property_id string | property_hash string | last_modified timestamp[us] | dataset_id string | multiplicity int32 | software string | method string | energy float64 | atomic_forces list | cauchy_stress list | cauchy_stress_volume_normalized bool | electronic_band_gap float64 | electronic_band_gap_type string | formation_energy float64 | adsorption_energy float64 | atomization_energy float64 | max_force_norm float64 | mean_force_norm float64 | energy_above_hull float64 | configuration_id string | configuration_hash string | structure_hash string | cell list | positions list | pbc list | chemical_formula_hill string | chemical_formula_reduced string | chemical_formula_anonymous string | elements list | elements_ratios list | atomic_numbers list | nsites int32 | nelements int32 | nperiodic_dimensions int32 | dimension_types list | names list | labels list | property_metadata_path string | configuration_metadata_path string | hash string | configuration_metadata string | property_metadata string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
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PO_1001701203356469477139328 | 10017012033564694771393285459647917881950748166975681529007249957947119109418283312762071476051899792878134780716958435635755316772310428805958740987370582 | 2025-07-10T09:38:18 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | 0 | unknown | null | null | null | null | null | 0.032107 | CO_3200026450236883161923721 | 3200026450236883161923721046565455669645664498517111323509185408127462979723485975874863741925175661138239064740828685971486057939442751719645498026034201 | 9919461551980591185402214161740531224081576662021094444575327772656662260516277109025260740053032892936716405660555613118845720872884388273275446852049461 | [
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PO_1001731014178223184981494 | 10017310141782231849814942475682919720474220220158152936032538799303927210538414621185191315014988766616719161688371246435854364009480002322749353761912350 | 2025-07-10T09:42:51 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.057565 | CO_1171193466416954704097562 | 11711934664169547040975620941927427672227370098947396801005034243961547757370038922705245233610054434958125843236200142853014993465944447239813411777389745 | 8214711312271807055389965878297491829280234256516710567934688681657809338296009954386990450523034458577854741620897915284257238126081738364895660528914475 | [
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PO_1001709190847914964424218 | 10017091908479149644242181245225732930314745283409005289665333984900416818716498775189100046146870125119932355558655925298261853618725274539797500896230983 | 2025-07-10T09:08:30 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.01848 | CO_8555185242988397006571495 | 8555185242988397006571495272225725016851815799303055740035361945742683689375522479558693189106910930206490170283684435320391054543557104145241692860684572 | 7166191181939513925001917242854340339457493214294957179621906561003929573996653811632128228275935479394111386231598230782052680383819266734363392404787884 | [
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[
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PO_1001720433588251614106877 | 10017204335882516141068778190178726639425388155642332507572844851531018020356055880167610578938363068476047602311750317019407835005280615564127063151898159 | 2025-07-10T09:22:10 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.029356 | CO_7776985785813234457174639 | 7776985785813234457174639946339659199839564466533366641289859517822520067470964656539034799804763748978399553659157917796590063025930185587351811287757925 | 10283894808955060049051045265079602076910686503490629002620168103160950667041178014378816700732577700120908272873709846219071926520682745049605966947882326 | [
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PO_1001727206358107355384384 | 10017272063581073553843842523810481940769025592119879432465665420369047641473121254005590028050644238261484672789278475876462895772945485455125411036275726 | 2025-07-10T09:22:51 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | 0 | unknown | null | null | null | null | null | 0.013648 | CO_4257002527008819050512322 | 4257002527008819050512322843299973221200214089286577085814630173966882605041448630565591107634351119005888820361868643235348307506607685360131063173920166 | 4650231757152037036312387973718098437432605961592166856676551713165760449105259902014449955277359368890180292084335607427806640963029387790689792997754503 | [
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PO_1001725609691398682005505 | 10017256096913986820055052440571009052579087208132029985646325433091634797067309786790414537156767523464807843601966197408084878610776318530228830718741630 | 2025-07-10T08:45:31 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.071567 | CO_1044517464712108737057049 | 10445174647121087370570498958658207401776046415670879845172614144619203522658640757353550314868618343858598992899812250579112592934197988971745635558928978 | 1324153948185226240917620373449598912756501205755879688515914390379713923895659618426654239137386675741637848343852395147175106017233284137781644995313258 | [
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PO_1001758487117295656226563 | 10017584871172956562265638079474542981513866677533625575559270157819506702535685129290181023372911426962506026821787484122296518377319492903083897725332044 | 2025-07-10T08:45:31 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.018169 | CO_1280464349099713240841890 | 12804643490997132408418902851991187990758682470568524836331989527529447969450385503266297689804840599824246957059580966904821338926191854904661452971892694 | 5664444740108912130391804343305417737064181599898185766448273949413398705300517814483595749015957275009254371859284237209248482236011283933025894578896440 | [
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[
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PO_1001711700813083828574502 | 10017117008130838285745025674945460018587018517739616772387993113148718749795771648896902919038447734715980836801778324384600602217967696318661924233469444 | 2025-07-10T08:48:43 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.071685 | CO_1024956998414618224806804 | 10249569984146182248068046421259686957186969864481379584331850267566353908008996528868866047619308611457065767581348772999175521210961832898878463042192274 | 11158384891037380043059443654226491701107921529620195688709894934831748611428478806596698555053013766502888730311396258890365544725680548975428571542019024 | [
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PO_1001707195924971028450456 | 10017071959249710284504564991204064800666973929186725174158859177084116202506405887703288949444968350283039027994183095655951954810054935287817175814510148 | 2025-07-10T08:52:46 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.036056 | CO_1287636546943825252090268 | 1287636546943825252090268547920149147012965120509911809458471111784222047184132468740218903277526892725453440337320173422724096600780208744300473533513466 | 12524474750293416339938587296417290802160769689466475950194160058145208093795003724434497762392201185499028259705893672333255603683428595050934313557740813 | [
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PO_1001744108774637978813704 | 1001744108774637978813704103605618525666253651873684042876529578342173787262126667073212663536380530475265090445515890719201911913784974528804951119685967 | 2025-07-10T08:52:46 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.043526 | CO_7559571691734347095539613 | 7559571691734347095539613476595783951370924799439272632243716121970970231625607791656833638975305380850146612992308735963594442138044235881063528427001903 | 5681047843179478468344386028973510761690271862081689702725883847488410036953313364529994726149956185827525631923882617766720841401042259732248054594157354 | [
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PO_1001739606422133133524510 | 10017396064221331335245102472242614050420673313922495460662728394036239846024373542564694242024498003850986002053803173894512930850826485135641464806119660 | 2025-07-10T09:00:06 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.09581 | CO_5300574653532007259299837 | 5300574653532007259299837609486700536475886170428280395073445811466604310369161570694041007315431338640236260096111643817728675135381639767661056489497307 | 11529710647459233310344473171783499397248877885672701673964604593495463495307705458125068056282972559344517451509593021935713503832538377951645242996725478 | [
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true
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62,
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PO_1001763543208717250968288 | 10017635432087172509682881277681741690330068949712664554627325458162180938997745854894331274294379756633725493739331520076699534948444421122330927978085764 | 2025-07-10T09:03:45 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.05671 | CO_1941016990602495496796906 | 1941016990602495496796906833087382756816236604069050299844255498274774782700068747143296174889552322733718054661684681413830723995300119339776564216763331 | 4982042648035601558070777282017172524073500829155719408122781246573330620521204092915228948993560852239244756534472062940144291294543227571531777896496576 | [
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PO_1001771823439596936713486 | 10017718234395969367134862165028274721741053040509509172399689016197857238651493761989041797597395561470683031081589640469002938203904816584165677848176675 | 2025-07-10T09:03:47 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.06925 | CO_3710187372403167319976912 | 371018737240316731997691242405975089628646755968563687257187745775696047399815486797911311833116511474556034773519832060028068456770121646055654105282543 | 6168409357232322590060171063832078658748484712017754053152195757314982109145374976156020393767313412590112012264791268970903937960436978618322895460693095 | [
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PO_1001731340495877745577923 | 10017313404958777455779230467271389116003330897635453724926109070030825263189446929850787052065408021301625805373599580207075718438157485204257729669462756 | 2025-07-10T09:07:33 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.010001 | CO_9793776683574848063906782 | 9793776683574848063906782230718213479521275825301774930619464924117299122063318672865538311918322931891586267520356130768595545363109703772048485544647480 | 7794417053610602336223372172713552797296484235791645263127754965516625036441729039079676830771588494729117548369068992648683780313932819352922863352039780 | [
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PO_1001752389098695059441592 | 10017523890986950594415923261088105502874517041375288315234479149716172907491163459086260145082036543023104449687063898488245900153411328806049122139771450 | 2025-07-10T11:10:41 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.085762 | CO_1296779011527612775746101 | 12967790115276127757461010701778298595463164302215523879342934161012853282628051366608520249879296781017372494522999699377833689146366021676588139668578443 | 2133263260046278794071737332920326238503586614661790909893781630499754236447805208145387681105585115520051123139478796288235218359353574121834837830928678 | [
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true
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PO_1001776004535556062972211 | 10017760045355560629722119874346318432424963982905036060195453469263033801711970982549388204347768692891642968570626449433038998095995187077904348335833340 | 2025-07-10T11:23:06 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.00604 | CO_4718193947939562834916222 | 4718193947939562834916222851600269009103928040192066667095711454915270238559715290462582159187549735908081364008068998774390553422749725826285345144224704 | 9667200775508831759751003357053429430513131031823070970171919976553500435105112529586867212705408101080880685892693955236131769044681648103154929298504876 | [
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[
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PO_1001765262023319519938778 | 10017652620233195199387786437411078986588897854096222283893255622974613132990211849950799411678984832621379788313911997325124184666502153571967332576413348 | 2025-07-10T10:51:52 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.020258 | CO_8516914051360854103634016 | 851691405136085410363401640759320139459489535237935078607354798414018842675565373446609450731338897932282371619496211449183611534080252918124321576587806 | 4577132951908595161232842746152057727048781409327552211957736878236545871077325018815974357773953186354799926833382326567643727546794898777495839542152377 | [
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PO_1001716480736284657939097 | 10017164807362846579390976730169982268168222910963389624930516969954114525804888844602900153128244913168705378336627255238411378132957989211359256628751562 | 2025-07-10T10:54:58 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.091545 | CO_2218200984441479692229639 | 2218200984441479692229639485827084430853048944777366388210004302058488980061576807563462044627890839172306620053153508486306039299724183979230249754913081 | 6603661742733222047961031023664283771919567940436587451999660437313422970318731389449183787763118404302141537817808164850039168310378948172609135050667341 | [
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PO_1001706620258962199596325 | 10017066202589621995963255641796186910663422916760965974670258768409007733440742233579383869125273540263573116299437783907861889512755639374527991365144906 | 2025-07-10T10:58:06 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.000155 | CO_8236117905819201526727010 | 8236117905819201526727010954685217101574479510454115755014651084997102464492469992905575306233759923660888970967673549173513641370875917270243933741601616 | 2365268805876376139699712687744992190963865567252239946233959791869810827802010569621445369482913043187630408182521040861195564072572082775078359631759515 | [
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PO_1001746923613002664569302 | 10017469236130026645693029152714077780766197863013643052687696781217423116442477276593539750922516350409214787151325221950488839922610215743557431606242270 | 2025-07-10T11:01:27 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.085192 | CO_9183763580923272619149810 | 9183763580923272619149810820281360500268235543399271108685283549411004280247982198046986248714246986404750339244618665604292614001875778225839615448701509 | 9148296804144180266386122622016397410399020100700777892382999494933524182703870161487624091352724139902117223225328419357236889888860930441427554890109965 | [
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PO_1001786031169764324547377 | 10017860311697643245473772041237319198882739613130719056405865080640050097849582757119543482394704127654839665557040196215179490683349221052053371890277073 | 2025-07-10T10:05:38 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.050585 | CO_6070378892394240046499935 | 6070378892394240046499935385811157199961721919723679993222496907461544246310439169526370534901160397274927409632694946445299700715425149370868667298191372 | 7597571960159516548001393644264726172260615474867512198962856536662261480388977380070516825650258997313461350130341549098209240934157094202014664935819726 | [
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PO_1001705380979558297250686 | 1001705380979558297250686472686360355188221415553148078090949860459528271726744325826938218459580101836585393440804627160687985070441720537900837157865707 | 2025-07-10T10:16:53 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.050028 | CO_1003280457347519478330859 | 10032804573475194783308598520769953070738609090900200283743618812498173562727273566699557919161777108854907525659110557785105107891119576519095459830969770 | 8215967565463796306552383057975813513244828079176672797151708930440638315249773804682454851156832535327944112671534840936519516230625792664949515156637331 | [
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PO_1001705493485862670848378 | 10017054934858626708483785534470913552117569511571519130893154965525230956449411028389613872697115233588352089395476006261999524041899556726193834020208110 | 2025-07-10T10:20:35 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.049283 | CO_5068193808533259708691931 | 5068193808533259708691931266239737175691502366514270107725722066473680335445956055500373000357084269484205752949649176934731241673101649262598942371579277 | 9740865653596955491130878568300262614811203724487731165276977220582081059379312866271437488857246837304837072219838810730269217560809996437364838361314685 | [
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PO_1001768481627314975952813 | 10017684816273149759528133689599684069810628605645562346206207872960511749689263664149635825998163855047238812983537221470137430284308762746295175371246105 | 2025-07-10T09:44:19 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.019122 | CO_2018734695574469415805875 | 2018734695574469415805875837764225657591429356034245298845703151849410606348996995323398092335202860170051684062102389770041567956078049514839186737913786 | 12731498367429536922262351275250640871309016025705357947855004265360795797551660327195608180015673548768829778587246481731220753442593207668395012998580564 | [
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PO_1001789653979855787736321 | 10017896539798557877363211829164358525783315066346492731813746111540368452861351290188857447137144935944930446095433713767362071215986052374818212564352279 | 2025-07-10T09:54:14 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.090228 | CO_8588385125237677068511290 | 858838512523767706851129010448806952840184005856044236476002661299102712382187410024095173080481908298255843750009197254515135048414687480465614799910243 | 4949467776164404941516056260111230069135918615878579045509275869080938937180933624487260345226019589015342916276687657615548039871147058169536663650931777 | [
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PO_1001718794971748250383510 | 10017187949717482503835109293512314664289997419687853651962548810253932891543416354024484480350003606447396119641145061503018520033312698036736886193993828 | 2025-07-10T09:57:59 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.00699 | CO_9907888365993456535097340 | 9907888365993456535097340616556132371241163179242432758622948654782066547997809571340065391060620684830926398693192489890283226738087283157212511440166183 | 12316881282585981952520083674643206582770995364367163493043865350083639867699582842639834055126365940634353742341103991265660357126746508950801296112984835 | [
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PO_1001766439534742025041666 | 10017664395347420250416662617889464424784091928892210478933917053500805886913533705304457210641714749436235527148127317077218456340625182887815153913120785 | 2025-07-10T10:22:31 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.037167 | CO_9743515377984788546735392 | 9743515377984788546735392276435781211400937259011979539179154961745313989057138635893144816094157258287943556016410319671817598557593156422152719734161976 | 4263262437766058489210196357560811258143997383611026281409685499597824131997218144987654868907920783475635714101195704556608097930548647821968771702765963 | [
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PO_1001999302294055345050010 | 10019993022940553450500106156986093254373538877648237252551963784313256224251069984617249855844621214543818052945934505609723583730357356331510844180305599 | 2025-07-10T09:27:10 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0 | CO_2983412417469869921172461 | 2983412417469869921172461437466547573925357980075919685480909799116537410227245500532672430441521104290217371037408728291855192181049188358219611360306670 | 9685520661959983556763897137610527938799100401578980962550631873785319886699922312805128981096335929652320502514900017321131035231826391435925870944175363 | [
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PO_1001954967314783755242901 | 1001954967314783755242901829521865490662661040360539917430539040854226090313302967136394621528396160143020518204021231773212562400789796983171663987706005 | 2025-07-10T09:38:15 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.023222 | CO_1194383613886769893283651 | 11943836138867698932836513498979146272490161478797754352962058037759629955436533304758598138866584775027746928717452665503631463462526950309867382323276772 | 6330260059154601490530164555875320857543731397320506321837778030419492364195509789005402509029212936534620516888477360665191867154188259623898937720559201 | [
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PO_1001920036041573299659434 | 10019200360415732996594347228518492693089935531275799667526734344775617222213736884339534433670180461268692518452522824631650237526841782538283834439020239 | 2025-07-10T09:38:17 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.064571 | CO_1066703308393746308582639 | 1066703308393746308582639340588593472963477524091628451080993095857834289389187846706045629569182695380290976809342342984856014745026696259801434732080261 | 6925699787118900900124954630705439982102918416334087065874589293933599273468037549945757461112667397271570511226401426718176822564674065134861985702105139 | [
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PO_1001931128926567390293739 | 10019311289265673902937390522645845227873632642910909660715943826939893724007009592301183347223464757230717326171773796828616085776205176103917376317129691 | 2025-07-10T09:42:51 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | 2.5475 | unknown | null | null | null | null | null | 0.057381 | CO_3666452586405427389713849 | 3666452586405427389713849558802868186841259234576011735555147298401780411593620940947667070805643925811604490011057875094390431191562087886885639799488854 | 3704165206656982698808710122288682205041711169289109844227267492768189215413510355074532520931936722757657278186448201860280679347626752422244528796100714 | [
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PO_1001964707175943678470406 | 10019647071759436784704069875977277283010357059418704512578525960372892795915479240258183422218460370497832795479562514851481557997408646919041809419463702 | 2025-07-10T09:42:53 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.004046 | CO_9873422690312833194923541 | 9873422690312833194923541180198202835310703699091662268294169856278296298649885854669150643782065013486149584515372064671254739178342517719084986427832261 | 1439106174876692159225643817298018360870435864556170837304279747325234577971813546605005480081968089509903878266544462540418908144519945670943862307464469 | [
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PO_1001944029110009373820328 | 10019440291100093738203281857665621394076443897894417919727350237929682520777503770542120237886261585370687096564842145903538922613213977431239690927619837 | 2025-07-10T09:42:54 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.021862 | CO_1626266624656720499822939 | 1626266624656720499822939834741689635365713395966819599881629109952486209291039387332839574744010743967749811380219472365822482922541327180810848571023947 | 11926759938580818517006752997522870064341266221099390842668873918880970228160466223242983699705096725464142469196086176628600590890434916640390221170981894 | [
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PO_1001927872137948836576365 | 10019278721379488365763653903934167266374106672271765620265980810669734530915931684202625944611578844836032725681542149819770465139435648182202657872403590 | 2025-07-10T09:42:54 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.017024 | CO_7500369503496747847117548 | 7500369503496747847117548991726634666949992878423222114844264947963228170027468817679742003454004253338264488346815651366181356760075058124116528110839140 | 11478388501712792317383504137013437182183546917728250751116938091493616989328975360032695732933159000612061471660190887823647747695575113172670022008267047 | [
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PO_1001995158354913770965067 | 10019951583549137709650671184688903255241619149703534816011827545380987194942913156298991165445126754779425856527112674829773378463266001936725464131931471 | 2025-07-10T09:08:30 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.03295 | CO_5573439537187264206039021 | 5573439537187264206039021497670555578801043350966890366022864045841002312329567651395940928898607750210387624186914582380695698766182331732929407242193757 | 2043270930928824645158493001531608539973837332381870434311868262825016111354527065180431569848922703168835784158843859391271540269458953118368259010984724 | [
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PO_1001936293407493766751582 | 10019362934074937667515823368482671557717166812282172686810111159261052855371785894478485745231066009656345131215381121119566825739285856726126538497733612 | 2025-07-10T09:15:43 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.032478 | CO_1236675706772233611731691 | 12366757067722336117316916772813456727030586375065283608378131676846682956345041007742946927942397934157703555484995763282855205911927919154460630663427783 | 7696009890419387129022479650551542108531452461009413759860819483954405220066621334143307648102254682606371222760113396978627204564812189987661827886431911 | [
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PO_1001980316503899827073743 | 10019803165038998270737438968234083387663201313713704377365456546932373320667179445427603967612636053897029534767722287564292090017342075680222693710112069 | 2025-07-10T09:15:43 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.038406 | CO_1150699788365873233609976 | 11506997883658732336099763207763944630987967048674602417533799916790083246160113943579870690409032305388306793171037191357085466547870820327113281385666921 | 1665628215428926417499290044773016769239474344946228442192628754950667170265045713904113806894106377196742607757411318694339409249442002668038700803649776 | [
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[
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PO_1001919735795549563660264 | 10019197357955495636602645922018123888477673743729737361705861253197344457433589074751017792085556676755703249244228279952002157222398654477747908791843837 | 2025-07-10T09:15:46 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.038921 | CO_2173469356829668867921725 | 2173469356829668867921725607991668658106867285413927221367374216896824795361879063904762451536859527399691108813197839432177653896614431766866132564394104 | 4418024330353626694814686645282433980187675423341984997143866718718097906794224061933274761300565488169098116728295081456514473999560969555669645260017294 | [
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PO_1001959356345197101611780 | 1001959356345197101611780819096275243600459460009353966521844632765537073700631245985547597416934284467455913608596703591006551356201904451068067513871682 | 2025-07-10T09:19:28 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.002821 | CO_1309532717296590429030691 | 13095327172965904290306918834188858561279885965515668524460729835824598548286898410494637775509004669604879461160912845890465495495190114804947602771085159 | 10561945895257904458260812885427833239675845631743629107878922080551869614159216000194613369015129250561426248494925774707981581454254476201879320626426990 | [
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PO_1001901704673402647410985 | 10019017046734026474109852224315640563411214827782787856433632682336885734368940429620592834678788464597562921588843404860395674187650295010651805177888835 | 2025-07-10T09:19:29 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.001076 | CO_4208588117961712161347266 | 4208588117961712161347266250444799743627135797014937423562835887624749554952253438911606434031690876503799615096220510674188369989278027449392780978401127 | 6525299023993804214096242484249941270982241646517721477963513469140459630823532190274009609244874638096960906075556894482881412897698408679003732625374640 | [
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PO_1001997270568489030845433 | 10019972705684890308454331084504767975147534411975530989257654395906975500238625480070537102485488250199775619489285732337711234551639928312921707871266448 | 2025-07-10T11:01:25 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.088217 | CO_2498101215318173941165162 | 2498101215318173941165162815551322806282302450990116263357715428842849050998420852204607758961092494514951623038759934542530748978147329431355504347003170 | 3426826525466561429468467756197369869832870278207780079312986078577499143968026229908759841439118622961065832441052804992689147690276759638422535759610088 | [
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PO_1001943807349559439969759 | 10019438073495594399697590013233809018812303418290816320891987640489325694367130329013955751132190469155204579847499872547973473533417631265362787116236702 | 2025-07-10T11:03:45 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.029736 | CO_4930886047278685522754649 | 493088604727868552275464993696467731845071235959682437139349761816717935024456425607774837701955948730333154448782544692073156927164587391874865658635876 | 11410434149912801535619504172635553637281190821286756617311514278803283983815928957491900699312718940727294338485915206537136072718858454877381766449043525 | [
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[
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PO_1001989903319492482427919 | 10019899033194924824279190691557565194794811240184417502957445486565051900487728525833918268527820135104043779830647126866644984835193867759481048987116654 | 2025-07-10T10:05:38 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0 | CO_6737624004913241560815248 | 6737624004913241560815248050413066330581194863128454284894974693796149040911681554119299861693716888218039023133563753474948335648071729000807671749114661 | 12472897679530354672637653073173920135328408865888620364259609982747070963753310801124967852602337772058325299844663611045145869473512975806502721332467950 | [
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71,
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PO_1001997415716531986025723 | 10019974157165319860257238388967122513470115628410721365181757985437834196379590032325045832239557368470829616396242238880191203859904577177355392005359894 | 2025-07-10T10:09:55 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.028976 | CO_3798541190889239893295709 | 3798541190889239893295709785808484763247523247588900105687927090271847021507800358614589920018737054479400231187617138078901155875846885530285870809130427 | 744049369205210368721753227841754314073436683009021991269523583910339532363197155595477399970411982537035404725473216973298620528038445035471645666795110 | [
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PO_1001931513934010082051264 | 10019315139340100820512641196584685010130066786846670026547387360924911121730622231591540328726962511857463949792754466884160258579920456882591675734936960 | 2025-07-10T10:16:55 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.048267 | CO_6915314345714895696401061 | 6915314345714895696401061443154440798501802478279719757700920306003333728844531785899784043814954456209524298302845064368334817165616766902818267267516912 | 2570574167378199576313081280780969732843623825700290449822128316287721407946729663504245122363531403983547758719219297575843126136402941849880284529664772 | [
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[
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true
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PO_1001934416110068695807319 | 10019344161100686958073192626613473238938086056682663979448642603840460101824784133190612629607220062656579067774796102061318232029637413401433891489558176 | 2025-07-10T10:20:36 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.089969 | CO_1065374815908008911054818 | 10653748159080089110548182689856089941797301190966416596679303216612153113172614783224172386893673472970029701051148031501681850155947142664064847374654656 | 4471569188104614772836003592341590356386719178852390056096679253140964861297124743245219919679449855406687869515725658453509596128623399851401993495945199 | [
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true
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PO_1001992379182703567293306 | 10019923791827035672933062561792866969485764706450783196763572490563885303455935761055629820604618681677625996517286664863747409627879523663566390242513522 | 2025-07-10T10:20:36 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.042063 | CO_1057935181427271625931347 | 10579351814272716259313476815513524157073630828553358293511773075176125846619615741597483343150706281912831919796313616524897506959447341392474234567586891 | 3879363669128823975554249824098786735984497273189521243704171682482760780811462124794540778977187499815869895265529699470706848142977110509450514372480627 | [
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PO_1001930137015409406684754 | 10019301370154094066847545983652210916163738033819965608960609199750712183624933247914231140350653998432958580617990556272695764640615071784672653570020927 | 2025-07-10T09:53:37 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.022018 | CO_7051303447313071244256212 | 7051303447313071244256212078220672273137648051067057687265912059733612979078910466724038596804802029044397938875545077767876259637496436686795983284411135 | 11525816402657809015961885415512832403338674292071593887056318020277216028376551999289221135027158007713584352285605796717748348918886015576886843203402663 | [
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PO_1001935928546695198490745 | 10019359285466951984907450933885639395277083224981017136568277308173813975916271577941199406562409437123985693187606753373000679001739667347597304675859273 | 2025-07-10T09:53:39 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.068542 | CO_5346120762445246787576119 | 5346120762445246787576119056510608000133953372831156790892164264838135119248516044823880272411626927689756830996105425874975588411186802035323311381821705 | 3037777917496137344016897478614752997730486624113043331968152386420273865286479149781794208830522907984946273234427566119617718695981041858657367572010614 | [
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PO_1001941517773490249254769 | 10019415177734902492547690382113354375488434412529356226660276399663332596104590454950439980026969505897845585622149952216462321912998286257242682603707015 | 2025-07-10T09:57:57 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | 1.1464 | unknown | null | null | null | null | null | 0.048702 | CO_5262006543177871161408524 | 5262006543177871161408524138743545569421311213886099725591698048837023379183839216681651852290294883883853399924643855454121167410806166023376289075576526 | 1045172511251719384119187845615221550503215106985217883924150050965071852100972759740701040456597932049247251692778333374295198901810736008820460258505604 | [
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PO_1002098665112406765753454 | 10020986651124067657534541428549648281980204448738495717627169874064162183049049075944249722914541173235049479368558578828300509822342368970120621216337438 | 2025-07-10T11:30:05 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.005075 | CO_1090978672750994800317257 | 10909786727509948003172570749282385340009781220130382225214479968782670933275781059317479003082700349338940024598906755140037910873686585321561915342861165 | 1207081380669611249937772099499799244057611376837774514252124703917558571859488575977495176133182871932589089196182575786655102538908144346880131380520614 | [
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PO_1002096174379061779820398 | 10020961743790617798203980564398785584605910681473860036313493083303675705851621704401213037918938222844484382015229514241861373730790201277064250707956370 | 2025-07-10T09:31:40 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.080493 | CO_9697487428815308096783704 | 9697487428815308096783704883436749889981922394592954221871121691404081878955376632838827146323132026939763298697660612447444845976415035835023528848284260 | 594704131961521683939105759284612347175958994668811436298420496582048024632267075698603080964178414625055857419493135590743268688168983767357470771937813 | [
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PO_1002038045758434923218156 | 10020380457584349232181562666494893473457353061562891460075681799815004348960833267973295656115304265606313883058141917663607461424425067808471771640537192 | 2025-07-10T09:38:18 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.001811 | CO_9405878062056989360507023 | 9405878062056989360507023095090692374281320350929483545737447893087842370609288358436832442498025837874049536073601833639597941552877182360114789638991005 | 1013642697458887388857929062383815444010737259766567759465807765839636119086005071338691986668707363912311160617441346184636341121589949299507967525083932 | [
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PO_1002088154576848810237694 | 10020881545768488102376947705859523799965067063366027774313052134381764805593768894918478635582433236714025112474533551278432654713622856050051336511028824 | 2025-07-10T09:42:52 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.081013 | CO_2186921462374653814640020 | 2186921462374653814640020528307084925229614480469356130139607628135562097338763402955428005928126581271245346032067440132825197370279489345269108426660980 | 8911651430809794542095811214572614307491365611254304733801253704613549064509196044172838056816441013969360030508726438504615591072237408360494595084350991 | [
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PO_1002074701719082364730616 | 10020747017190823647306168922445136021052765527850116213953273303723732077231524433803198425230859387916154759109783541899227223206351486980649135425691516 | 2025-07-10T09:12:14 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.044768 | CO_1231157430393158092532472 | 12311574303931580925324726532067265950490504931295981856851372536768862333758797831999365772729848181990386770563496141676546401482966904329336018601324151 | 10288365297772071615920526832277466695655443905261404097728982734789563227633959097397434273447832284132357004395822210501572475717902131577728428715146506 | [
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PO_1002007431826600368378277 | 10020074318266003683782779736576569745133162425492840091876161886385235879234004768864442857496207617131601861780750839279224649909452129809737271376415416 | 2025-07-10T09:15:44 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.005111 | CO_8137622069141151341332838 | 8137622069141151341332838181765883494570997714244063296731755817288673763279886095945565686302292979203353653137032026720849603607275358707465786224195150 | 1031415908867121189272109810408490631794656112149737473449157571303561112329579484007549981197577504780439107403689390306095908463925602828680554176328507 | [
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PO_1002057608593182243650398 | 10020576085931822436503985385237534610300170429466881273946221211206703831472925706134126936532241819552381376907211389852223449551333379382545873307406594 | 2025-07-10T09:19:28 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.092952 | CO_7531349316228643780017967 | 7531349316228643780017967567114884736139044061184820831456862578840118552232849997718763033078043420523513308372522173829339760213353230783074153343212440 | 12629091533933726751571951692105130186191394528827824144020365738395312549612363343109484762826236504437404706523662458801994499825439424165604899107902866 | [
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] | null | data/MD/8810/MD_3706892161367792865018810.json | null | null | null | {"alex_mp_file_key": "232917", "alex_mp_id": "alex<agm002274922>", "alex_mp_split": "train", "chemical_system": "Ga-Ir-Pr", "dft_bulk_modulus": NaN, "dft_mag_density": -0.0002779402886433, "hhi_score": 6941.952082757077, "input": "Please see original datasets Alexandria and MP-20 for configuration creation details.", "... |
PO_1002093682058230951300075 | 10020936820582309513000756166471127594994120843451354012319703489091362986380639648824081358513807819216278256772473969493224338313548547003309174243987405 | 2025-07-10T09:22:47 | DS_uluw9723f2n4_0 | 1 | VASP | PBE | null | null | null | null | null | null | null | null | null | null | null | 0.082777 | CO_7611616819979055894009184 | 7611616819979055894009184932663104797448372029305075921276604297552069169591697863748498226559173156284567603541631454957161628613328831030090273350107949 | 8243206260606557276245504821339829001264242244565134617547950803436015424822387400286525762898939645632779690642097472241744113284631682867948771135142065 | [
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"alex_mp_train_agm004630939"
] | null | data/MD/3611/MD_4564501089804285737923611.json | null | null | null | {"alex_mp_file_key": "242752", "alex_mp_id": "alex<agm004630939>", "alex_mp_split": "train", "chemical_system": "Dy-Sm-Y-Zr", "dft_bulk_modulus": NaN, "dft_mag_density": 1.192742253060579e-05, "hhi_score": 2987.091918495695, "input": "Please see original datasets Alexandria and MP-20 for configuration creation details.... |
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