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PO_4453738616816851283333271 | 4453738616816851283333271376581348011359684566056083575122264397040778381056760990797940506687495497217625021092817368711052038642075493277609952074792009 | 2025-04-16T21:37:17 | DS_101uk70asqhq_0 | 1 | VASP | DFT-PBE | -116.94249 | [
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PO_4454187656062621590017280 | 4454187656062621590017280088787723725469126832689098910027104530286453748193110162324176292406414326017257938432916760140216198711717580755579626115028148 | 2025-04-16T17:32:46 | DS_101uk70asqhq_0 | 1 | VASP | DFT-PBE | -112.593964 | [
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PO_4458729670928747813235121 | 445872967092874781323512149418436695117694108194513540984988591202425009198172546106088088968011351087259426505485675924075927055557985610448210226336655 | 2025-04-16T20:03:40 | DS_101uk70asqhq_0 | 1 | VASP | DFT-PBE | -39.760159 | [
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... | [
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"deepmd_set.000_15"
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PO_4456841671242389646171448 | 4456841671242389646171448690307455877542394151626282449740105170607522421712551440916169033336308488299232916566811119635428611379925249502132454936468295 | 2025-04-17T18:48:22 | DS_101uk70asqhq_0 | 1 | VASP | DFT-PBE | -112.627953 | [
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[
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"data.000_set.000_11"
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PO_4456344548109879048311103 | 4456344548109879048311103138497075897698455435822581371769439068800541373093943696959031425058523803122052558060504498418894073267349058210540557956045536 | 2025-04-16T16:50:24 | DS_101uk70asqhq_0 | 1 | VASP | DFT-PBE | -95.288002 | [
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"deepmd_set.000_638"
] | null | data/MD/5202/MD_1086845055867124744315202.json | null | null | null | {"hash": "10868450558671247443152026947160338505683745266658651051718065983487878962987857602829315249215796444208488632888003673539585986066311769564391053988452926", "id": "MD_1086845055867124744315202"} |
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