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PO_5574622817322621200271974 | 5574622817322621200271974133149989889822991767734923660528524235917693175139565481757010503243762894181623107309350063854357038818556933882740455789460029 | 2025-04-16T21:27:46 | DS_6sjhg1f8fv5j_0 | 1 | CP2K | DFT-PBE+D3 | -505.81282 | [
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[
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... | [
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true,
true
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... | [
true,
true,
true
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"C",
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... | 151 | 2 | 3 | [
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] | null | data/MD/3341/MD_4178802015180711158523341.json | data/MD/2360/MD_5085563091843178930982360.json | null | {"config_type": "deposition", "hash": "5085563091843178930982360100539406021215696347708504656720957170424303591863714685556596531403026063781709596599516565635016083334750335589969203795829992", "id": "MD_5085563091843178930982360"} | {"input": {"cutoff-energy": {"value": 300, "units": "Ry"}, "relative-cutoff-energy": {"value": 60, "units": "Ry"}, "scheme": "QUICKSTEP"}, "hash": "4178802015180711158523341789665647106270915003175636797223149523631617352424712633254110378226507537845096425680076758458702686284378534857806338422045244", "id": "MD_41788... |
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