cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc1pc9v6
title: CCDC 1560008: Experimental Crystal Structure Determination

description: Related Article: Lv-Bing Yuan, Yan-Ping He, Hai Xu, Jian Zhang|2017|J.Solid State Chem.|255|200|doi:10.1016/j.jssc.2017.08.024
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pc7kv
title: CCDC 1559937: Experimental Crystal Structure Determination

description: Related Article: Claudia Heindl, Eugenia Peresypkina, Alexander V. Virovets, Ivan S. Bushmarinov, Michael G. Medvedev, Barbara Krämer, Birger Dittrich, Manfred Scheer|2017|Angew.Chem.,Int.Ed.|56|13237|doi:10.1002/anie.201706756
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pc7lw
title: CCDC 1559938: Experimental Crystal Structure Determination

description: Related Article: Claudia Heindl, Eugenia Peresypkina, Alexander V. Virovets, Ivan S. Bushmarinov, Michael G. Medvedev, Barbara Krämer, Birger Dittrich, Manfred Scheer|2017|Angew.Chem.,Int.Ed.|56|13237|doi:10.1002/anie.201706756
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pc7mx
title: CCDC 1559939: Experimental Crystal Structure Determination

description: Related Article: Claudia Heindl, Eugenia Peresypkina, Alexander V. Virovets, Ivan S. Bushmarinov, Michael G. Medvedev, Barbara Krämer, Birger Dittrich, Manfred Scheer|2017|Angew.Chem.,Int.Ed.|56|13237|doi:10.1002/anie.201706756
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pc9zb
title: CCDC 1560012: Experimental Crystal Structure Determination

description: Related Article: Marijana Juric, Lidija Androš Dubraja, Damir Pajic, Filip Toric, Andrej Zorko, Andrew Ozarowski, Vito Despoja, William Lafargue-Dit-Hauret, Xavier Rocquefelte|2017|Inorg.Chem.|56|6879|doi:10.1021/acs.inorgchem.7b00181
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcb0d
title: CCDC 1560013: Experimental Crystal Structure Determination

description: Related Article: Lucia Tamborini, Federica Mastronardi, Leonardo Lo Presti, Birgitte Nielsen, Carlo De Micheli, Paola Conti, Andrea Pinto|2017|Chem. Sel.|2|10295|doi:10.1002/slct.201702154
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5281/zenodo.17430297
title: Coherent Optical Power Conversion via Plasmonically-Coupled Tunneling Rectennas: A Rigorous Non-Equilibrium Framework Bypassing Thermodynamic Limits

description: The Shockley–Queisser limit of 33.7% stems from incoherent photon absorption and thermal relaxation in bandgap-based photovoltaics. This work presents a complete, self-consistent theoretical framework for a coherent optical power converter based on a plasmonically-coupled tunneling rectenna that operates outside the detailed-balance paradigm. Solar radiation is modeled as a classical electromagnetic wave, eliminating thermalization losses by design. Full-wave Maxwell simulations (Ansys Lumerical FDTD 2024 R2.1) are coupled with non-equilibrium quantum transport via the Non-Equilibrium Green's Function method with self-consistent Born approximation (NEGF-SCBA). The model predicts a power conversion efficiency of 68.7 ± 0.5% at the maximum power point under AM1.5G illumination, bounded solely by quantified Ohmic, radiative, and inelastic losses—independent of bandgap, temperature, or spectral mismatch. This efficiency is the highest reported for single-junction solar energy conversion without multi-junction, hot-carrier, or intermediate-band mechanisms.

Keywords: optical rectenna, coherent conversion, Shockley-Queisser bypass, MIM diode, NEGF-SCBA, quantum coherence, thermodynamic limit, first-principles, material selection
DOI: 10.5281/zenodo.17436218
title: Coherent Optical Power Conversion via Plasmonically-Coupled Tunneling Rectennas: A Rigorous Non-Equilibrium Framework Bypassing Thermodynamic Limits

description: The Shockley–Queisser limit of 33.7% stems from incoherent photon absorption and thermal relaxation in bandgap-based photovoltaics. This work presents a complete, self-consistent theoretical framework for a coherent optical power converter based on a plasmonically-coupled tunneling rectenna that operates outside the detailed-balance paradigm. Solar radiation is modeled as a classical electromagnetic wave, eliminating thermalization losses by design. Full-wave Maxwell simulations (Ansys Lumerical FDTD 2024 R2.1) are coupled with non-equilibrium quantum transport via the Non-Equilibrium Green's Function method with self-consistent Born approximation (NEGF-SCBA). The model predicts a power conversion efficiency of 68.7 ± 0.5% at the maximum power point under AM1.5G illumination, bounded solely by quantified Ohmic, radiative, and inelastic losses—independent of bandgap, temperature, or spectral mismatch. This efficiency is the highest reported for single-junction solar energy conversion without multi-junction, hot-carrier, or intermediate-band mechanisms.

Keywords: optical rectenna, coherent conversion, Shockley-Queisser bypass, MIM diode, NEGF-SCBA, quantum coherence, thermodynamic limit, first-principles, material selection
DOI: 10.5517/ccdc.csd.cc1pcb1f
title: CCDC 1560014: Experimental Crystal Structure Determination

description: Related Article: Lucia Tamborini, Federica Mastronardi, Leonardo Lo Presti, Birgitte Nielsen, Carlo De Micheli, Paola Conti, Andrea Pinto|2017|Chem. Sel.|2|10295|doi:10.1002/slct.201702154
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1p44yx
title: CCDC 1553129: Experimental Crystal Structure Determination

description: Related Article: Aydın Aktaş, Duygu Barut Celepci, Yetkin Gök, Muhittin Aygün|2018|Chem. Sel.|3|10932|doi:10.1002/slct.201802519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcb2g
title: CSD 1560015: Experimental Crystal Structure Determination

description: Related Article: Dong Wang, Xin Wang, Yue Lu, Changsheng Song, Jie Pan, Chilin Li, Manling Sui, Wei Zhao, Fuqiang Huang|2017|J.Mater.Chem.A|5|22618|doi:10.1039/C7TA06447K
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcb7m
title: CCDC 1560020: Experimental Crystal Structure Determination

description: Related Article: Celine Bittner, Henrike Ehrhorn, Dirk Bockfeld, Kai Brandhorst, Matthias Tamm|2017|Organometallics|36|3398|doi:10.1021/acs.organomet.7b00519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcb8n
title: CCDC 1560021: Experimental Crystal Structure Determination

description: Related Article: Celine Bittner, Henrike Ehrhorn, Dirk Bockfeld, Kai Brandhorst, Matthias Tamm|2017|Organometallics|36|3398|doi:10.1021/acs.organomet.7b00519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.15468/dl.3bv2j8
title: Occurrence Download

description: A dataset containing 5688 species occurrences available in GBIF matching the query:
{
 "and" : [
 {
 "or" : [
 "PublishingCountry is Colombia",
 {
 "and" : [
 "Country is Colombia",
 {
 "not" : {
 "Issue" : [
 "is Country coordinate mismatch"
 ]
 }
 }
 ]
 }
 ]
 },
 {
 "and" : [
 "TaxonKey is one of (Aves [GBIF Backbone Taxonomy])",
 "StateProvince is one of (Chocó)",
 "PublishingOrg is one of (2a7e3080-28a9-11dd-97cd-b8a03c50a862)"
 ]
 }
 ]
}

 The dataset includes 5688 records from 7 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055175-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/ccdc.csd.cc1pcb9p
title: CCDC 1560022: Experimental Crystal Structure Determination

description: Related Article: Celine Bittner, Henrike Ehrhorn, Dirk Bockfeld, Kai Brandhorst, Matthias Tamm|2017|Organometallics|36|3398|doi:10.1021/acs.organomet.7b00519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbbq
title: CCDC 1560023: Experimental Crystal Structure Determination

description: Related Article: Celine Bittner, Henrike Ehrhorn, Dirk Bockfeld, Kai Brandhorst, Matthias Tamm|2017|Organometallics|36|3398|doi:10.1021/acs.organomet.7b00519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbcr
title: CCDC 1560024: Experimental Crystal Structure Determination

description: Related Article: Celine Bittner, Henrike Ehrhorn, Dirk Bockfeld, Kai Brandhorst, Matthias Tamm|2017|Organometallics|36|3398|doi:10.1021/acs.organomet.7b00519
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbds
title: CCDC 1560025: Experimental Crystal Structure Determination

description: Related Article: Pavel B. Tsitovich, Anjula M. Kosswattaarachchi, Matthew R. Crawley, Timothy Y. Tittiris, Timothy R. Cook, Janet R. Morrow|2017|Chem.-Eur.J.|23|15327|doi:10.1002/chem.201704381
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbft
title: CCDC 1560026: Experimental Crystal Structure Determination

description: Related Article: Gladis G. Zakirova, Dmitrii Yu. Mladentsev, Nataliya E. Borisova|2017|Tetrahedron Lett.|58|3415|doi:10.1016/j.tetlet.2017.07.055
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbhw
title: CCDC 1560028: Experimental Crystal Structure Determination

description: Related Article: C.M. Bateman, L.N. Zakharov, E.R. Abbey|2017|Acta Crystallogr.,Sect.E:Cryst.Commun.|73|1140|doi:10.1107/S2056989017009884
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1ks1r4
title: CCDC 1453086: Experimental Crystal Structure Determination

description: Related Article: J.N. Low, L.R. Gomes, A. Gaspar, F. Borges|2017|Acta Crystallogr.,Sect.E:Cryst.Commun.|73|1130|doi:10.1107/S2056989017009896
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1mxl59
title: CCDC 1517021: Experimental Crystal Structure Determination

description: Related Article: L.R. Gomes, J.N. Low, F. Cagide, F. Borges|2017|Acta Crystallogr.,Sect.E:Cryst.Commun.|73|1154|doi:10.1107/S2056989017009902
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcd9r
title: CCDC 1560084: Experimental Crystal Structure Determination

description: Related Article: L.R. Gomes, J.N. Low, F. Cagide, F. Borges|2017|Acta Crystallogr.,Sect.E:Cryst.Commun.|73|1154|doi:10.1107/S2056989017009902
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pc057
title: CCDC 1559708: Experimental Crystal Structure Determination

description: Related Article: Byoungmoo Kim,  Golo Storch,  Gourab Banerjee,  Brandon Q. Mercado,  Janelle Castillo-Lora,  Gary W. Brudvig,  James M. Mayer,  Scott J. Miller|2017|J.Am.Chem.Soc.|139|15239|doi:10.1021/jacs.7b09176
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbjx
title: CCDC 1560029: Experimental Crystal Structure Determination

description: Related Article: Danielle L. Widner,  Emily R. Robinson,  Alejandra B. Perez,  Herh G. Vang,  Rachel A. Thorson,  Zakarias L. Driscoll,  Sierra M. Giebel,  Calvin W. Berndt,  Eric Bosch,  Erin D. Speetzen and Nathan P. Bowling|2017|Eur.J.Org.Chem.|2017|5739|doi:10.1002/ejoc.201700969
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbm0
title: CCDC 1560032: Experimental Crystal Structure Determination

description: Related Article: Aleksandra Zydor, Richard J. Burford, Michael D. Fryzuk|2017|Organometallics|36|3564|doi:10.1021/acs.organomet.7b00487
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbn1
title: CCDC 1560033: Experimental Crystal Structure Determination

description: Related Article: Aleksandra Zydor, Richard J. Burford, Michael D. Fryzuk|2017|Organometallics|36|3564|doi:10.1021/acs.organomet.7b00487
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.15468/dl.nxppbb
title: Occurrence Download

description: A dataset containing 66855 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is United States of America",
 "GadmGid is USA.5_1",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "TaxonKey is Campylorhynchus brunneicapillus"
 ]
}

 The dataset includes 66855 records from 49 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055141-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/ccdc.csd.cc1pcbp2
title: CCDC 1560034: Experimental Crystal Structure Determination

description: Related Article: Jie Liu, Jorge R. Barrio, Nagichettiar Satyamurthy|2017|J.Fluorine Chem.|201|24|doi:10.1016/j.jfluchem.2017.08.007
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbq3
title: CCDC 1560035: Experimental Crystal Structure Determination

description: Related Article: Elvia Becerra-Martínez, Francisco Ayala-Mata, Pedro Velázquez-Ponce, Manuel E. Medina, Hugo A. Jiménez-Vazquez, Pedro Joseph-Nathan, L. Gerardo Zepeda|2017|Tetrahedron:Asymm.|28|1350|doi:10.1016/j.tetasy.2017.07.008
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcbr4
title: CCDC 1560036: Experimental Crystal Structure Determination

description: Related Article: S. Lahmidi, N. Abad, M. Boulhaoua, N.K. Sebbar, E.M. Essassi, J.T. Mague|2017|IUCrData|2|x170991|doi:10.1107/S2414314617009919
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.15468/dl.dqfz5h
title: Occurrence Download

description: A dataset containing 3531 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is Spain",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "TaxonKey is Gentiana lutea"
 ]
}

 The dataset includes 3531 records from 47 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055177-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/ccdc.csd.cc1pcbs5
title: CCDC 1560037: Experimental Crystal Structure Determination

description: Related Article: Elvia Becerra-Martínez, Francisco Ayala-Mata, Pedro Velázquez-Ponce, Manuel E. Medina, Hugo A. Jiménez-Vazquez, Pedro Joseph-Nathan, L. Gerardo Zepeda|2017|Tetrahedron:Asymm.|28|1350|doi:10.1016/j.tetasy.2017.07.008
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc1pcdq5
title: CCDC 1560097: Experimental Crystal Structure Determination

description: Related Article: Calynn E. Morrison, Fudong Wang, Nigam P. Rath, Brian M. Wieliczka, Richard A. Loomis, William E. Buhro|2017|Inorg.Chem.|56|12920|doi:10.1021/acs.inorgchem.7b01711
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.