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PO_4903756423451452247117150 | 490375642345145224711715005235468715804151024723730887772411019283203605606013713071101502501526236679776030520898018892430384700150392725117118835709702 | 2025-04-16T16:59:46 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 1.4453 | unknown | -94.824439 | null | null | null | null | null | CO_1339735655560586565312469 | 1339735655560586565312469501619025466005164825925499674533522356935276984713219114848560397080512310993696813155839040705068025877418650644239613273271768 | 6395175687197610360354636498922436292655863786704449745862325524811500081478061098066110154157891528622007033224508946917766635923864303362069850116397133 | [
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PO_4903078337664066004076092 | 4903078337664066004076092567000983473392040884763868413531786455560591267514091104860662217137322601186992290764705794383496753398479784020415290597711714 | 2025-04-16T22:04:30 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 0 | unknown | -13.482969 | null | null | null | null | null | CO_6561814817445094291839203 | 6561814817445094291839203104516693797570473279297732426796467398043271058352332289257453831576298928262948348274429552657868237354657953043936488838164131 | 11962242988336464258465701416674648154652668240024625398917106204320776618549945432912162923584154434495128268200845103996807985255813038056415687916878596 | [
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3.9... | [
true,
true,
true
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0
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true,
true
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0.25,
0.25,
0.5
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3,
8,
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25
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PO_4903689860272020489198375 | 4903689860272020489198375071065236422260282244423544220486744570248549098052146139190744880066987145650432385082883658657659841755422983655322953770488958 | 2025-04-16T16:29:51 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 0.089 | unknown | -12.135837 | null | null | null | null | null | CO_1196067267765864166270453 | 11960672677658641662704533917532368355204979483846853783673946128073024239382123715241147553284706784843888612343065903537155202953590606835891914100964995 | 1642069889987959855536177976412370212732531540527729336789076712264298687569783191311587090377570641745011492655768857254691678826925255487718953599791770 | [
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1.9094059212514105
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0
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true,
true,
true
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0.2,
0.6,
0.2
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8,
8,
27,
59
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[
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6.431358963368482,
2.7540919950246945
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true,
true,
true
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0.08333333333333333,
0.6666666666666666,
0.25
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23,
23,
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1.895660805,
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0,
0,
0
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] | [
true,
true,
true
] | ErPdSb | ErPdSb | ABC | [
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0.3333333333333333,
0.3333333333333333,
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46,
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68
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[
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true,
true
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9,
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] | 32 | 3 | 0 | [
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3.6518567262719404
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[
0,
0,
0
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] | [
true,
true,
true
] | LiTl2Tm | LiTl2Tm | A2BC | [
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0.25,
0.5,
0.25
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69,
81,
81
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[
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[
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6.422443793246622
],
[
7.962090939700185,
-3.978120746581468,
4.849297450866832
],
... | [
true,
true,
true
] | C4Na8Ni4O28P4 | CNa2NiO7P | A7B2CDE | [
"C",
"Na",
"Ni",
"O",
"P"
] | [
0.08333333333333333,
0.16666666666666666,
0.08333333333333333,
0.5833333333333334,
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11,
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8,
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8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | 48 | 5 | 0 | [
0,
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0
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PO_4910944604929311394843459 | 4910944604929311394843459383577286954874078513638434257415066987736046099831751528101019742508898923888874061536241176392460266771261525448358466306709987 | 2025-04-16T20:51:24 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 0 | unknown | -47.164509 | null | null | null | null | null | CO_1636629550674480540617494 | 1636629550674480540617494606596876439989837135022307962253649536359164512506926994272864876324163128135532032465642112023905364960119980645357095211957996 | 10526971622739960927443790202815193028955636837918127255140639033726839837715202704133796680263855894644913216458499921412875569730232449626948839392914227 | [
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5.81901171
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[
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[
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[
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2.178649177319475,
13.23225612051228
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[
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true,
true,
true
] | Se18Sm10 | Se9Sm5 | A9B5 | [
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"Sm"
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0.6428571428571429,
0.35714285714285715
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62,
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34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34
] | 28 | 2 | 0 | [
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0
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PO_4901144672369569662688223 | 4901144672369569662688223261721510792675364826532770117038801278911432489345151971214396003763863475916903978155268559333307326052979357695609373696050903 | 2025-04-16T17:34:29 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 0 | unknown | 0.140583 | null | null | null | null | null | CO_7644773498074731437269483 | 7644773498074731437269483363528255717747871860096887277236489060501342625062012907924709053766846989351307729707987057382860706340836642902931224203295489 | 3487643062333404766538668050915183196838886956708173640437481805782435457499016043490526377312122446182426101020023829633791929661593010984837818039811308 | [
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0,
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[
-1.60889168,
2.78668213,
-1.13765822
],
[
0,
0,
3.41297465
]
] | [
[
0,
0,
0
]
] | [
true,
true,
true
] | Tm | Tm | A | [
"Tm"
] | [
1
] | [
69
] | 1 | 1 | 0 | [
0,
0,
0
] | [
"CFID_mp_desc_data_84k_8442",
"megnet_3304",
"matbench_mp_gap_451",
"matbench_mp_e_form_7206"
] | null | data/MD/5202/MD_1086845055867124744315202.json | data/MD/1468/MD_3374419322936642333381468.json | null | {"materials-project-version": "2019.7.30", "volume": 30.60393672259499, "hash": "3374419322936642333381468227255252049220922880437744950578210099883656348394078530025092019487155318207792469564365360017959751577391366498112003397269915", "id": "MD_3374419322936642333381468"} | {"hash": "10868450558671247443152026947160338505683745266658651051718065983487878962987857602829315249215796444208488632888003673539585986066311769564391053988452926", "id": "MD_1086845055867124744315202"} |
PO_4910407810701389047982416 | 4910407810701389047982416273390846732171091641106261995189811405469157383676786851775706032088782134382093863376043510224100781339174314195968511524018671 | 2025-04-17T17:56:16 | DS_9yr94hhj1k33_0 | 1 | VASP | DFT-PBE | null | [] | [] | null | 2.5211 | unknown | -22.755956 | null | null | null | null | null | CO_9974683636805684083311236 | 9974683636805684083311236090501900315605851601950314121501099307706005252279905726480821869953003846382501732230167004501955333484379618176970933920560828 | 3448985359462893928726079453004009992607681198426589053040144608648451636161778359039598234031558674393799109428984859742996854226715922632325890958676214 | [
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[
-4.81879149,
2.40088944,
-2.40088944
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[
-4.81879149,
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2.40088944
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0
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[
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[
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[
0,
0,
0
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[
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4.6009453619228686e-17
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[
-... | [
true,
true,
true
] | Ca3CdO4 | Ca3CdO4 | A4B3C | [
"Ca",
"Cd",
"O"
] | [
0.375,
0.125,
0.5
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20,
20,
20,
48,
8,
8,
8,
8
] | 8 | 3 | 0 | [
0,
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0
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"CFID_mp_desc_data_84k_54942",
"megnet_40618"
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0,
0
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[
0,
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0
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[
0,
0,
15.33482629
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[
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5.900580738256027,
9.860034452602225
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[
6.708130934099175,
0.006926458256027199,
5.474791837397775
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... | [
true,
true,
true
] | I20K8N4O4Ru4 | I5K2NORu | A5B2CDE | [
"I",
"K",
"N",
"O",
"Ru"
] | [
0.5,
0.2,
0.1,
0.1,
0.1
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19,
19,
19,
19,
19,
19,
19,
44,
44,
44,
44,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
7,
7,
7,
7,
8,
8,
8,
8
] | 40 | 5 | 0 | [
0,
0,
0
] | [
"CFID_mp_desc_data_84k_37249",
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"matbench_mp_gap_96595",
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] | null | data/MD/5202/MD_1086845055867124744315202.json | data/MD/4299/MD_4105764819510646882484299.json | null | {"materials-project-version": "2019.7.30", "volume": 1437.5793960004248, "hash": "4105764819510646882484299494476445647161488400645538719972856978171062810385313644944396614545278681022549605710457382859959244785332407628622411749755276", "id": "MD_4105764819510646882484299"} | {"hash": "10868450558671247443152026947160338505683745266658651051718065983487878962987857602829315249215796444208488632888003673539585986066311769564391053988452926", "id": "MD_1086845055867124744315202"} |
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