ O +no O +influence O +” O +as O +known O +from O +Casimir B-Process +forces I-Process +or I-Process +Lamb I-Process +shift I-Process +is O +clearly O +visible O +here O +as O +well O +. O + +The O +systems O +in O +which O +the O +Stern B-Process +– I-Process +Gerlach I-Process +force I-Process +is O +most O +prominent O +are O +those O +with O +a O +high O +electromagnetic B-Process +field I-Process +gradient I-Process +. O +Section O +2 O +considers O +the O +implications O +of O +the O +coupling O +between O +the O +spin O +of O +a O +classical O +electron B-Material +and O +the O +rapidly O +varying O +electromagnetic B-Material +field I-Material +produced O +by O +a O +laser-driven B-Process +plasma I-Process +wave I-Process +. O +Sufficiently O +short O +, O +high-intensity B-Process +laser I-Process +pulses I-Process +can O +form O +longitudinal B-Material +waves I-Material +within O +the O +electron O +density O +of O +a O +plasma B-Material +. O +These O +density B-Material +waves I-Material +propagate O +with O +speed O +comparable O +to O +the O +group O +speed O +of O +the O +laser B-Process +pulse I-Process +. O +Not O +all O +plasma B-Material +electrons I-Material +form O +this O +wave O +, O +however O +; O +some O +of O +the O +electrons O +are O +caught O +up O +in O +the O +wave O +and O +accelerated O +by O +its O +high O +fields O +. O +The O +wave O +eventually O +collapses O +as O +these O +electrons B-Process +damp I-Process +the I-Process +wave I-Process +( O +the O +wave B-Process +‘ I-Process +breaks’ I-Process +) O +. O +The O +extremely O +high B-Material +electric I-Material +field I-Material +gradient I-Material +of I-Material +a I-Material +plasma I-Material +wave I-Material +near O +wavebreaking O +provides O +an O +excellent O +theoretical O +testing O +ground O +for O +the O +effects O +of O +Stern B-Task +– I-Task +Gerlach-type I-Task +contributions I-Task +to O +the O +trajectory O +of O +a O +test O +electron B-Material +. O + +Flow-induced O +deformations O +can O +lead O +to O +irreversible O +changes O +in O +the O +structure O +of O +a O +polymeric B-Material +fluid I-Material +; O +if O +the O +rate O +of O +extension O +far O +exceeds O +the O +rate O +of O +relaxation O +, O +then O +the O +polymer O +chain O +can O +be O +broken O +. O +Mechanical O +degradation O +of O +polymers B-Material +in O +extensional O +flow O +has O +long O +been O +recognised O +[ O +30 O +] O +and O +leads O +to O +a O +reduction B-Process +in I-Process +the I-Process +average I-Process +molecular I-Process +weight I-Process +. O +A-Alamry O +et O +al O +. O +[ O +1 O +] O +have O +recently O +reported O +evidence O +of O +flow-induced O +polymer O +degradation O +in O +DoD B-Process +jetting I-Process +. O +Central B-Task +scission I-Task +is O +observed O +for O +polystyrene B-Material +in O +a O +number O +of O +good O +solvents O +under O +certain O +jetting O +conditions O +for O +a O +bounded O +range O +of O +molecular O +weights O +. O +Since O +only O +those O +molecules O +that O +are O +fully O +extended O +can O +be O +fractured O +at O +the O +centre O +of O +the O +polymer O +chain O +[ O +29 O +] O +, O +in O +this O +paper O +we O +investigate O +whether O +flow-induced B-Task +central I-Task +scission I-Task +is O +possible O +under O +the O +conditions O +of O +DoD B-Process +jetting I-Process +. O + +This O +conclusion O +is O +a O +consequence O +of O +the O +high O +jet O +speeds O +and O +small O +nozzle O +diameters O +in O +combination O +with O +the O +relatively O +high O +viscosity O +solvent O +and O +modest O +molecular O +weights O +of O +the O +polystyrene B-Material +, O +which O +results O +in O +high O +Weissenberg O +numbers O +and O +moderate O +values O +of O +the O +extensibility O +, O +L O +studied O +here O +. O +As O +discussed O +in O +earlier O +papers O +[ O +3,6 O +] O +, O +other O +jetting B-Process +fluid I-Process +combinations I-Process +, O +such O +as O +those O +of O +de O +Gans O +et O +al O +. O +[ O +4 O +] O +, O +lie O +in O +a O +different O +jetting O +regime O +where O +full O +extension O +does O +not O +occur O +and O +relaxation O +time O +controls O +the O +viscoelastic O +behaviour O +. O +Consequently O +inkjet B-Process +fluid I-Process +assessment I-Process +methods I-Process +need O +to O +provide B-Task +a I-Task +full I-Task +characterisation I-Task +including I-Task +both I-Task +linear I-Task +and I-Task +nonlinear I-Task +viscoelastic I-Task +properties I-Task +. O +This O +complexity O +suggests O +assessments O +of O +inkjet B-Material +fluids I-Material +might O +have O +to O +include O +jetting O +from O +sets O +of O +DoD B-Process +print I-Process +head I-Process +devices I-Process +with O +different O +sensitivities O +to O +all O +the O +various O +VE O +parameters O +[ O +37 O +] O +, O +rather O +than O +reliance O +on O +testing O +without O +jetting B-Process +. O +This O +was O +not O +the O +expected O +outcome O +from O +the O +present O +work O +but O +does O +echo O +the O +very O +pragmatic O +viewpoint O +expressed O +as O +a O +“ B-Process +map I-Process +of I-Process +misery I-Process +” I-Process +by O +Clasen O +et O +al O +. O +[ O +38 O +] O +and O +may O +provide O +a O +way O +forward O +for O +future O +R O +& O +D O +strategies O +towards O +ink B-Task +testing I-Task +. O + +Denier O +and O +Hewitt O +[ O +12 O +] O +have O +shown O +that O +bounded O +solutions O +to O +9a O +, O +9b O +and O +9c O +subject O +to O +( O +10a O +) O +and O +( O +10b O +) O +exist O +only O +in O +the O +shear-thinning O +case O +for O +n O +> O +12 O +. O +In O +the O +shear-thickening B-Process +case O +they O +have O +shown O +that O +solutions B-Material +become O +non-differentiable O +at O +some O +critical O +location O +ηc O +, O +and O +although O +it O +transpires O +that O +this O +singularity B-Process +can O +be O +regularised O +entirely O +within O +the O +context O +of O +the O +power-law B-Process +model I-Process +, O +we O +will O +not O +consider O +such O +flows B-Material +here O +. O +Thus O +in O +this O +study O +we O +will O +consider O +flows O +with O +power-law O +index O +in O +the O +range O +12 O +< O +n O +⩽ O +1 O +. O +They O +have O +also O +shown O +that O +for O +12 O +< O +n O +< O +1 O +to O +ensure O +the O +correct B-Process +algebraic I-Process +decay I-Process +in O +the O +numerical O +solutions O +one O +must O +apply O +the O +Robin O +condition O +( O +11 O +)( O +u O +¯ O +′ O +, O +v O +¯ O +′ O +)= O +nη O +( O +n-1 O +)( O +u O +¯ O +, O +v O +¯) O +asη O +→∞ O +, O +at O +some O +suitably O +large O +value O +of O +η O += O +η O +∞≫ O +1 O +. O +In O +the O +Newtonian O +case O +this O +relationship O +becomes O +singular O +, O +this O +is O +due O +to O +the O +fact O +that O +when O +n O += O +1 O +the O +functions O +u O +¯ O +and O +v O +¯ O +decay O +exponentially O +. O +Cochran O +[ O +13 O +] O +showed O +that O +in O +this O +case O +( O +12 O +)( O +u O +¯ O +′ O +, O +v O +¯ O +′ O +)= O +w O +¯∞( O +u O +¯ O +, O +v O +¯) O +asη O +→∞ O +, O +where O +w O +∞=- O +2 O +∫ O +0 O +∞ O +u O +¯ O +dη O +. O + +In O +order O +for O +DLS B-Task +based I-Task +micro-rheology I-Task +to O +be O +successful O +, O +there O +must O +be O +sufficient O +scattering O +contrast O +between O +the O +sample B-Material +and I-Material +the I-Material +tracer I-Material +particles I-Material +. O +In O +order O +to O +achieve O +this O +, O +the O +maximum O +possible O +concentration O +of O +tracer O +particles O +was O +added O +such O +that O +single O +scattering O +events O +still O +dominated O +( O +as O +determined O +by O +measurements O +of O +diffusion O +coefficients O +in O +water B-Material +at O +different O +concentrations O +) O +. O +In O +order O +to O +determine O +whether O +or O +not O +the O +background O +scattering O +from O +the O +sample O +was O +sufficiently O +low O +compared O +to O +that O +of O +the O +tracer B-Material +particles I-Material +, O +we O +also O +compared O +the O +scattering B-Material +intensities I-Material +obtained O +from O +samples O +with O +and O +without O +tracer B-Material +particles I-Material +as O +a O +function O +of O +time O +. O +The O +results O +of O +this O +exercise O +are O +shown O +in O +Fig. O +6. O +From O +this O +figure O +it O +can O +be O +seen O +that O +although O +initially O +the O +scattering B-Process +from O +the O +sample O +without O +tracer B-Material +particles I-Material +is O +low O +compared O +to O +those O +containing O +tracer O +particles O +, O +as O +gelation B-Material +proceeds O +this O +eventually O +ceases O +to O +be O +the O +case O +. O +This O +is O +presumably O +because O +of O +the O +development O +of O +supra-molecular B-Material +structures I-Material +, O +such O +as O +those O +seen O +previously O +( O +Fig. O +2B O +) O +. O +Based O +on O +the O +results O +in O +Fig. O +6 O +it O +was O +decided O +to O +only O +use O +data O +collected O +in O +the O +first O +240min O +of O +the O +experiment O +, O +after O +which O +point O +the O +scattering B-Material +from I-Material +the I-Material +gel I-Material +network I-Material +became O +rather O +too O +large O +to O +ignore O +. O + +Tack B-Material +is O +an O +important O +property O +of O +a O +PSA B-Material +as O +it O +quantifies O +its O +ability O +to O +form O +instantly O +a O +bond O +when O +brought O +into O +contact O +with O +a O +surface O +. O +The O +final O +adhesion O +and O +cohesive O +strength O +of O +the O +bond O +are O +influenced O +by O +numerous O +factors O +including O +the O +surface O +energies O +of O +the O +adhesive B-Material +and O +substrate B-Material +, O +dwell O +time O +, O +contact O +pressure O +, O +mechanical O +properties O +of O +the O +adhesive B-Material +, O +as O +well O +as O +environmental O +conditions O +such O +as O +temperature O +and O +humidity O +[ O +8 O +] O +. O +Therefore O +, O +tack O +is O +important O +in O +many O +applications O +where O +an O +instant O +bond O +is O +required O +, O +however O +it O +is O +equally O +important O +when O +a O +‘ B-Task +clean’ I-Task +separation I-Task +of O +the O +initially O +bonded B-Material +surfaces I-Material +is O +desirable O +. O +Many O +different O +methods O +for O +measuring O +the O +tack B-Material +have O +been O +devised O +with O +the O +four O +main O +ones O +being O +the O +rolling B-Process +ball I-Process +, O +loop B-Process +tack I-Process +, O +quick B-Process +stick I-Process +and O +probe B-Process +tack I-Process +tests B-Process +[ O +9 O +] O +. O +Each O +has O +its O +own O +advantages O +and O +disadvantages O +and O +the O +specific O +testing O +method O +should O +be O +selected O +based O +on O +the O +particular O +application O +. O + +The O +first O +of O +these O +systems O +, O +a O +biopolymer B-Process +gel I-Process +, O +involves O +the O +thermoreversible B-Task +gelation I-Task +of O +aqueous O +gelatin O +solutions O +to O +form O +a O +physical O +gel O +, O +whereas O +the O +other O +systems O +considered O +herein O +involve O +the O +formation O +of O +chemical O +gels O +featuring O +permanent O +cross-linked B-Process +branching I-Process +networks I-Process +. O +The O +second O +system O +is O +a O +commercial B-Process +silicone I-Process +dielectric I-Process +gel I-Process +( O +SDG B-Process +) O +which O +is O +used O +in O +the O +production B-Task +of I-Task +electronic I-Task +products I-Task +created O +by O +industrial O +printing O +processes O +. O +The O +third O +experimental O +system O +is O +a O +fibrin B-Process +gel I-Process +formed O +by O +the O +thrombin-induced B-Process +polymerisation I-Process +of O +fibrinogen B-Process +molecules I-Process +. O +The O +gel B-Process +network I-Process +product I-Process +in O +the O +latter O +case O +forms O +the O +principal O +microstructural B-Material +component I-Material +of O +a O +blood B-Material +clot I-Material +[ O +8 O +] O +. O +The O +latter O +case O +is O +particularly O +interesting O +as O +the O +critical-gel B-Material +which O +is O +established O +at O +the O +GP B-Material +serves O +as O +a O +‘ B-Material +template’ I-Material +for I-Material +the I-Material +ensuing I-Material +development I-Material +of I-Material +microstructure I-Material +and I-Material +associated I-Material +rheological I-Material +properties I-Material +in O +the O +post-GP O +phase O +of O +fibrin O +clot O +evolution O +[ O +9 O +] O +. O + +A O +convenient O +and O +widely O +reported O +technique O +for O +detection B-Task +of I-Task +the I-Task +GP I-Task +involves O +measurements B-Process +of I-Process +the I-Process +complex I-Process +shear I-Process +modulus I-Process +, O +G O +∗ O +, O +over O +a O +range O +of O +frequencies O +, O +ω O +, O +in O +oscillatory O +shear O +. O +At O +the O +GP O +the O +elastic O +and O +viscous O +components O +of O +the O +complex O +modulus O +, O +G′ O +and O +G O +″ O +, O +respectively O +scale O +in O +oscillatory O +frequency O +, O +ω O +, O +as O +G′ O +( O +ω O +)∼ O +G O +″( O +ω O +)∼ O +ωα O +where O +α O +is O +termed O +the O +stress O +relaxation O +exponent O +[ O +15 O +] O +. O +Thus O +, O +the O +GP O +may O +be O +identified O +as O +the O +instant O +where O +the O +G′ O +and O +G O +″ O +scale O +in O +frequency O +according O +to O +identical O +power O +laws O +[ O +15 O +] O +, O +behaviour O +corresponding O +to O +attainment O +of O +a O +frequency O +independent O +phase O +angle O +, O +δ O +(= O +atan O +( O +G O +″/ O +G′ O +)) O +. O +GP B-Process +measurements I-Process +may O +involve O +‘ O +frequency O +sweeps’ O +with O +repeated O +consecutive O +application O +of O +a O +set O +of O +small O +amplitude O +oscillatory O +shear O +, O +SAOS O +, O +waveforms O +[ O +15,16 O +] O +, O +or O +by O +Fourier O +Transform O +Mechanical O +Spectroscopy O +, O +FTMS O +, O +in O +which O +G O +∗( O +ω O +) O +is O +found O +by O +simultaneous O +application O +of O +several O +harmonic O +frequencies O +in O +a O +composite O +waveform O +and O +its O +subsequent O +Fourier O +analysis O +[ O +17,18 O +] O +. O +Frequency O +sweeps O +are O +limited O +to O +relatively O +slow O +gelation O +processes O +due O +to O +sample O +mutation O +and O +interpolation O +errors O +[ O +9,19,20 O +] O +. O +FTMS O +may O +overcome O +these O +limitations O +, O +but O +is O +unsuitable O +for O +markedly O +strain O +sensitive O +materials O +, O +such O +as O +fibrin O +gels O +, O +due O +to O +the O +strain O +amplitude O +of O +the O +composite O +waveform O +exceeding O +the O +linear O +viscoelastic O +range O +( O +LVR O +) O +[ O +9 O +] O +. O + +Equilibrium B-Material +surface I-Material +tension I-Material +was O +measured O +at O +21 O +° O +C O +with O +a O +SITA B-Process +pro I-Process +line I-Process +t-15 I-Process +bubble I-Process +tensiometer I-Process +. O +Rheological B-Process +measurements I-Process +were O +performed O +with O +an O +ARES B-Process +rheometer I-Process +at O +shear O +rates O +up O +to O +15s O +− O +1 O +and O +with O +a O +piezo B-Process +axial I-Process +vibrator I-Process +[ O +21 O +] O +( O +PAV B-Process +) O +at O +frequencies O +up O +to O +6kHz O +. O +Table O +1 O +shows O +the O +measured O +values B-Material +of I-Material +viscosity I-Material +( O +the O +real O +component O +η′ O +of O +complex O +viscosity O +) O +at O +1s O +− O +1 O +and O +4000s O +− O +1 O +and O +of O +surface B-Material +tension I-Material +for O +the O +solutions O +with O +and O +without O +the O +surfactant O +mixture O +. O +For O +the O +most B-Material +concentrated I-Material +( I-Material +1.1wt I-Material +%) I-Material +solution I-Material +, O +viscosity O +fell O +from O +> O +60mPas O +at O +low O +shear O +rate O +to O +about O +4mPas O +at O +the O +highest O +shear O +rates O +. O +The O +PEDOT B-Material +: I-Material +PSS I-Material +fluids I-Material +also O +exhibited O +elasticity O +that O +steadily O +reduced O +with O +increasing O +frequency O +[ O +4 O +] O +. O +All O +the O +aqueous O +PEDOT B-Material +: I-Material +PSS I-Material +solutions I-Material +shear-thinned O +significantly O +, O +but O +the O +presence O +of O +surfactants O +did O +not O +affect O +the O +trends O +in O +the O +rheological O +behaviour O +, O +particularly O +at O +the O +higher O +frequencies O +( O +10 O +– O +4000s O +− O +1 O +) O +. O + +In O +this O +paper O +, O +we O +propose O +a O +general O +agent-based O +distributed O +framework B-Task +where O +each B-Process +agent I-Process +is I-Process +implementing I-Process +a I-Process +different I-Process +metaheuristic I-Process +/ I-Process +local I-Process +search I-Process +combination I-Process +. O +Moreover O +, O +an O +agent O +continuously O +adapts B-Process +itself O +during O +the O +search O +process O +using O +a B-Material +direct I-Material +cooperation I-Material +protocol I-Material +based O +on O +reinforcement B-Task +learning I-Task +and O +pattern B-Task +matching I-Task +. O +Good B-Task +patterns I-Task +that O +make O +up O +improving O +solutions O +are O +identified O +and O +shared O +by O +the O +agents B-Material +. O +This O +agent-based B-Task +system I-Task +aims O +to O +provide B-Process +a I-Process +modular I-Process +flexible I-Process +framework I-Process +to O +deal B-Process +with I-Process +a I-Process +variety I-Process +of I-Process +different I-Process +problem I-Process +domains I-Process +. O +We O +have O +evaluated O +the O +performance O +of O +this B-Task +approach I-Task +using O +the O +proposed O +framework O +which O +embodies B-Process +a I-Process +set I-Process +of I-Process +well I-Process +known I-Process +metaheuristics I-Process +with I-Process +different I-Process +configurations I-Process +as O +agents O +on O +two B-Material +problem I-Material +domains I-Material +, O +Permutation B-Material +Flow-shop I-Material +Scheduling I-Material +and I-Material +Capacitated I-Material +Vehicle I-Material +Routing I-Material +. O +The O +results O +show O +the O +success O +of O +the O +approach B-Task +yielding O +three O +new O +best O +known O +results O +of O +the O +Capacitated B-Material +Vehicle I-Material +Routing I-Material +benchmarks I-Material +tested O +, O +whilst O +the O +results O +for O +Permutation B-Material +Flow-shop I-Material +Scheduling I-Material +are O +commensurate O +with O +the O +best O +known O +values O +for O +all O +the O +benchmarks O +tested O +. O + +As O +mentioned O +earlier O +, O +this O +paper O +represents O +ongoing O +efforts O +to O +efficiently O +address O +the O +stochastic B-Task +MPSP I-Task +. O +Future O +work O +may O +consider O +investigating O +whether O +the O +algorithm O +would O +be O +as O +successful O +or O +not O +in O +solving O +variants O +of O +the O +MPSP O +that O +include O +more O +operational B-Task +constraints I-Task +, O +such O +as O +variable B-Task +cut-off I-Task +grade I-Task +, O +grade B-Task +blending I-Task +, O +and O +stockpiling B-Task +, O +as O +it O +is O +in O +solving O +the O +“ O +classical O +” O +variant O +considered O +in O +this O +paper O +. O +Indeed O +, O +it O +is O +a O +general-purpose B-Process +algorithm I-Process +and O +should O +be O +applicable O +to O +any O +of O +these O +variants O +. O +Other O +research O +avenues O +include O +considering O +other O +strategies O +for O +updating O +the O +penalties O +within O +PH B-Process +and O +other O +methods O +for O +solving O +the O +sub-problems O +. O +Finally O +, O +another O +important O +research O +direction O +is O +the O +development O +of O +other O +efficient O +solution O +approaches O +. O +Since O +it O +has O +been O +observed O +empirically O +that O +the O +problem O +formulation O +often O +achieves O +small O +integrality O +gaps O +, O +one O +approach O +could O +be O +to O +solve B-Process +the I-Process +linear I-Process +relaxation I-Process +of O +the O +problem O +using O +an O +efficient O +algorithm O +and O +then O +to O +use O +an O +LP-rounding B-Process +procedure I-Process +to O +get O +an O +integer O +solution O +. O + +We O +propose O +an O +equilibrium B-Process +model I-Process +that O +allows O +to O +analyze B-Task +the I-Task +long-run I-Task +impact I-Task +of I-Task +the I-Task +electricity I-Task +market I-Task +design I-Task +on I-Task +transmission I-Task +line I-Task +expansion I-Task +by O +the O +regulator O +and O +investment O +in O +generation O +capacity O +by O +private O +firms O +in O +liberalized O +electricity O +markets O +. O +The O +model O +incorporates O +investment O +decisions O +of O +the O +transmission O +system O +operator O +and O +private O +firms O +in O +expectation O +of O +an O +energy-only O +market O +and O +cost-based O +redispatch O +. O +In O +different O +specifications O +we O +consider O +the O +cases O +of O +one O +vs. O +multiple O +price O +zones O +( O +market B-Process +splitting I-Process +) O +and O +analyze B-Process +different I-Process +approaches I-Process +to I-Process +recover I-Process +network I-Process +cost I-Process +— O +in O +particular O +lump B-Task +sum I-Task +, O +generation B-Task +capacity I-Task +based I-Task +, O +and O +energy B-Task +based I-Task +fees I-Task +. O +In O +order O +to O +compare O +the O +outcomes O +of O +our O +multilevel B-Process +market I-Process +model I-Process +with O +a O +first B-Process +best I-Process +benchmark I-Process +, O +we O +also O +solve B-Process +the I-Process +corresponding I-Process +integrated I-Process +planner I-Process +problem I-Process +. O +Using O +two O +test O +networks O +we O +illustrate O +that O +energy-only O +markets O +can O +lead O +to O +suboptimal O +locational O +decisions O +for O +generation O +capacity O +and O +thus O +imply O +excessive B-Process +network I-Process +expansion I-Process +. O +Market B-Process +splitting I-Process +heals O +these O +problems O +only O +partially O +. O +These O +results O +are O +valid O +for O +all O +considered O +types O +of O +network O +tariffs O +, O +although O +investment O +slightly O +differs O +across O +those O +regimes O +. O + +Regarding O +the O +implications B-Task +of I-Task +the I-Task +results I-Task +of O +this O +paper O +, O +we O +note O +two O +points O +. O +From O +a O +practical O +point O +of O +view O +, O +we O +have O +endowed O +the B-Task +weighted I-Task +additive I-Task +model I-Task +with I-Task +a I-Task +distance I-Task +function I-Task +structure I-Task +, O +which O +takes B-Process +negative I-Process +values I-Process +for I-Process +points I-Process +located I-Process +outside I-Process +the I-Process +technology I-Process +and I-Process +non-negative I-Process +values I-Process +for I-Process +points I-Process +into I-Process +the I-Process +production I-Process +possibility I-Process +set I-Process +. O +In O +this O +respect O +, O +the B-Task +weighted I-Task +additive I-Task +distance I-Task +function I-Task +methodologically O +supports O +the O +branch O +of O +the O +literature O +that O +resorts O +to O +the O +weighted B-Material +additive I-Material +model I-Material +or O +some B-Material +related I-Material +approach I-Material +to O +measure B-Process +productivity I-Process +over I-Process +time I-Process +( O +see O +, O +for O +example O +, O +Mahlberg O +& O +Sahoo O +, O +2011 O +or O +Chang O +et O +al. O +, O +2012 O +) O +. O +From O +a O +theoretical O +point O +of O +view O +, O +we O +have O +provided O +a B-Material +new I-Material +distance I-Material +function I-Material +with O +some O +interesting O +properties O +in O +contrast O +to O +the O +usual O +ones O +, O +mainly O +( O +1 O +) O +when O +technical O +inefficiency O +has O +to O +be O +estimated O +, O +the B-Material +weighted I-Material +additive I-Material +distance I-Material +function I-Material +coincides O +with O +the O +weighted O +additive O +model O +, O +which O +means B-Process +that I-Process +technical I-Process +inefficiency I-Process +is I-Process +measured I-Process +following I-Process +the I-Process +Pareto-Koopmans I-Process +notion I-Process +of I-Process +efficiency I-Process +; O +and O +( O +2 O +) O +when O +productivity O +has O +to O +be O +determined B-Process +and I-Process +decomposed I-Process +over I-Process +time I-Process +the O +weighted B-Material +additive I-Material +distance I-Material +function I-Material +emerges O +as O +an O +attractive O +tool O +to O +be O +used O +for O +cross-period O +evaluation O +of O +returns O +to O +scale O +changes O +, O +since O +this O +distance O +function O +is O +always O +feasible O +, O +even O +under O +Variable O +Returns O +to O +Scale O +. 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O +In O +the O +single O +class O +setting O +, O +a O +known O +limitation O +of O +MMPPs B-Material +is O +the O +inability O +to O +simultaneously O +fit O +many O +statistical B-Process +descriptors I-Process +due O +to O +the O +non-linearity O +of O +their O +underlying B-Process +equations I-Process +( O +Bodrog O +, O +Heindl O +, O +Horváth O +, O +& O +Telek O +, O +2008 O +; O +Heindl O +, O +Horváth O +, O +& O +Gross O +, O +2006 O +; O +Horváth O +& O +Telek O +, O +2009 O +) O +. O +This O +has O +led O +to O +the O +definition O +of O +several O +approaches O +to O +fit O +complex O +traces O +by O +composing B-Process +multiple I-Process +small-sized I-Process +MMPPs I-Process +or I-Process +MAPs I-Process +using O +Kronecker B-Process +operators I-Process +( O +Andersen O +& O +Nielsen O +, O +1998 O +; O +Casale O +, O +Zhang O +, O +& O +Smirni O +, O +2010 O +; O +Horváth O +& O +Telek O +, O +2002 O +) O +. 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O +The O +reader O +is O +referred O +to O +the O +excellent O +textbooks O +that O +describe O +the O +common B-Process +algorithms I-Process +employed I-Process +[ O +80 O +– O +82 O +] O +. O +The O +quality O +of O +the O +result O +is O +obviously O +limited O +by O +the O +accuracy O +of O +the O +EoS B-Process +to O +faithfully O +represent O +fluid B-Material +mixtures I-Material +. O +Furthermore O +, O +the O +fact O +that O +some O +of O +the O +more O +interesting O +features O +of O +the O +phase O +diagram O +are O +close O +to O +the O +critical O +points O +of O +the O +mixture O +, O +make O +these O +calculations O +particularly O +challenging O +for O +all O +but O +the O +most O +optimized O +and O +force-fitted O +of O +models O +. O + +The O +next O +phase O +of O +our O +current O +study O +is O +to O +use O +the O +parameters O +obtained O +from O +pure-component B-Process +systems I-Process +in O +a O +transferable O +manner O +to O +represent O +the O +corresponding O +mixtures O +. O +Mixtures B-Material +of I-Material +n-alkanes I-Material +and I-Material +H2O I-Material +have O +been O +studied O +previously O +with O +SAFT-γ B-Process +SW I-Process +[ O +82 O +] O +. O +In O +general O +it O +is O +well O +known O +that O +the O +extreme O +nature O +of O +the O +phase O +separation O +[ O +150 O +] O +makes O +it O +challenging O +to O +model O +mixtures B-Material +of I-Material +H2O I-Material +with O +non-polar B-Process +compounds I-Process +. O +Because O +of O +the O +large O +differences O +in O +the O +dielectric O +constant O +of O +the O +two O +phases O +as O +well O +as O +in O +the O +dipole O +moment O +of O +H2O B-Material +and O +the O +hydrophobic B-Material +molecules I-Material +, O +it O +especially O +difficult O +to O +obtain O +phase-independent O +unlike O +interaction O +parameters O +[ O +112 O +] O +and O +thus O +to O +model O +simultaneously O +the O +equilibrium O +phases O +. O +In O +previous O +work O +[ O +82 O +] O +, O +emphasis O +was O +placed O +on O +obtaining O +an O +accurate O +description B-Task +of I-Task +the I-Task +alkane-rich I-Task +phases I-Task +( O +both O +liquid B-Material +and O +vapour B-Material +) O +, O +while O +small O +absolute O +( O +but O +not O +relative O +) O +deviations O +for O +the O +aqueous O +phase O +composition O +were O +achieved O +. 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O + +Recently O +, O +fundamental O +( O +thermophysical O +property O +) O +research O +on O +ionic B-Material +clathrate I-Material +hydrates I-Material +has O +experienced O +remarkable O +growth O +, O +particularly O +over O +the O +last O +ten O +years O +[ O +21 O +– O +30 O +] O +. O +Previously O +, O +beginning O +with O +the O +first O +paper O +on O +unusual B-Material +hydrates I-Material +of I-Material +tetrabutylammonium I-Material +salts I-Material +in O +1940 O +[ O +31 O +] O +, O +a O +number O +of O +studies O +could O +be O +found O +on O +ionic B-Material +clathrate I-Material +hydrates I-Material +( O +hereafter O +, O +semiclathrate B-Material +hydrates I-Material +) O +[ O +32 O +– O +35 O +] O +before O +the O +unified O +terminology O +semiclathrate B-Material +hydrate I-Material +was O +generally O +accepted O +. O +Semiclathrate B-Material +hydrates I-Material +have O +been O +attracting O +increased O +attention O +because O +of O +their O +promising O +applications O +as O +phase B-Process +change I-Process +materials I-Process +for I-Process +refrigeration I-Process +systems I-Process +and O +in O +gas B-Process +capture I-Process +and I-Process +storage I-Process +[ O +36 O +– O +41 O +] O +. O +In O +addition O +, O +there O +is O +interesting O +speculation O +that O +semiclathrate B-Material +hydrate I-Material +may O +be O +regarded O +as O +a O +representative O +substance O +for O +the O +study B-Task +of I-Task +thermal I-Task +conductivity I-Task +in O +clathrate O +hydrate O +in O +general O +. 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O + +With O +development O +of O +performance-based B-Task +design I-Task +, O +some O +studies O +have O +been O +conducted O +on O +fire O +risk O +analysis O +in O +buildings O +from O +different O +perspectives O +and O +levels O +. O +Models B-Process +such O +as O +FiRECAM B-Process +[ O +11,12 O +] O +and O +FiERAsystem B-Process +[ O +13 O +] O +were O +used O +to O +calculate O +the O +expected O +life O +risk O +. O +In O +other O +studies O +probabilistic B-Process +methods I-Process +have O +been O +used O +to O +assess O +levels O +of O +people O +safety O +in O +buildings O +[ O +14 O +] O +. O +Quantitative B-Process +risk I-Process +analysis I-Process +approaches I-Process +have O +also O +been O +used O +to O +quantify O +the O +risk O +to O +occupants O +using O +stochastic B-Process +factors I-Process +[ O +15 O +] O +. O +However O +, O +studies O +to O +date O +have O +largely O +been O +concerned O +with O +various O +aspects B-Material +of I-Material +fire I-Material +risk I-Material +analysis I-Material +and O +there O +has O +been O +little O +in O +the O +way O +of O +development O +of O +systematic B-Process +theoretical I-Process +methods I-Process +for O +analyzing O +fire O +risk O +in O +buildings O +in O +terms O +of O +fire O +risk O +management O +. O +Existing O +fire O +risk O +management O +involves O +the O +identification B-Process +of I-Process +alternative I-Process +fire I-Process +safety I-Process +design I-Process +options I-Process +[ O +16,17 O +] O +, O +the O +ongoing B-Process +inspection I-Process +, O +maintenance B-Process +of I-Process +fire I-Process +protection I-Process +systems I-Process +[ O +18 O +] O +and O +evacuation B-Process +training I-Process +and I-Process +drills I-Process +[ O +19 O +] O +. 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O +The O +Newman O +– O +Penrose O +constants O +are O +a O +set O +of O +absolutely O +conserved O +quantities O +defined O +as O +integrals O +of O +certain O +components O +of O +the O +Weyl B-Material +tensor I-Material +and O +the O +Maxwell B-Material +fields I-Material +over O +cuts O +of O +null O +infinity O +— O +see O +[ O +19 O +– O +21 O +] O +for O +the O +Einstein O +– O +Maxwell O +case O +. O +In O +[ O +22 O +] O +it O +has O +been O +shown O +that O +the O +value O +of O +the O +Newman B-Material +– I-Material +Penrose I-Material +constants I-Material +for O +a O +vacuum B-Material +radiative I-Material +spacetime I-Material +coincides O +with O +the O +value O +of O +the O +rescaled O +Weyl O +spinor O +at O +i O ++— O +this O +result O +can O +be O +extended O +to O +the O +electrovacuum O +case O +using O +the O +methods O +of O +this O +article O +. O +For O +the O +radiative B-Task +spacetimes I-Task +arising O +from O +the O +construction O +of O +[ O +17 O +] O +it O +can O +be O +seen O +that O +the O +value O +of O +the O +Weyl O +spinor O +at O +i O ++ O +is O +essentially O +the O +mass O +quadrupole O +of O +the O +seed O +static O +spacetime O +. O +It O +follows O +, O +that O +the O +Newman B-Material +– I-Material +Penrose I-Material +constants I-Material +of O +the O +radiative B-Material +spacetime I-Material +can O +take O +arbitrary O +values O +. O +On O +the O +other O +hand O +, O +for O +the O +Minkowski B-Task +spacetime I-Task +, O +the O +Newman B-Material +– I-Material +Penrose I-Material +constants I-Material +are O +exactly O +zero O +, O +and O +those O +of O +perturbations O +thereof O +will O +be O +small O +. 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O +( O +2013 O +) O +, O +other O +methods O +including O +MC B-Process +( O +without O +smoothing O +and O +decimation O +) O +are O +evaluated O +with O +application O +to O +vessel B-Task +modeling I-Task +. O +The O +authors O +, O +point O +at O +SA B-Material +as O +a O +suitable O +method O +for O +reconstruction B-Task +of I-Task +vessels I-Task +with O +applications O +to O +surgery B-Task +planning I-Task +. O +The O +methods O +evaluated O +by O +Wu O +et O +al O +. O +( O +2013 O +) O +could O +be O +also O +compared O +with O +another O +set O +of O +techniques O +( O +known O +as O +model-based B-Material +methods I-Material +) O +( O +Preim O +and O +Oeltze O +, O +2008 O +) O +, O +widely O +used O +in O +the O +context O +of O +vessel B-Task +modeling I-Task +for I-Task +surgery I-Task +planning I-Task +. O + +The O +need O +for O +power B-Task +generation I-Task +industry O +to O +improve B-Task +the I-Task +thermal I-Task +efficiency I-Task +of I-Task +power I-Task +plant I-Task +has O +led O +to O +the O +development O +of O +9 B-Material +– I-Material +12 I-Material +% I-Material +Cr I-Material +martensitic I-Material +steels I-Material +. O +The O +development B-Task +of I-Task +and I-Task +research I-Task +on I-Task +P91 I-Task +steels I-Task +started O +since O +late O +1970s O +and O +early O +1990s O +, O +respectively O +[ O +1 O +] O +. O +The O +work O +has O +focussed O +on O +their O +creep O +strengths O +due O +to O +its O +intended O +application O +at O +high O +temperature O +. O +Recently O +, O +the O +introduction O +of O +more O +cyclic O +operation O +of O +power B-Material +plant I-Material +has O +introduced O +the O +possibility O +of O +fatigue B-Process +problems I-Process +. O +Bore O +cracking O +due O +to O +the O +effects O +of O +varying O +steam B-Process +warming I-Process +has O +been O +reported O +[ O +2 O +] O +. O +The O +temperature B-Process +cycling I-Process +causes O +thermal O +gradients O +between O +the O +inside O +and O +outside O +of O +components O +and O +this O +can O +cause O +cyclic O +stress O +levels O +to O +be O +of O +concerns O +. O +Recently O +, O +research O +on O +thermal B-Task +– I-Task +mechanical I-Task +analysis I-Task +of I-Task +P91 I-Task +has O +been O +carried O +out O +including O +the O +characterisation B-Task +of I-Task +the I-Task +cyclic I-Task +behaviour I-Task +of I-Task +the I-Task +material I-Task +using O +the O +two-layer B-Process +and I-Process +unified I-Process +visco-plasticity I-Process +models I-Process +[ O +3,4 O +] O +. O + +In O +previous O +publications O +the O +present O +authors O +proposed O +a O +method O +to O +incorporate B-Task +the I-Task +thermodynamics I-Task +of I-Task +ternary I-Task +alloys I-Task +and I-Task +liquid I-Task +diffusion-governed I-Task +solidification I-Task +kinetics I-Task +into I-Task +a I-Task +multiphase I-Task +volume I-Task +average I-Task +solidification I-Task +model I-Task +[ O +23,24 O +] O +. O +Back B-Process +diffusion I-Process +was O +disregarded O +. O +A O +way O +to O +access O +the O +thermodynamic B-Material +data I-Material +( O +e.g. O +Thermo-Calc O +[ O +1 O +]) O +through O +a O +tabulation B-Material +and I-Material +interpolation I-Material +program I-Material +ISAT B-Material +( O +In B-Material +Situ I-Material +Adaptive I-Material +Tabulation I-Material +) O +was O +suggested O +. O +With O +the O +ISAT B-Process +approach I-Process +it O +is O +possible O +to O +perform O +an O +online O +call O +of O +the O +thermodynamic B-Material +data I-Material +and O +trace O +the O +formation O +of O +each O +individual O +solid O +phase O +( O +primary O +, O +peritectic O +, O +eutectic O +, O +etc. O +) O +. O +As O +the O +number O +of O +calls O +of O +the O +thermodynamic O +data O +is O +equal O +to O +the O +product O +of O +the O +number O +of O +the O +discretized B-Material +volume I-Material +elements I-Material +, O +the O +time O +steps O +and O +the O +calculation O +iterations O +per O +time O +step O +, O +the O +calculation O +becomes O +exhausting O +. O +Therefore O +, O +the O +current B-Process +model I-Process +is O +a O +modification B-Process +of I-Process +the I-Process +previous I-Process +model I-Process +using I-Process +a I-Process +linearized I-Process +phase I-Process +diagram I-Process +, O +and O +no O +online B-Process +call I-Process +of I-Process +thermodynamic I-Process +data I-Process +is O +necessary O +. O +In O +addition O +, O +the O +model O +presented O +in O +this O +paper O +is O +extended B-Task +to I-Task +consider I-Task +the I-Task +back I-Task +diffusion I-Task +into I-Task +the I-Task +solid I-Task +. O +With O +these O +modifications B-Process +, O +the O +model O +can O +be O +used O +to O +perform B-Task +casting I-Task +process I-Task +simulations I-Task +with I-Task +incorporated I-Task +full I-Task +diffusion-governed I-Task +solidification I-Task +kinetics I-Task +for O +ternary B-Material +alloys I-Material +at O +a O +reasonable O +computation O +cost O +. O + +Due O +to O +the O +complex O +nature O +of O +the O +thermal B-Process +spray I-Process +process I-Process +, O +modelling B-Task +has O +been O +playing O +a O +key O +role O +in O +providing B-Task +some I-Task +key I-Task +insights I-Task +for I-Task +process I-Task +design I-Task +and I-Task +operations I-Task +. O +The O +relationships O +among O +processing B-Process +conditions O +, O +particle O +characteristics O +, O +and O +the O +resulting O +coating B-Process +properties O +are O +nonlinear O +and O +might O +be O +difficult O +to O +be O +unravelled O +by O +the O +experimental B-Task +studies I-Task +alone O +( O +e.g. O +[ O +5 O +– O +7 O +]) O +Detailed O +information O +on O +the O +atomic B-Process +level I-Process +changes I-Process +leading O +to O +changes O +observed O +at O +macroscale O +can O +appropriately O +be O +obtained O +by O +MD B-Process +simulation I-Process +and O +the O +effect O +of O +temperature O +and O +velocity O +can O +be O +determined O +more O +precisely O +. O +In O +this O +work O +, O +relatively O +simpler O +spray B-Process +system I-Process +of O +copper B-Material +– I-Material +copper I-Material +particle I-Material +was O +simulated O +to O +obtain O +a O +better O +understanding O +of O +particle B-Process +recrystallization I-Process +and I-Process +solidification I-Process +, O +and O +deformation B-Process +mechanics O +and O +topography O +of O +the O +impacting O +particles B-Material +. O +Using O +state-of-the-art O +methods O +to O +examine O +the O +physical O +mechanisms O +involved O +in O +the O +impacting O +behavior O +and O +structure O +– O +property O +relationship O +, O +it O +can O +be O +suggested O +that O +the O +consecutive B-Process +layer I-Process +deposition I-Process +of O +particles B-Material +can O +better O +be O +understood O +by O +understanding B-Task +individual I-Task +particle I-Task +impacts I-Task +. O +The O +particle B-Process +– I-Process +surface I-Process +interaction I-Process +mechanism I-Process +and O +its O +relation O +to O +Reynolds B-Process +number I-Process +can O +offer O +information O +on O +the O +quality O +of O +the O +coating B-Process +through O +its O +response O +to O +shock B-Process +heating I-Process +. O +As O +a O +general O +practice O +, O +engineering B-Material +components I-Material +are O +thermally B-Process +sprayed I-Process +in O +a O +continuous O +multilayer O +mode O +with O +cooling B-Process +; O +therefore O +there O +is O +an O +opportunity O +for O +developing B-Task +richer I-Task +theoretical I-Task +models I-Task +for I-Task +single I-Task +or I-Task +multiple I-Task +particle I-Task +impact I-Task +in O +conjunction O +with O +actual O +spraying B-Task +tests I-Task +, O +so O +as O +to O +identify O +cohesive O +and O +adhesive O +strength O +, O +hardness O +and O +residual O +stresses O +. O + +Structural B-Material +adhesives I-Material +are O +increasingly O +used O +for O +bonding B-Material +components I-Material +within O +critical B-Material +load I-Material +bearing I-Material +engineering I-Material +structures I-Material +such O +as O +aerospace B-Material +and O +automotives B-Material +. O +Typically O +these O +adhesives B-Material +are O +based O +on O +epoxy B-Material +polymers I-Material +. O +Epoxies B-Material +are O +inherently O +brittle O +due O +to O +their O +homogeneous O +microstructure B-Material +and O +highly O +cross O +linked O +nature O +. O +Thus O +, O +there O +has O +been O +much O +research O +focused O +on O +improving B-Task +the I-Task +fracture I-Task +toughness I-Task +of I-Task +epoxy I-Task +polymers I-Task +by O +incorporating B-Process +a I-Process +second I-Process +minority I-Process +phase I-Process +at I-Process +the I-Process +nano-scale I-Process +. O +These O +modifiers O +fall O +into O +one O +of O +two O +main O +categories O +: O +inorganic B-Material +additives I-Material +, O +e.g. O +silica B-Material +[ O +1,2 O +] O +, O +glass B-Material +[ O +3 O +] O +, O +alumina B-Material +[ O +4 O +] O +, O +nano-clays B-Material +[ O +5 O +] O +and O +carbon B-Material +nanotubes I-Material +[ O +6,7 O +] O +or O +organic B-Material +, O +usually O +rubber B-Material +particles I-Material +. O +Rubbery B-Material +additives I-Material +can O +be O +either O +core B-Material +– I-Material +shell I-Material +rubber I-Material +particles I-Material +[ O +8 O +– O +10 O +] O +or O +can O +form O +during O +curing B-Process +via O +reaction B-Process +induced I-Process +phase I-Process +separation I-Process +mechanisms I-Process +[ O +11,12 O +] O +. O +The O +primary O +energy B-Process +dissipation I-Process +mechanisms I-Process +for O +rubber B-Material +toughened I-Material +epoxies I-Material +are O +known O +to O +be O +both O +plastic B-Task +void I-Task +growth I-Task +and O +shear B-Process +band I-Process +development I-Process +[ O +13 O +] O +. O +It O +has O +also O +been O +shown O +that O +a O +combination O +of O +the O +above O +additives B-Material +to O +create O +a O +hybrid B-Material +material I-Material +can O +provide O +synergistic B-Process +toughening I-Process +effects I-Process +, O +e.g. O +carbon B-Material +nanotubes I-Material +and O +silica B-Material +nanoparticles I-Material +[ O +14 O +] O +or O +rubber B-Material +with I-Material +silica I-Material +nanoparticles I-Material +[ O +15 O +– O +17 O +] O +. O + +These O +results O +demonstrate O +that O +SW-SVR B-Process +predicts O +complicated O +micrometeorological B-Material +data I-Material +with O +the O +best O +prediction O +performance O +and O +the O +lowest O +computational O +complexity O +compared O +with O +standard B-Process +algorithms I-Process +. O +In O +particular O +, O +we O +found O +that O +dynamic B-Process +aggregation I-Process +of I-Process +models I-Process +built O +from O +very O +little O +extracted O +data O +by O +D-SDC B-Process +is O +effective O +for O +compatibility O +of O +high O +prediction O +performance O +and O +low O +computational O +complexity O +. O +However O +, O +there O +are O +problems O +to O +be O +solved O +in O +SW-SVR B-Process +. O +Firstly O +, O +the O +prediction O +performance O +of O +SW-SVR O +sometimes O +deteriorates O +despite O +an O +increase O +of O +training B-Material +data I-Material +. O +In O +particular O +, O +this O +problem O +occurred O +under O +the O +conditions O +that O +prediction O +horizons O +are O +6 O +h O +as O +shown O +in O +Fig. O +3. O +This O +is O +because O +data O +extracted O +by O +D-SDC B-Process +involves O +unnecessary O +training B-Material +data I-Material +for O +highly O +accurate O +prediction O +. O +If O +D-SDC B-Process +extracts O +the O +same O +data O +as O +the O +extracted O +data O +when O +training O +periods O +are O +shorter O +, O +the O +prediction O +performance O +of O +SW-SVR B-Process +never O +deteriorates O +due O +to O +an O +increase O +of O +training B-Material +data I-Material +. O +Therefore O +, O +we O +must O +review O +both O +feature O +mapping O +and O +algorithms O +of O +D-SDC B-Process +so O +as O +to O +avoid O +extracting O +unnecessary O +training O +data O +. O +Meanwhile O +, O +SW-SVR B-Process +is O +based O +on O +a O +combination B-Process +of I-Process +several I-Process +algorithms I-Process +: O +kernel B-Process +approximation I-Process +, O +PLS B-Process +regression I-Process +, O +k-means B-Process +, O +D-SDC B-Process +, O +and O +linear B-Process +SVR I-Process +. O +Moreover O +, O +each O +algorithm O +has O +several O +parameters O +. O +Therefore O +, O +SW-SVR B-Process +has O +more O +varied O +parameters O +, O +and O +it O +takes O +more O +time O +to O +tune B-Process +the I-Process +parameters I-Process +. O +In O +this O +experiment O +, O +we O +used O +a O +grid B-Process +search I-Process +roughly O +so O +as O +to O +decide O +the O +parameters O +in O +a O +certain O +time O +. O +However O +, O +there O +is O +still O +room O +for O +improvement O +in O +the O +prediction O +performance O +by O +using O +other O +approaches O +such O +as O +a O +genetic B-Process +algorithm I-Process +instead O +of O +a O +grid B-Process +search I-Process +( O +Huang O +& O +Wang O +, O +2006 O +) O +. O + +• O +More O +efforts O +should O +be O +directed O +towards O +advancing O +the O +methods O +of O +feature B-Task +extraction I-Task +to O +overcome O +the O +influence O +of O +dynamic O +factors O +that O +limit O +the O +performance O +. O +The O +use O +of O +advanced B-Process +machine I-Process +learning I-Process +methods I-Process +such O +as O +deep B-Process +neural I-Process +networks I-Process +and O +muscles B-Process +synergies I-Process +extraction I-Process +should O +also O +be O +investigated O +on O +problems O +under O +the O +influence O +of O +multiple O +dynamic O +factors O +as O +such O +methods O +may O +provide O +substantial O +improvements O +upon O +the O +utilized B-Process +time-and-frequency I-Process +EMG I-Process +feature I-Process +extraction I-Process +methods I-Process +( O +Diener O +, O +Janke O +, O +& O +Schultz O +, O +2015 O +; O +Ison O +, O +Vujaklija O +, O +Whitsell O +, O +Farina O +, O +& O +Artemiadis O +, O +2016 O +; O +Park O +& O +Lee O +, O +2016 O +) O +. O +Meanwhile O +, O +we O +showed O +that O +the O +performance B-Material +of O +the O +learning O +algorithms O +can O +be O +improved O +by O +using O +feature B-Process +extraction I-Process +methods I-Process +that O +rely O +on O +the O +angular O +information O +of O +muscle O +activation O +patterns O +. O +Features B-Process +such O +as O +the O +TD-PSD B-Process +and O +the O +DFT B-Process +proved O +more O +successful O +than O +others O +in O +reducing B-Task +the I-Task +impact I-Task +of I-Task +the I-Task +two I-Task +dynamic I-Task +factors I-Task +that O +we O +considered O +in O +this O +paper O +. O +Such O +features O +can O +be O +readily O +implemented O +into O +a O +prosthesis B-Process +controller I-Process +for O +real-time B-Task +control I-Task +, O +especially O +that O +the O +EMG B-Process +pattern I-Process +recognition I-Process +systems I-Process +are O +nowadays O +becoming O +available O +for O +clinical B-Task +testing I-Task +, O +e.g. O +the O +COAPT B-Process +complete I-Process +control I-Process +system I-Process +( O +Kuiken O +et O +al. O +, O +2014 O +) O +11https O +:// O +www.coaptengineering.com O +/ O +. O + +In O +the O +recent O +years O +and O +mainly O +motivated O +by O +the O +impulse O +of O +data B-Task +mining I-Task +many O +methods O +for O +dimensionality B-Task +reduction I-Task +have O +arisen O +. O +Within O +these O +, O +it O +is O +worth O +highlighting O +the O +Principal B-Material +Component I-Material +Analysis I-Material +method I-Material +( O +PCA B-Material +) O +( O +Jolliffe O +, O +2002 O +) O +. O +In O +an O +N-dimensional O +vector O +space O +, O +the B-Material +simplest I-Material +version I-Material +of I-Material +PCA I-Material +( O +linear B-Material +PCA I-Material +) O +is O +a O +technique O +that O +finds B-Process +the I-Process +mutually-uncorrelated I-Process +vectors I-Process +onto O +which O +the B-Process +projection I-Process +of I-Process +the I-Process +samples I-Process +generates I-Process +the I-Process +highest I-Process +variances I-Process +. O +The O +result O +is O +a B-Material +set I-Material +of I-Material +orthogonal I-Material +vectors I-Material +sorted O +in O +descending O +order O +of O +achieved O +variance O +. O +The O +first O +of O +these O +vectors O +is O +that O +onto O +which O +the B-Process +variance I-Process +of I-Process +the I-Process +projection I-Process +of I-Process +the I-Process +samples I-Process +is I-Process +maximum I-Process +. O +In O +this O +sense O +, O +the O +original O +KPIs O +constitute O +the O +N-dimensional B-Material +vector I-Material +space I-Material +basis I-Material +, O +whereas O +the O +N B-Material +^ I-Material +synthetic I-Material +KPIs I-Material +represent O +the O +orthogonal O +vectors O +with O +the O +highest O +variance O +. O +To O +be O +rigorous O +, O +up B-Task +to I-Task +N I-Task +synthetic I-Task +orthogonal I-Task +KPIs I-Task +may O +be O +computed O +. O +However O +, O +only O +a O +small O +set O +of O +them O +, O +the B-Material +first I-Material +N I-Material +^ I-Material +, O +is O +enough O +to O +account O +for O +most O +of O +the O +variance O +of O +the O +data O +. O + +EM B-Material +sensors I-Material +exploit O +the O +difference B-Task +in I-Task +magnetic I-Task +properties I-Task +, O +such O +as O +relative B-Task +permeability I-Task +, O +and O +electrical B-Task +conductivity I-Task +between O +samples O +with O +different O +microstructural B-Task +phase I-Task +balances I-Task +. O +In O +ferromagnetic B-Material +steels I-Material +, O +the O +change O +in O +relative B-Task +permeability I-Task +has O +a O +significant O +effect O +. O +Previously O +, O +multi-frequency B-Material +EM I-Material +sensors I-Material +have O +been O +shown O +to O +be O +able O +to O +measure O +austenite O +/ O +ferrite O +fraction O +from O +0 O +% O +to O +100 O +% O +in O +model O +( O +HIPped O +austenitic O +/ O +ferritc O +stainless B-Material +steel I-Material +powder I-Material +) O +alloys O +[ O +7,8 O +] O +. O +The O +large O +difference B-Process +in I-Process +magnetic I-Process +properties I-Process +of O +ferrite B-Process +( O +ferromagnetic B-Process +) O +and O +austenite B-Process +( O +paramagnetic B-Process +) O +phases O +makes O +the O +change O +in O +signal O +large O +and O +hence O +relatively O +easy O +to O +measure O +. O +EM B-Material +sensors I-Material +have O +also O +measured O +the O +levels O +of O +decarburisation B-Task +( O +variation B-Task +in I-Task +ferrite I-Task +content I-Task +with I-Task +depth I-Task +) O +in O +steel B-Material +rod I-Material +[ O +9,10 O +] O +. O +The O +approach O +adopted O +to O +relate O +the O +overall O +steel O +EM B-Process +sensor I-Process +signal I-Process +to O +its O +microstructure O +has O +been O +to O +construct O +a O +finite B-Process +element I-Process +( O +FE B-Process +) O +model O +for O +the O +microstructure O +( O +phase O +, O +region O +size O +and O +distribution O +) O +. O +The O +EM B-Process +properties I-Process +of I-Process +the I-Process +individual I-Process +phases I-Process +are O +assigned O +to O +those O +regions O +to O +give O +the O +overall B-Process +EM I-Process +properties I-Process +of O +the O +steel B-Material +. O +Within O +the O +model O +the O +particular B-Process +sensor I-Process +geometry I-Process +is O +included O +( O +e.g. O +two-dimensional O +axisymmetric O +for O +a O +cylindrical B-Material +sample I-Material +and O +tubular B-Material +sensor I-Material +[ O +10 O +]) O +and O +the O +interaction O +with O +the O +steel B-Material +and O +any O +external B-Material +circuits I-Material +predicted O +. O +In O +this O +way O +different O +microstructures B-Material +and O +sensor B-Material +designs O +can O +be O +compared O +. O + +Many O +applications O +in O +fluid B-Task +mechanics I-Task +have O +shown O +that O +surface B-Process +suction I-Process +can O +be O +used O +as O +an O +effective O +flow-control B-Process +mechanism I-Process +. O +For O +example O +, O +Gregory O +and O +Walker O +[ O +1 O +] O +discuss O +how O +the O +introduction O +of O +suction O +extends O +the O +laminar-flow O +region O +over O +a O +swept B-Material +wing I-Material +by O +reducing B-Task +the I-Task +thickness I-Task +of I-Task +the I-Task +boundary I-Task +layer I-Task +and I-Task +the I-Task +magnitude I-Task +of I-Task +crossflow I-Task +velocity I-Task +. O +Conclusions O +for O +the O +swept-wing B-Material +flow O +arose O +from O +equivalent O +studies O +of O +the O +von O +Kármán O +( O +rotating B-Material +disk I-Material +) O +flow O +( O +see O +Gregory O +and O +Walker O +[ O +2 O +] O +, O +Stuart O +[ O +3 O +]) O +and O +work O +has O +since O +continued O +into O +this O +and O +related O +flows O +using O +numerical B-Process +and I-Process +asymptotic I-Process +approaches I-Process +( O +see O +Ockendon O +[ O +4 O +] O +, O +Dhanak O +[ O +5 O +] O +, O +Bassom O +and O +Seddougui O +[ O +6 O +] O +, O +Lingwood O +[ O +7 O +] O +, O +Turkyilmazoglu O +[ O +8 O +] O +, O +Lingwood O +and O +Garrett O +[ O +9 O +] O +, O +for O +example O +) O +. O +The O +literature O +shows O +that O +increasing B-Process +suction I-Process +has O +a O +stabilising O +effect O +on O +the O +general O +class O +of O +“ B-Process +Bödewadt I-Process +, I-Process +Ekman I-Process +and I-Process +von I-Process +Kármán I-Process +” I-Process +( I-Process +BEK I-Process +) I-Process +flows I-Process +which O +results O +in O +an O +increase B-Process +in I-Process +critical I-Process +Reynolds I-Process +numbers I-Process +for O +the O +onset O +of O +convective O +and O +absolute O +instabilities O +, O +a O +narrowing B-Process +in I-Process +the I-Process +range I-Process +of I-Process +unstable I-Process +parameters I-Process +and O +a O +decrease B-Process +in I-Process +amplification I-Process +rates I-Process +of O +the O +unstable O +convective O +modes O +. O +The O +convective B-Process +instability I-Process +results O +are O +interpreted O +in O +terms O +of O +a O +delay O +in O +the O +onset O +of O +spiral B-Material +vortices I-Material +, O +and O +the O +absolute B-Process +instability I-Process +results O +in O +terms O +of O +the O +onset O +of O +laminar-turbulent B-Process +transition I-Process +( O +Lingwood O +[ O +7,10,11 O +]) O +. O + +We O +have O +developed O +a O +systematic O +, O +quantified O +understanding O +of O +a O +specific O +problem O +: O +the O +design B-Task +of I-Task +mobile-friendly I-Task +unique I-Task +identifiers I-Task +. O +But O +our O +results O +also O +apply O +to O +the O +design B-Task +of I-Task +other I-Task +text-based I-Task +services I-Task +. O +There O +has O +been O +a O +trend O +toward O +bespoke B-Material +and I-Material +adaptive I-Material +keyboards I-Material +( O +e.g. O +, O +Dunlop O +and O +Levine O +, O +2012 O +; O +Karrenbauer O +and O +Oulasvirta O +, O +2014 O +; O +Leiva O +et O +al. O +, O +2015 O +; O +Wiseman O +et O +al. O +, O +2013 O +) O +. O +More O +often O +than O +not O +, O +though O +, O +input B-Material +devices I-Material +are O +a O +fixed O +constraint O +in O +the O +design B-Task +of I-Task +a I-Task +service I-Task +. O +Most O +users O +are O +typing O +on O +the O +keyboard O +that O +came O +with O +their O +phone O +. O +Those O +keyboards O +have O +advantages O +, O +limitations O +and O +quirks O +. O +The O +mode-switching B-Process +that O +most O +touchscreen O +keyboards O +require O +to O +reach O +numbers O +and O +capital O +letters O +is O +at O +the O +root O +of O +design O +improvements O +we O +propose O +in O +this O +paper O +. O +When O +designing B-Task +services I-Task +, O +it O +is O +vital O +to O +be O +aware O +of O +the O +fixed O +constraints O +of O +a O +system O +and O +to O +then O +focus O +on O +the O +aspects O +of O +a O +service O +'s O +design O +that O +can O +be O +controlled O +. O +Making O +changes O +to O +input O +data O +in O +this O +way O +is O +a O +cheap O +, O +quick O +and O +easy O +way O +to O +improve O +user O +experience O +. O + +Probabilistic B-Process +and I-Process +stochastic I-Process +approaches I-Process +can O +facilitate O +the O +search B-Task +for I-Task +local I-Task +and I-Task +global I-Task +optima I-Task +. O +Evolutionary B-Process +algorithms I-Process +, O +such O +as O +genetic B-Process +population I-Process +( O +Jomier O +et O +al. O +, O +2006 O +; O +Rivest-Henault O +et O +al. O +, O +2012 O +; O +Ruijters O +et O +al. O +, O +2009 O +) O +, O +are O +considered O +as O +a O +strategy O +that O +is O +“ O +less O +likely O +to O +get O +stuck O +in O +a O +local O +optimum O +” O +( O +Ruijters O +et O +al. O +, O +2009 O +) O +. O +A O +cost B-Material +function I-Material +consisting O +of O +the O +“ O +sum O +of O +the O +Gaussian-blurred O +intensity O +values O +in O +the O +[ O +DSA O +] O +at O +the O +projected O +model O +points O +” O +( O +Jomier O +et O +al. O +, O +2006 O +) O +is O +optimized O +using O +a O +genetic B-Process +algorithm I-Process +optimizer I-Process +. O +Other O +authors O +“ O +use O +the O +Condensation B-Process +form I-Process +of I-Process +sequential I-Process +Monte I-Process +Carlo I-Process +sampling I-Process +to O +estimate O +a O +cost O +function O +gradient O +” O +( O +Florin O +et O +al. O +, O +2005 O +) O +for O +finding O +the O +global O +minimum O +. O +Besides O +, O +the O +Kalman O +filter O +is O +successfully O +adopted O +( O +Curwen O +et O +al. O +, O +1994 O +; O +Feldmar O +et O +al. O +, O +1997 O +; O +Toledo O +et O +al. O +, O +1998 O +) O +. O + +For O +all O +volunteers O +the O +AAMM B-Task +technique I-Task +significantly O +( O +p O +< O +0.01 O +) O +outperformed O +the O +other O +two O +methods O +in O +all O +of O +the O +intervals O +as O +can O +be O +seen O +by O +comparing O +to O +the O +error B-Material +curves I-Material +shown O +in O +Fig. O +8 O +and O +the O +figures O +in O +Table O +1 O +in O +the O +supplementary O +materials O +. O +Significance O +was O +assessed O +using O +a O +1-tailed B-Process +Wilcoxon I-Process +signed I-Process +rank I-Process +test I-Process +since O +the O +error O +distributions O +were O +generally O +not O +symmetric O +. O +The O +estimation O +errors O +for O +AAMM B-Task +and O +its O +non-adaptive O +counterpart O +, O +AAMM O +( O +no O +adapt. O +) O +, O +were O +similar O +in O +the O +beginning O +of O +the O +application O +phase O +, O +but O +as O +anticipated O +, O +as O +the O +application O +phase O +went O +on O +, O +the O +AAMM O +technique O +continually O +improved O +its O +accuracy O +by O +incorporating O +more O +and O +more O +data O +into O +the O +model O +. O +On O +average O +the O +motion O +estimation O +of O +AAMM O +improved O +by O +22.94 O +% O +in O +T5 O +with O +respect O +to O +its O +non-adaptive O +counterpart O +. O +However O +, O +the O +method O +has O +already O +significantly O +adapted O +to O +the O +breathing O +pattern O +in O +T2 O +, O +i.e. O +after O +between O +3 O +and O +7 O +min O +of O +imaging O +, O +where O +motion O +estimations O +where O +on O +average O +16.87 O +% O +more O +accurate O +than O +at O +the O +beginning O +of O +the O +adaptation O +phase O +. O +By O +visually O +inspecting O +the O +curves O +for O +AAMM O +in O +Fig. O +8 O +it O +can O +be O +seen O +that O +for O +many O +volunteers O +( O +in O +particular O +volunteers O +A O +, O +D O +, O +E O +, O +and O +F O +) O +the O +error O +curves O +start O +to O +flatten O +approximately O +around O +the O +7 O +min O +mark O +. O +From O +this O +it O +can O +be O +concluded O +that O +a O +longer O +calibration O +scan O +of O +around O +12 O +min O +would O +be O +optimal O +, O +that O +is O +the O +5 O +min O +that O +were O +used O +for O +calibration O +in O +this O +experiment O +plus O +7 O +min O +worth O +of O +data O +added O +during O +the O +application O +phase O +. O +Note O +that O +this O +time O +could O +be O +significantly O +reduced O +if O +a O +non-cardiac-gated O +sequence O +was O +used O +. O + +As O +a O +particular O +case O +of O +survey O +data O +, O +we O +used O +the O +iUTAH B-Process +“ I-Process +Utah I-Process +Water I-Process +Survey I-Process +,” I-Process +which O +was O +implemented O +by O +participating O +researchers O +from O +several O +Utah O +institutions O +of O +higher O +education O +. O +The O +objectives O +of O +the O +survey O +were O +to O +document O +how O +a O +representative O +cross-section O +of O +Utah B-Task +'s I-Task +adult I-Task +population I-Task +thinks I-Task +about I-Task +water I-Task +issues I-Task +. O +The O +survey B-Process +included O +three O +core O +blocks O +of O +questions O +: O +perceptions B-Material +of I-Material +the I-Material +adequacy I-Material +of I-Material +local I-Material +water I-Material +supplies I-Material +, O +perceptions B-Material +of I-Material +the I-Material +quality I-Material +of I-Material +local I-Material +water I-Material +resources I-Material +, O +and O +concern B-Material +about I-Material +a I-Material +range I-Material +of I-Material +water I-Material +and I-Material +non-water I-Material +issues I-Material +. O +A O +number O +of O +additional O +questions O +captured O +information O +about O +respondents' O +familiarity B-Material +with I-Material +water I-Material +cost I-Material +, O +lawn-watering O +behaviors O +, O +participation O +in O +water O +based O +recreation O +, O +and O +demographic O +attributes O +. O +Supplementary O +material O +to O +this O +paper O +includes O +a O +document O +with O +a O +description O +of O +the O +dataset O +as O +a O +whole O +, O +a O +document O +containing O +the O +complete O +survey O +instrument O +, O +and O +two O +data O +files O +containing O +the O +results O +and O +an O +associated O +codebook O +( O +see O +Section O +4.3 O +) O +. O + +Isogeometric B-Process +analysis I-Process +( O +IGA B-Process +) O +is O +a O +numerical B-Process +simulation I-Process +method I-Process +which O +is O +directly O +based O +on O +the O +NURBS-based B-Process +representation I-Process +of O +CAD O +models O +. O +It O +exploits O +the O +tensor-product O +structure O +of O +2 O +- O +or O +3-dimensional O +NURBS B-Material +objects O +to O +parameterize O +the O +physical O +domain O +. O +Hence O +the O +physical O +domain O +is O +parameterized O +with O +respect O +to O +a O +rectangle O +or O +to O +a O +cube O +. O +Consequently O +, O +singularly O +parameterized O +NURBS O +surfaces O +and O +NURBS O +volumes O +are O +needed O +in O +order O +to O +represent O +non-quadrangular O +or O +non-hexahedral O +domains O +without O +splitting O +, O +thereby O +producing O +a O +very O +compact O +and O +convenient O +representation.The O +Galerkin O +projection O +introduces O +finite-dimensional O +spaces O +of O +test O +functions O +in O +the O +weak O +formulation O +of O +partial O +differential O +equations O +. O +In O +particular O +, O +the O +test O +functions O +used O +in O +isogeometric O +analysis O +are O +obtained O +by O +composing O +the O +inverse O +of O +the O +domain O +parameterization O +with O +the O +NURBS O +basis O +functions O +. O +In O +the O +case O +of O +singular O +parameterizations O +, O +however O +, O +some O +of O +the O +resulting O +test O +functions O +do O +not O +necessarily O +fulfill O +the O +required O +regularity O +properties O +. O +Consequently O +, O +numerical O +methods O +for O +the O +solution O +of O +partial O +differential O +equations O +cannot O +be O +applied O +properly.We O +discuss O +the O +regularity O +properties O +of O +the O +test O +functions O +. O +For O +one O +- O +and O +two-dimensional O +domains O +we O +consider O +several O +important O +classes O +of O +singularities O +of O +NURBS O +parameterizations O +. O +For O +specific O +cases O +we O +derive O +additional O +conditions O +which O +guarantee O +the O +regularity O +of O +the O +test O +functions O +. O +In O +addition O +we O +present O +a O +modification O +scheme O +for O +the O +discretized O +function O +space O +in O +case O +of O +insufficient O +regularity O +. O +It O +is O +also O +shown O +how O +these O +results O +can O +be O +applied O +for O +computational O +domains O +in O +higher O +dimensions O +that O +can O +be O +parameterized O +via O +sweeping O +. O + +The O +above O +discussion O +also O +lays O +bare O +the O +difference O +of O +perspectives O +between O +the O +fusion O +of O +hard B-Process +constraints I-Process +and O +knowledge-base B-Process +merging I-Process +: O +the O +idea O +of O +Konieczny O +and O +Pino-Perez O +is O +to O +explain O +the O +fusion B-Process +of I-Process +plain I-Process +epistemic I-Process +states I-Process +, O +understood O +as O +a O +set O +of O +plausible O +worlds O +, O +by O +the O +existence O +of O +underlying O +partial B-Process +orderings I-Process +or O +numerical B-Process +plausibility I-Process +degrees I-Process +( O +obtained O +by O +distances O +) O +, O +based O +on O +axioms O +that O +only O +use O +plausible O +sets O +attached O +to O +these O +orderings O +. O +In O +[ O +67 O +] O +the O +same O +authors O +use O +both O +hard B-Process +( I-Process +integrity I-Process +) I-Process +constraints I-Process +and O +belief B-Process +sets I-Process +referring O +to O +plausible O +worlds O +, O +and O +try O +to O +extend O +both O +the O +AGM B-Process +revision I-Process +and O +knowledge-based B-Process +merging I-Process +. O +However O +, O +they O +do O +not O +envisage O +the O +merging B-Process +of I-Process +integrity I-Process +constraints I-Process +discussed O +in O +the O +previous O +section O +. O +The O +belief B-Task +revision I-Task +and I-Task +merging I-Task +literature O +takes O +an O +external O +point O +of O +view O +on O +cognitive O +processes O +under O +study O +. O +The O +underlying O +ordered B-Material +structures I-Material +are O +here O +a O +consequence O +of O +the O +merging O +postulates O +, O +but O +they O +do O +not O +appear O +explicitly O +in O +the O +axioms O +and O +they O +are O +not O +observable O +from O +the O +outside O +. O +On O +the O +contrary O +, O +our O +approach O +is O +to O +construct B-Process +fusion I-Process +rules I-Process +that O +only O +rely O +on O +what O +is O +explicitly O +supplied O +by O +sources O +. O +In O +the O +sequel O +we O +consider O +the O +counterpart O +of O +our O +fusion O +postulates O +for O +ranked B-Process +models I-Process +, O +that O +can O +be O +expressed O +by O +means O +of O +total O +orders O +of O +possible O +worlds O +or O +by O +their O +encodings O +on O +a O +plausibility O +scale O +. O + +Methods O +for O +anomaly B-Task +detection I-Task +in O +a O +local O +context O +are O +the O +conceptual O +opposite O +to O +the O +afore-described B-Material +centralized I-Material +methods I-Material +, O +which O +rely O +on O +globally B-Material +shared I-Material +models I-Material +. O +In O +data B-Task +mining I-Task +, O +the O +notion B-Task +of I-Task +locality I-Task +is O +often O +given O +as O +distance B-Material +between I-Material +data I-Material +values I-Material +( O +given O +a B-Material +specific I-Material +distance I-Material +metric I-Material +such I-Material +as I-Material +Euclidean I-Material +distance I-Material +) O +. O +A O +data O +point O +is O +compared B-Process +to I-Process +the I-Process +value I-Process +of I-Process +its I-Process +nearest I-Process +neighbors I-Process +in O +terms O +of O +data O +distance O +[ O +42 O +] O +. O +However O +, O +the B-Task +notion I-Task +of I-Task +locality I-Task +can O +also O +be O +given O +in O +a B-Material +geographical I-Material +distance I-Material +between O +the O +sources O +of O +the O +data O +. O +Many B-Material +similar I-Material +values I-Material +( O +i.e. O +, O +data O +with O +small O +distance O +among O +each O +other O +) O +result O +in O +a O +higher O +density O +, O +called O +clusters B-Material +, O +while O +values B-Process +that I-Process +are I-Process +less I-Process +similar I-Process +result I-Process +in I-Process +a I-Process +lower I-Process +density I-Process +. O +Anomalies B-Task +can O +fall O +outside O +of O +any O +cluster B-Material +but O +, O +when O +frequently O +occurring O +, O +can B-Process +form I-Process +a I-Process +cluster I-Process +too O +. O +Determining B-Task +if I-Task +a I-Task +datum I-Task +is I-Task +normal I-Task +or I-Task +anomalous I-Task +compared O +to O +local O +neighborhood O +data O +is O +a O +challenge O +. O + +MWSN B-Process +routing I-Process +protocols I-Process +generally O +take O +influence O +from O +both O +WSN B-Process +and O +mobile B-Process +ad I-Process +hoc I-Process +network I-Process +( O +MANET B-Process +) O +routing B-Process +protocols I-Process +, O +which O +all O +share O +common O +limitations O +, O +such O +as O +bandwidth O +, O +power O +and O +cost O +. O +WSNs B-Process +often O +share O +the O +same O +aim O +as O +MWSNs B-Process +, O +in O +that O +they O +wish O +to O +route B-Process +data I-Process +from O +many O +sensors B-Material +to O +a O +single O +sink O +. O +However O +, O +WSNs B-Process +are O +normally O +considered O +to O +be O +static O +and O +so O +the O +associated O +routing O +protocols O +are O +often O +unable O +to O +cope O +in O +a O +mobile O +scenario O +[ O +10 O +] O +. O +Alternatively O +, O +MANET B-Process +protocols I-Process +are O +designed O +to O +be O +able O +to O +cope O +with O +the O +mobility O +of O +nodes O +, O +however O +they O +aim O +to O +allow O +end-to-end O +communication O +to O +occur O +between O +any O +two O +nodes O +[ O +2 O +] O +. O +This O +extra O +functionality O +is O +often O +not O +required O +by O +MWSNs B-Process +and O +so O +the O +additional O +overhead O +is O +unnecessary O +. O +Combined O +with O +the O +high O +packet O +delivery O +ratios O +and O +low O +delays O +that O +are O +demanded O +by O +emerging O +applications O +, O +the O +ideal O +routing O +solution O +for O +a O +MWSN B-Process +is O +one O +that O +can O +handle O +the O +mobility O +of O +nodes O +and O +allows O +data O +to O +be O +forwarded O +from O +the O +sensors O +to O +the O +sink O +in O +a O +reliable O +and O +timely O +manner O +. O +This O +set O +of O +requirements O +make O +the O +problem O +of O +routing B-Task +in I-Task +a I-Task +MWSN I-Task +a O +unique O +challenge O +, O +which O +will O +require O +new O +specifically O +designed O +solutions O +. O +For O +this O +reason O +there O +have O +been O +many O +routing O +protocols O +designed O +for O +MWSNs B-Process +. O +As O +such O +, O +this O +section O +will O +give O +an O +overview O +of O +the O +current O +literature O +, O +which O +highlights O +the O +different O +techniques O +and O +commonly O +used O +protocols O +in O +MWSN B-Process +routing I-Process +. O + +In O +order O +to O +test B-Task +whether I-Task +haptic I-Task +patterns I-Task +can I-Task +convey I-Task +or I-Task +enhance I-Task +the I-Task +mood I-Task +music I-Task +of O +a O +movie O +, O +an O +affective B-Material +movie I-Material +clip I-Material +corpus I-Material +was O +required O +consisting O +of O +clips O +labeled O +according O +to O +the O +emotion O +conveyed O +in O +the O +mood O +music O +. O +The O +following O +database B-Material +collections I-Material +were O +examined O +as O +possible O +sources O +for O +the O +corpus O +: O +the O +Emotional B-Material +Movie I-Material +Database I-Material +( O +EMDB B-Material +) O +[ O +19 O +] O +, O +and O +Film B-Material +Stim I-Material +[ O +20 O +] O +. O +However O +, O +these O +were O +discarded O +after O +review B-Process +as O +unsuitable O +. O +The O +aim O +of O +this O +study O +is O +to O +enhance B-Task +the I-Task +mood I-Task +in O +the O +film O +score O +, O +and O +in O +the O +case O +of O +the O +clips O +in O +the O +EMDB B-Material +, O +no O +audio O +is O +provided O +which O +deemed O +the O +clips O +unsuitable O +. O +In O +the O +case O +of O +the O +Film B-Material +Stim I-Material +database I-Material +, O +the O +clips O +are O +in O +French O +rather O +than O +English O +, O +and O +with O +no O +subtitles O +which O +where O +also O +deemed O +unsuitable O +since O +the O +studies O +are O +carried O +out O +with O +English B-Material +speaking I-Material +participants I-Material +. O +Furthermore O +, O +the O +Film B-Material +Stim I-Material +selection I-Material +is O +based O +on O +the O +affective O +content O +of O +the O +narrative O +as O +in O +most O +of O +them O +there O +is O +no O +music O +which O +is O +also O +unsuitable O +as O +discussed O +. O +From O +our O +review B-Process +of I-Process +available I-Process +database I-Process +collections I-Process +, O +it O +was O +found O +that O +at O +present O +there O +is O +no O +standard O +corpus O +of O +affective O +movie O +clips O +where O +the O +affective O +indexing O +referred O +to O +the O +musical O +score O +of O +the O +clip O +. O + +Aspect-oriented B-Process +Programming I-Process +( O +AOP B-Process +) O +can O +well O +solve B-Task +the I-Task +cross-cutting I-Task +concerns I-Task +. O +Because O +of O +the O +different O +features O +of O +aspect O +, O +AOP B-Process +requires O +new O +techniques O +for O +testing O +. O +First O +, O +this O +paper O +proposes O +a O +model B-Task +to I-Task +test I-Task +aspect-oriented I-Task +software I-Task +. O +In O +order O +to O +support O +the O +testing B-Process +model I-Process +of O +the O +first O +three O +steps O +, O +we O +propose O +the O +algorithm B-Process +of I-Process +selecting I-Process +aspect I-Process +relevant I-Process +test I-Process +cases I-Process +. O +Then O +, O +we O +develop B-Task +a I-Task +new I-Task +tool I-Task +to I-Task +implement I-Task +the I-Task +theoretical I-Task +of I-Task +automating I-Task +select I-Task +test I-Task +case I-Task +. O +Finally O +, O +a O +case O +of O +the O +Bank B-Process +Account I-Process +System I-Process +is O +studied O +to O +illustrate O +our O +testing O +approach O +. 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O +A O +transformation B-Material +matrix I-Material +which O +can O +express B-Task +the I-Task +relationship I-Task +between O +an O +object B-Material +point I-Material +and O +its O +image B-Material +by O +the O +refraction B-Process +of I-Process +prism I-Process +was O +derived O +based O +on O +geometrical B-Process +optics I-Process +, O +and O +a O +mathematical B-Process +model I-Process +was O +introduced O +which O +can O +denote O +the O +position O +of O +prism B-Material +with O +arbitrary O +faces O +only O +by O +7 O +parameters O +. O +This O +model O +can O +extend B-Process +the I-Process +application I-Process +of I-Process +single-lens I-Process +stereovision I-Process +system I-Process +using O +prism B-Material +to O +a O +more O +widely O +area O +. O +Experimentation O +results O +are O +presented O +to O +prove O +the O +effectiveness B-Process +and O +robustness B-Process +of O +our O +proposed O +model O +. 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O +This O +resulted O +in O +a O +significant B-Process +reduction I-Process +in I-Process +the I-Process +number I-Process +of I-Process +zones I-Process +and I-Process +monitoring I-Process +probes I-Process +. O +The O +varying B-Process +amounts I-Process +of I-Process +steelwork I-Process +in O +the O +beams O +had O +previously O +lead O +to O +up O +to O +5 O +zones O +per O +beam O +, O +with O +multiple B-Process +layers I-Process +of I-Process +mesh I-Process +to O +achieve O +the O +design O +current O +density O +. O +On O +review O +of O +the O +data B-Material +the O +operating O +current O +density O +was O +similar O +in O +all O +zones O +and O +so O +this O +was O +reduced O +to O +a O +single O +zone O +per O +beam O +. 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O +This O +situation O +resulted O +in O +the O +concrete O +to O +exhibit O +an O +excessively O +porous O +structure O +. O +The O +most O +fundamental O +rules O +of O +thumb O +of O +construction O +, O +namely O +concrete B-Material +cover I-Material +, O +was O +not O +taken O +care O +of O +in O +formwork O +workmanship O +. O +Faults B-Process +in I-Process +the I-Process +connections I-Process +of I-Process +stirrups I-Process +to O +the O +longitudinal O +bars O +, O +unstaggered B-Process +formation I-Process +of I-Process +stirrup I-Process +hooks B-Material +in O +beams B-Material +and O +columns B-Material +, O +the O +perpendicular B-Process +angles I-Process +of O +the O +hooks B-Material +, O +inadequately B-Process +anchorage I-Process +lengths I-Process +of O +the O +stirrup B-Material +hooks I-Material +and O +longitudinal B-Material +bars I-Material +, O +and O +the O +use B-Process +of I-Process +cold I-Process +joints I-Process +were O +the O +other O +frequently O +encountered O +workmanship B-Process +defects I-Process +( O +Figs. O +19 O +– O +22 O +) O +. 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O +Long B-Process +term I-Process +studies I-Process +in I-Process +Finland I-Process +concluded O +that O +this O +empirical O +fit O +is O +an O +exponential B-Task +relationship I-Task +[ O +1 O +] O +. O +The O +exponential O +fits O +, O +using O +a O +sufficient B-Process +amount I-Process +of I-Process +cores I-Process +, O +can O +be O +used O +to O +map B-Task +the I-Task +air I-Task +void I-Task +content I-Task +variation I-Task +in O +a O +similar O +manner O +to O +the O +dielectric B-Material +maps I-Material +shown O +in O +Fig. O +4. O +Only O +4 O +cores O +were O +feasible O +due O +to O +various O +factors O +involved O +with O +testing B-Task +the I-Task +final I-Task +lift I-Task +of O +an O +in-service O +pavement O +. O +More O +cores O +are O +needed O +for O +more B-Task +stable I-Task +exponential I-Task +coefficients I-Task +, O +although O +the O +limited O +cores O +show O +that O +the O +predicted B-Process +relationships I-Process +are O +similar O +for O +the O +measured B-Process +dielectric I-Process +range I-Process +in O +this O +case-study O +. O +Since O +both O +regressions B-Process +predict O +air B-Task +void I-Task +content I-Task +at O +a O +maximum O +difference O +of O +0.56 O +% O +, O +which O +is O +within O +the O +uncertainty O +of O +the O +core B-Process +measurement I-Process +precision I-Process +of O +0.7 O +% O +, O +use O +of O +either O +the O +initial B-Process +or I-Process +repeat I-Process +run I-Process +regression I-Process +predictions I-Process +are O +appropriate O +. O + +MicroCT B-Process +has O +been O +applied O +to O +AM B-Material +parts I-Material +in O +various O +forms O +. O +Some O +preliminary B-Material +results I-Material +demonstrating O +the O +visualization B-Task +of I-Task +defects I-Task +including O +porosity B-Process +in I-Process +AM I-Process +components I-Process +were O +reported O +in O +[ O +6 O +] O +. O +In O +another O +study O +, O +the O +porosity B-Task +structures I-Task +in I-Task +parts I-Task +built O +with O +improper O +settings O +were O +investigated O +[ O +7 O +] O +. O +In O +this O +work O +, O +the O +average B-Process +porosity I-Process +ranged O +from O +0.1 O +– O +0.5 O +% O +, O +and O +large O +pores O +were O +observed O +which O +followed O +the O +build B-Process +direction I-Process +and O +may O +be O +attributed O +to O +the O +electron B-Process +beam I-Process +raster I-Process +and I-Process +overlap I-Process +pattern I-Process +. I-Process +This O +was O +followed O +by O +more O +recent B-Material +reports I-Material +of O +the O +porosity B-Task +distribution I-Task +as O +a O +function O +of O +build O +strategy O +for O +electron B-Material +beam I-Material +melted I-Material +samples I-Material +with O +average O +porosity O +< O +0.2 O +% O +[ O +8 O +] O +. O +In O +another O +study O +, O +similar O +porosity B-Material +images I-Material +from O +microCT B-Material +were O +reported O +at O +levels O +above O +0.2 O +% O +average O +porosity O +[ O +9,10 O +] O +. O +Very O +recent O +work O +reports O +similar O +images O +and O +may O +indicate O +that O +the O +porosity O +structure O +depends O +on O +the O +build O +direction O +[ O +11 O +] O +. O +Other O +applications O +of O +the O +use O +of O +microCT O +to O +characterize B-Task +AM I-Task +parts I-Task +include O +the O +comparison B-Process +of I-Process +the I-Process +part I-Process +to I-Process +its I-Process +design I-Process +model I-Process +[ O +12 O +] O +and O +the O +characterization B-Process +of I-Process +surface I-Process +roughness I-Process +of O +such O +parts O +[ O +13 O +] O +. O +In O +the O +present O +work O +, O +the O +aim O +is O +to O +demonstrate B-Task +a I-Task +specific I-Task +type I-Task +of I-Task +defect I-Task +present O +at O +very B-Process +low I-Process +average I-Process +porosity I-Process +levels I-Process +below O +0.01 O +% O +, O +and O +which O +does O +not B-Process +follow I-Process +the I-Process +build I-Process +direction I-Process +as O +in O +some O +other O +reported O +examples O +. O +We O +also O +demonstrate O +how O +this O +porosity B-Task +structure I-Task +changes I-Task +after O +Hot B-Process +Isostatic I-Process +Pressing I-Process +( O +HIP B-Process +) O +treatment O +of O +the O +same O +sample O +. O + +Aeroengine B-Task +turbine I-Task +disks I-Task +often O +consist O +of O +paramagnetic B-Material +, O +that O +means O +non-ferromagnetic B-Material +Nickel I-Material +based I-Material +alloys I-Material +. O +Sometimes O +, O +parasitic B-Material +small I-Material +ferromagnetic I-Material +particles I-Material +can O +be O +included O +in O +these O +disks O +that O +may O +decrease B-Task +the I-Task +mechanical I-Task +stability I-Task +. O +For O +this O +reason O +, O +in O +case O +of O +a O +suspicion O +disks O +are O +to O +be O +analysed O +with O +respect O +to O +ferromagnetic B-Process +inclusions I-Process +. O +These O +inclusions O +generate O +a O +magnetic B-Task +density I-Task +which O +can O +be O +measured O +by O +a O +flux B-Material +gate I-Material +magnetometer I-Material +using O +the O +magnetic B-Process +remanence I-Process +method I-Process +[ O +1 O +] O +. O +The O +detection B-Process +principle I-Process +of I-Process +ferromagnetic I-Process +impurities I-Process +in O +non-magnetic O +metallic O +materials O +is O +based O +on O +their O +remanence O +. O +Before O +such O +a O +measurement B-Task +can O +be O +carried O +out O +, O +the O +aeroengine O +turbine O +disks O +are O +premagnetised B-Process +in O +axial O +direction O +. O +As O +ferromagnetic O +materials O +show O +the O +well-known O +hysteresis B-Process +behaviour I-Process +, O +those O +materials O +can O +be O +magnetised O +by O +a O +strong B-Process +magnetic I-Process +field I-Process +which O +drives O +the O +magnetic O +material O +into O +saturation O +. O +When O +removing B-Process +the I-Process +magnetic I-Process +field I-Process +, O +the O +remanence O +is O +left O +. O +This O +remaining B-Process +flux I-Process +density I-Process +is O +used O +to O +detect O +them O +in O +non-magnetic O +materials O +. O + +Although O +the O +presented O +model O +is O +developed O +and O +tested O +with O +a-C B-Material +: I-Material +H I-Material +layers I-Material +in O +mind O +, O +it O +is O +not O +necessarily O +limited O +to O +them O +. O +Moreover O +, O +the O +only O +assumptions O +are O +chemical B-Process +reactions I-Process +between O +the O +gas B-Material +and O +the O +solid B-Material +forming I-Material +volatiles I-Material +, O +the O +loss O +of O +these O +volatiles O +from O +the O +material O +and O +the O +two O +stated O +boundary O +conditions O +of O +gas B-Material +influx O +at O +a O +single B-Material +outer I-Material +surface I-Material +and O +the O +possibility O +of O +reactions B-Process +throughout O +the O +bulk O +. O +Porosity B-Process +and O +significant O +gas B-Material +inventories I-Material +were O +observed O +not O +only O +for O +carbon B-Material +[ O +12 O +] O +but O +, O +e.g. O +also O +for O +beryllium B-Material +co-deposits I-Material +[ O +25 O +] O +and O +can O +be O +expected O +for O +other O +co-deposits O +formed O +in O +plasma B-Material +devices I-Material +[ O +1 O +] O +. O +Thus O +, O +TCR B-Material +and O +its O +description O +by O +the O +presented O +model O +may O +be O +applicable O +to O +all O +deposits O +. O +If O +a O +layer O +has O +constituents B-Process +that I-Process +are I-Process +not I-Process +forming I-Process +volatiles I-Process +with I-Process +the I-Process +reactive I-Process +gas I-Process +, O +e.g. O +W B-Process +and I-Process +Be I-Process +with I-Process +O2 I-Process +, O +these O +constituents O +cannot O +be O +removed O +by O +TCR B-Material +, O +as O +they O +will O +not O +be O +removed O +from O +the O +deposit O +. O +This O +can O +influence O +the O +removal O +of O +other O +deposit B-Material +constituents I-Material +and O +the O +time O +evolution O +of O +the O +process O +can O +change O +. O +The O +new O +understanding O +of O +TCR B-Material +may O +, O +for O +the O +first O +time O +, O +allow O +applying O +the O +method O +in O +a O +controlled O +way O +to O +nuclear B-Material +fusion I-Material +devices I-Material +, O +possibly O +solving O +the O +tritium B-Process +retention I-Process +issue O +especially O +related O +to O +carbon B-Material +based I-Material +materials I-Material +. O + +Power B-Material +and I-Material +particle I-Material +exhaust I-Material +are O +crucial O +for O +the O +viability O +of O +any O +future O +fusion B-Material +power I-Material +plant I-Material +concept O +. O +Heat O +in O +fusion B-Process +reactors I-Process +must O +be O +extracted O +through O +a O +wall O +and O +cannot O +be O +exhausted O +volumetrically O +, O +which O +limits O +the O +allowed O +power O +density O +in O +fusion O +reactors O +[ O +1 O +] O +and O +is O +a O +severe B-Task +technical I-Task +challenge I-Task +in O +itself O +[ O +2 O +] O +. O +In O +addition O +, O +structural B-Process +material I-Process +changes I-Process +resulting O +from O +neutron B-Process +irradiation I-Process +cause O +degradation O +in O +the O +heat O +exhaust O +capabilities O +of O +existing O +designs O +[ O +3 O +] O +and O +static B-Process +surfaces I-Process +can O +suffer O +severely O +from O +erosion O +due O +to O +impinging B-Material +plasma I-Material +particles I-Material +[ O +4,5 O +] O +. O +It O +is O +concluded O +that O +conventional O +concepts O +and O +materials O +for O +plasma B-Task +facing I-Task +components I-Task +( O +PFCs B-Task +) O +reach O +their O +limits O +in O +terms O +of O +material O +lifetime O +and O +power O +exhaust O +at O +approximately O +20MW O +/ O +m2 O +, O +which O +is O +presumably O +dramatically O +reduced O +to O +< O +10MW O +/ O +m2 O +due O +to O +neutron B-Material +damage O +in O +a O +D-T B-Material +reactor I-Material +[ O +6 O +] O +or O +even O +only O +half O +that O +value O +[ O +7 O +] O +. O +