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DS_07zjrtacjg3z_0
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data/MD/4357/MD_1024398629573454165794357.json
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PO_1001561139103084088787985
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DS_07zjrtacjg3z_0
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VASP
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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C60
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C
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A
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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C50
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PO_1002906147114578651091743
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| 2025-04-17T18:06:06
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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C60
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DS_07zjrtacjg3z_0
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C50
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| 2025-04-16T18:32:22
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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C53
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DS_07zjrtacjg3z_0
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C49
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[
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data/MD/4357/MD_1024398629573454165794357.json
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PO_4938457231351080275949721
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| 2025-04-16T16:09:44
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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C59
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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PO_4906711031762185067847556
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| 2025-04-16T18:49:01
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DS_07zjrtacjg3z_0
| 1
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VASP
|
DFT-PBE
| -520.537504
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C59
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C
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A
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PO_4912624499455190837762117
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| 2025-04-16T15:43:51
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
| -194.298913
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| 2025-04-17T18:06:06
|
DS_07zjrtacjg3z_0
| 1
|
VASP
|
DFT-PBE
| -414.206227
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CO_1102912582851279144468420
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true,
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C50
|
C
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A
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[
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data/MD/4357/MD_1024398629573454165794357.json
| null | null | null |
{"input": {"encut": {"value": 520, "units": "eV"}}, "hash": "102439862957345416579435757980411251184715859364031590652706556386856859773466490977891980138017845683216054395454090990042136855050809363628328039055230", "id": "MD_1024398629573454165794357"}
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PO_4915273194475088325080047
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| 2025-04-16T20:57:06
|
DS_07zjrtacjg3z_0
| 1
|
VASP
|
DFT-PBE
| -438.559506
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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C59
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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C50
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C
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A
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| 2025-04-16T17:26:05
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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C56
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C
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A
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PO_1003525956540255981501360
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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C59
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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C53
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C
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A
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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VASP
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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VASP
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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A
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DS_07zjrtacjg3z_0
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VASP
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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DS_07zjrtacjg3z_0
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VASP
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DFT-PBE
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DS_07zjrtacjg3z_0
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C55
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C
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A
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| 2025-04-16T16:55:31
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DS_07zjrtacjg3z_0
| 1
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VASP
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DFT-PBE
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