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PO_1052690524999910382569497 | 10526905249999103825694973546375430933906278364604801763314483679929438516055737461952424797634852115093602098365442784230726330472639310082806841615053589 | 2025-04-16T16:01:29 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -11.421473 | [
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PO_1015703294796128174024789 | 10157032947961281740247892587711736938120244514332523102434433568772271037038163369000715831171083339235255622566455723559300568834126346867746862818416598 | 2025-04-16T16:43:28 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -29.981077 | [
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PO_1015867281931519931343162 | 10158672819315199313431628831600726338835132094108985038507930225429476724494963359937766773491196342237700399730127168228418681464516495438710391711111112 | 2025-04-16T21:52:07 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -17.18922 | [
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PO_1053707435756865779957769 | 10537074357568657799577694419084678879297729904015861942309785249054501546974812183837291751626337915624568596369052293303615838472649577176710900788988788 | 2025-04-16T20:16:40 | DS_mevqyitwxukc_0 | 1 | VASP | DFT-PBE | -41.441357 | [
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[
6.75839996337... | [
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true
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] | null | data/MD/8121/MD_1213582242930949697188121.json | data/MD/4429/MD_3439659285659338594744429.json | null | {"materials-project-id": "mp-1056702", "temperature": 237, "hash": "3439659285659338594744429554995128402634124993844567363121524767592147956870772456577025403142995038416572931380179484889726124110952249575049066684984209", "id": "MD_3439659285659338594744429"} | {"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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