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[
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PO_1002379093628049241089565 | 10023790936280492410895652972838079647441223987921280890913988111608273206740955424472698604747149221118553719312760388456034675558296361558299496258606258 | 2025-04-16T20:57:06 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -41.591282 | [
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PO_1002404915533630457857133 | 10024049155336304578571336346794923869286870886050397955705402829738503582732537186287430834870904916445489508642393672125801403602403731005732369007980357 | 2025-04-16T21:29:37 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -52.330845 | [
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PO_4917875140385752256279196 | 4917875140385752256279196708150814011794575683980580547279924807685194264121693839444742559736524097975675680906031676848803733826825125096134363489983159 | 2025-04-17T18:48:22 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -55.641001 | [
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PO_4917254314392520184428105 | 4917254314392520184428105000117852248153908516943152794387279745246456008501499260210748086068383493445681809260087479576403482929069955014598394801780921 | 2025-04-16T18:55:10 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -14.3369 | [
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79,
79,
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0,
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4916948021512828627203694 | 4916948021512828627203694119131151484972544692946482050426398145153401357343749822075199803854431678563206510804859084532641693509923438970690120535239625 | 2025-04-16T17:55:48 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -60.455412 | [
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4916404301326210863741343 | 4916404301326210863741343882085687593641465309316971521893460723007056040805659220308713795155354508584778633524103249917584230291109023483016688153999106 | 2025-04-16T18:28:24 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -32.611786 | [
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PO_4919741175108247874972075 | 491974117510824787497207510828264507330685718952285860815863985831223265957559559584565677566283856784065902899348838268160411244974462485364166268050785 | 2025-04-16T15:44:32 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -59.928693 | [
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[... | [
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PO_4918998342925182057557877 | 4918998342925182057557877606281952405051182372605860742944322976643422466239999215174325174561287485863047272895573632221836230411420917382965337328311612 | 2025-04-16T22:04:30 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -110.699343 | [
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PO_4918506030557925438078493 | 491850603055792543807849373269312852496599027090970852215538926368628378169768986322009029089297388113819997919926158246673648273884038637603006624312108 | 2025-04-16T15:45:08 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -15.53346 | [
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PO_4918908006886511032472688 | 4918908006886511032472688333924744687456026017630944063093216598559023290329284057366451932384614784173265921608489244068596392986636205413768504095319117 | 2025-04-16T20:09:34 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -35.333153 | [
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PO_4923900348603376037843256 | 4923900348603376037843256024552833870833161882371516202434354219402780151308021439464215153143467335344534893248475004665395965171027223296079091685797102 | 2025-04-16T20:58:52 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -20.994576 | [
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PO_4910859896117919626873944 | 4910859896117919626873944284855332283469627747910265613041169309420829950391964030708079096010172757334564517268862019811000005874788120729385474710739014 | 2025-04-16T21:12:08 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | 85.057922 | [
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PO_4902879184588641405623128 | 4902879184588641405623128894056935597540421042620818841865472003146794302628395798796499406780755176459806975041418652202773317232540314726252388437694110 | 2025-04-16T16:47:26 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -54.687999 | [
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PO_4906959570305743398626404 | 4906959570305743398626404007119255289257713984327086228693697142686014169635146652310606544688965326995361344622229936553591989857826473573184404980311033 | 2025-04-16T17:41:23 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -61.385916 | [
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PO_4906325500911676607717341 | 4906325500911676607717341281572838861351347124100314470459019753844056276782061796988519972475275674881128520992213167766563337280736149924269267383794335 | 2025-04-16T17:06:11 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -43.493198 | [
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PO_4906517377411199262368843 | 4906517377411199262368843265425809961252277588446867426642352327308742448394909298844734490297987107690328072465328643317612468333624900195388377675683949 | 2025-04-16T21:23:51 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -43.413765 | [
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PO_4906709399006827754154607 | 4906709399006827754154607097722902221229681961445045779667841538528931845889543190580764670448253705902495396329081914968986120959499482295523076686169743 | 2025-04-16T16:04:42 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -102.23105 | [
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
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PO_4908960553661868021639501 | 4908960553661868021639501457015626305602012007977403342349087162651565378924672249509673034131280662726316711960925408194724151833223988208970949848955380 | 2025-04-16T21:37:17 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -85.606087 | [
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PO_4915556524976770126019265 | 4915556524976770126019265276109757037317286540385548549951520435730274368041933033938913592728643283585072406821980002766484043275093196091066376321310812 | 2025-04-16T20:33:21 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -51.285172 | [
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... | [
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PO_4922159882748117633311170 | 4922159882748117633311170869580049203932786216899650576295810258603802540105666466047595393481867881680185936293670329113268986984487966278903096138579369 | 2025-04-16T17:55:11 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -60.451238 | [
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[
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PO_4922780058752608881151969 | 4922780058752608881151969633872095044977540859900018296007407131741513209746670059088277762178502794304816562566686206974671186227167916939563569152703021 | 2025-04-16T20:52:57 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | 70.356323 | [
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[
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PO_4922339276225057357480793 | 4922339276225057357480793830591645930692171218903144297894341801121002748965883675704865946940923820383030597055292086859523390719671810669162401172783614 | 2025-04-16T21:27:46 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -118.545456 | [
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"data.000_set.000_14"
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PO_4924039157647164054604229 | 4924039157647164054604229162759992916922241979168076816336535278549737966889567591984839814348081393834895297562854567356271817705286442769196542721466298 | 2025-04-16T21:43:16 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -16.878929 | [
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PO_4924212609873928811814433 | 4924212609873928811814433942363706876510338206620293688203121825418205918848801514993877756549696527510038758723582796877332317017311107249645876912407317 | 2025-04-16T21:21:56 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -60.031982 | [
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[
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PO_4924909293007770644603506 | 4924909293007770644603506326250120892893954642497170948033755696630211606663390890308064071873139918523165454466342984418870909285388117197765181577114524 | 2025-04-16T21:52:07 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -55.405431 | [
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4924481073450278382679684 | 4924481073450278382679684677265316178129576036096445750623445434571338167750833418332280824839765867780699712441126642426017152361932152524402811794095191 | 2025-04-16T18:53:17 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -49.269421 | [
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[
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4924287953009971414407358 | 4924287953009971414407358932135973426780977939898528399390373108969296490162693549743779887450055209530543236693687034729157315720605243789937098973850433 | 2025-04-16T21:09:01 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -88.473442 | [
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[
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true
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"data.002_set.000_49"
] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4921986726597091209269588 | 4921986726597091209269588556497228321180270605899336308923408187680437347457779610156392621319493623557247369908441834481954542898715362405791320398005276 | 2025-04-16T17:45:49 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -21.562196 | [
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... | [
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1
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79,
79,
79
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PO_4921682913109938226552325 | 4921682913109938226552325019064986077585933844243114764300437344654167288661775109596798550025399580935028478427725675192952571745158145806811121147763498 | 2025-04-16T18:33:20 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -61.796216 | [
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PO_4921450214938027196934630 | 4921450214938027196934630895411594734554320008930960958251252259664747722151695310444022102454165049864668870147655264799371041054500616727442372559848249 | 2025-04-16T20:19:02 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | 47.863487 | [
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PO_4925126759755835129607113 | 4925126759755835129607113911260753029463783224841512858186862186039302575174423253602159885555654123627362130125284342923386189850471267023170030048197787 | 2025-04-16T20:33:21 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -44.363734 | [
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PO_4925143752957302711870914 | 4925143752957302711870914932020917406495913843959592464178784097436468803194265302248782134102763641578260395836170141461113852423482658310883335652944091 | 2025-04-16T21:12:08 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -51.958112 | [
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79,
79,
79,
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PO_4929599711363751410274037 | 4929599711363751410274037286823230075175226932224714407804626452645842784740832245533855420608164540070437052832086730877240938783189290846292485692523214 | 2025-04-16T18:28:43 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -13.745319 | [
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... | [
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1
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79,
79,
79,
79,
79,
79
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0,
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4929497388883299952383725 | 4929497388883299952383725150394086682642693520446937516032323127774326539494469191117718235032630498810440537710048594443009350033762562304323982534686657 | 2025-04-16T20:22:27 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -35.742046 | [
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... | [
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1
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79,
79,
79,
79,
79,
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79,
79,
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] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4928914272470959487397005 | 492891427247095948739700506052178705751932066641934612050525219642434860965603862296565536271968969591980783348145979665340900287302064657818085052394180 | 2025-04-16T21:13:01 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -29.69169 | [
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PO_4928606595360668257413319 | 4928606595360668257413319968126588731423702033173857359666767367036852550422968776741230498801218795217255843368517898132508097850763797961806764444454128 | 2025-04-16T21:56:50 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -51.180859 | [
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[
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"deepmd_set.000_241"
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PO_4928341127332073070290307 | 4928341127332073070290307985639931565374260960886312930828326861570706510806412353374107818605059080544713388504306482688649629846184765599757674080186032 | 2025-04-16T20:21:52 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -44.181262 | [
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[
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true,
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79,
79,
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"data.026_set.000_92"
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PO_4938628321945744872488967 | 4938628321945744872488967800281125912411166438451198872901769615854817422022397711005689421744761205792779176972150314162274247600145451793677863126507860 | 2025-04-16T18:29:13 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -96.972862 | [
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[
5.9... | [
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"deepmd_set.000_735"
] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4938701049433733612755752 | 4938701049433733612755752368456300563588083750846081990903343394320651118192311419065025621524773343952711148615426895062363349104247790077019733966956281 | 2025-04-16T18:47:35 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -23.407307 | [
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[
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true,
true,
true
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1
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79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
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] | 16 | 1 | 0 | [
0,
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"deepmd_set.000_190"
] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4938123098155055821884211 | 4938123098155055821884211079321751638849072112822617713666413203359091705763934515946060641576362230019732155614876989259673507892044135408480265200846683 | 2025-04-16T16:10:10 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -60.303301 | [
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[
... | [
true,
true,
true
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1
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79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79
] | 16 | 1 | 0 | [
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"data.008_set.000_60"
] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_4927630777267027738177563 | 4927630777267027738177563016911689416465853083337270061578194417382251396266921022845644877667983754238752566674447079348271757219546544196559835659697137 | 2025-04-16T15:42:40 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -97.400299 | [
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[
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[
0.... | [
true,
true,
true
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1
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"data.001_set.000_0"
] | null | data/MD/4240/MD_9985399391223336507104240.json | null | null | null | {"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"} |
PO_1002496949347833180332001 | 10024969493478331803320018180289634785913937429500925601563192085546986085703864559866759752149928257221912886013639573695140851074232893901092599345391191 | 2025-04-16T18:24:30 | DS_tydu7u0h0hhz_0 | 1 | VASP, DP-GEN | DFT-PBE-D3 | -16.78344 | [
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[
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[
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[
... | [
true,
true,
true
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1
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79,
79,
79,
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79,
79,
79,
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