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PO_4247369210503702350424091 | 4247369210503702350424091023967747924609107468854015360520812489340336474615925020888246794533459755849650408328190190636478543281265604360173322789586680 | 2025-04-16T16:08:30 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -14.627504 | [
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PO_4247297907928000710817211 | 4247297907928000710817211472356244796909823624052715982085553659547687717424809885293003685936874614397265656844631165091915146695014127210538851406342505 | 2025-04-16T18:33:37 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -38.823235 | [
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[
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PO_4248375073542071174353436 | 4248375073542071174353436126939279526800926730770256736743915390907314095631268821463959802341002868171867065333115126623258804559793677610999226316989079 | 2025-04-16T15:42:56 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -44.233437 | [
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PO_4271383341375038455960176 | 4271383341375038455960176156584899392661483152972642016165656058513810730901580369220734079903335598635135555468856113234683577238533416131498158668248111 | 2025-04-16T21:44:51 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -33.463223 | [
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[
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] | null | data/MD/8121/MD_1213582242930949697188121.json | data/MD/1241/MD_1133590065711275190571241.json | null | {"materials-project-id": "mp-1094122", "temperature": 950, "hash": "11335900657112751905712415134074946468166480362310100541726528762783919458104196862039185175387692349953026113011038800075552039625923046858663124930728242", "id": "MD_1133590065711275190571241"} | {"input": {"ALGO": "fast", "EDIFF": "1E-8", "ENCUT": "400", "IBRION": "0", "ICHARG": "0", "ISIF": "2", "ISMEAR": "1", "ISTART": "0", "ISYM": "0", "KBLOCK": "10", "KGAMMA": "F", "KPAR": "16", "KSPACING": "0.24", "LCHARG": "T", "LREAL": "F", "LWAVE": "F", "MAXMIX": "50", "NBLOCK": "1", "NELM": "200", "NELMIN": "4", "NPAR... |
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