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DS_v4e6t79tt5xh_0
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VASP
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PO_1012464422705821507171219
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| 2025-04-16T20:11:48
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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A3B2
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PO_1012671015911747809034116
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| 2025-04-16T20:18:47
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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PO_1012727293460244943102671
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| 2025-04-16T16:06:08
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -67.351021
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1012911190704508388151658
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| 2025-04-17T18:48:22
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -71.125984
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CO_1271351226648053164381941
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1012905701830614994158674
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| 2025-04-17T18:37:27
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
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CO_7715829783374909324027739
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1013016326076985315955453
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| 2025-04-16T16:04:40
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -71.132339
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DS_v4e6t79tt5xh_0
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DS_v4e6t79tt5xh_0
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In8Se12
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In2Se3
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A3B2
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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A3B2
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| 2025-04-16T17:42:42
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4464427570817125264272567
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| 2025-04-16T16:55:31
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
|
A3B2
|
[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_4471888897673940960072517
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| 2025-04-16T21:38:17
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
| -18.093737
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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PO_1050128086310925864223121
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| 2025-04-16T16:10:07
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T20:11:35
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1051198830120222459881501
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| 2025-04-16T16:33:01
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1050832744107243715790605
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| 2025-04-16T17:15:37
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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true
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
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| 2
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1051125295466752463115242
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| 2025-04-16T20:11:35
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In2Se3
|
In2Se3
|
A3B2
|
[
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[
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0.6
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[
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34
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| 2
| 0
|
[
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1050859976722312934814299
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| 2025-04-16T21:44:51
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -64.726395
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DS_v4e6t79tt5xh_0
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1014859989505710011414122
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| 2025-04-16T17:30:41
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In12Se18
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In2Se3
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A3B2
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| 2025-04-16T21:13:40
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4495740226625671884628000
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| 2025-04-16T20:10:51
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_4502208037208479816993092
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| 2025-04-16T17:29:43
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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DS_v4e6t79tt5xh_0
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VASP
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A3B2
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| 2025-04-16T16:10:07
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4523748609030112465174174
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T21:04:14
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4529080115027969962132658
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| 2025-04-16T17:28:31
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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[
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4528691618151717059855073
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| 2025-04-16T15:14:02
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T21:43:16
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DS_v4e6t79tt5xh_0
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VASP
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In12Se18
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4526405673575551184884774
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| 2025-04-16T16:06:20
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4527372994703832463183100
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| 2025-04-16T18:09:42
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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A3B2
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| 2025-04-16T17:45:47
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1050404383354870566096415
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| 2025-04-16T17:03:14
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
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[
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1051510085878989796304679
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| 2025-04-16T16:09:52
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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DS_v4e6t79tt5xh_0
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A3B2
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DS_v4e6t79tt5xh_0
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VASP
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T18:08:39
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DS_v4e6t79tt5xh_0
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| 2025-04-16T21:22:14
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1014021663209917942854392
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| 2025-04-16T17:27:48
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1014035037232037589642476
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| 2025-04-16T15:42:34
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1014367662833079772391459
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| 2025-04-16T18:09:42
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1014374271954878109129873
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| 2025-04-16T17:54:28
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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CO_4825128950520605917786052
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1014325620202119814171422
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| 2025-04-16T21:22:40
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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CO_7120810070910013361177122
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true
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
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| 2
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1014492726954473926171746
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| 2025-04-16T18:56:50
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -18.078022
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[
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CO_8505744186483219418316069
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[
true,
true,
true
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In2Se3
|
In2Se3
|
A3B2
|
[
"In",
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[
0.4,
0.6
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[
49,
49,
34,
34,
34
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| 2
| 0
|
[
0,
0,
0
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1051339863614393552638113
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| 2025-04-16T20:56:28
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -18.111893
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[
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CO_6189024836774570884652553
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[
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true
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In2Se3
|
In2Se3
|
A3B2
|
[
"In",
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] |
[
0.4,
0.6
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[
49,
49,
34,
34,
34
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| 2
| 0
|
[
0,
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0
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[
"init.007_set.000_153"
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1051340184299466208173652
|
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| 2025-04-16T18:41:17
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
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CO_6823978345994072324466897
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[
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true,
true
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In8Se12
|
In2Se3
|
A3B2
|
[
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0.6
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| 2
| 0
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0,
0
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1051335537654564425677501
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| 2025-04-16T21:27:46
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -100.431229
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| null | null | null | null | null | 3.440038
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CO_4327602273062063289102143
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[
true,
true,
true
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In12Se18
|
In2Se3
|
A3B2
|
[
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[
0.4,
0.6
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| 2
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|
[
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1051491397928233610265632
|
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| 2025-04-16T21:57:13
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -68.538002
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CO_8771991202258746192460387
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In8Se12
|
In2Se3
|
A3B2
|
[
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4484505214625770927709930
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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PO_4484831334226470263872289
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| 2025-04-16T21:14:40
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In12Se18
|
In2Se3
|
A3B2
|
[
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[
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[
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4492091460175369880509321
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| 2025-04-16T17:48:31
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4492586706446696403393204
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| 2025-04-16T21:56:50
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DS_v4e6t79tt5xh_0
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VASP
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4492166117383676449851166
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| 2025-04-16T16:45:47
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4498218392906158490252791
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| 2025-04-16T17:29:43
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4497209719436407899730637
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| 2025-04-16T19:03:57
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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A3B2
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PO_4496972748150788967811517
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| 2025-04-16T16:33:13
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
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A3B2
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| 2025-04-16T21:13:40
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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| 2025-04-16T17:56:02
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DS_v4e6t79tt5xh_0
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VASP
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T18:47:00
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DS_v4e6t79tt5xh_0
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PO_1013417570200374465798030
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| 2025-04-17T17:45:49
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1013440040077568881006116
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| 2025-04-16T18:43:09
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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data/MD/5160/MD_2726573268070736046235160.json
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DS_v4e6t79tt5xh_0
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A3B2
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| 2025-04-16T18:42:12
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DS_v4e6t79tt5xh_0
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In8Se12
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A3B2
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| 2025-04-16T16:54:28
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1013514178924975923731509
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| 2025-04-16T21:57:13
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DS_v4e6t79tt5xh_0
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VASP
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A3B2
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PO_1013561689129403862976716
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| 2025-04-16T16:09:52
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DS_v4e6t79tt5xh_0
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In8Se12
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A3B2
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
0.4,
0.6
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| 2
| 0
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[
0,
0,
0
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
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PO_1013772631789505202996502
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| 2025-04-16T20:42:25
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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In8Se12
|
In2Se3
|
A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1013882064988073111480440
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| 2025-04-16T17:29:43
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
|
A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4483523773674583832252371
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| 2025-04-16T21:14:40
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4488201228130565857765631
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| 2025-04-16T16:30:10
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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In8Se12
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In2Se3
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A3B2
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PO_4485961724595159361675515
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| 2025-04-16T18:09:08
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DS_v4e6t79tt5xh_0
| 1
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VASP
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In12Se18
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4482992847161634601841683
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| 2025-04-16T20:24:05
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T16:00:45
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4489144037682459422709393
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| 2025-04-16T17:47:40
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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PO_4487042516074867797794614
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| 2025-04-16T16:30:52
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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| 2025-04-16T15:44:09
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DS_v4e6t79tt5xh_0
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VASP
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| 2025-04-16T17:11:24
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DS_v4e6t79tt5xh_0
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| 2025-04-16T17:55:48
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DS_v4e6t79tt5xh_0
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VASP
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DFT-PBE
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| 2025-04-16T17:26:47
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DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -65.448555
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CO_1080326049073459430348288
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In8Se12
|
In2Se3
|
A3B2
|
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_4478914284362029915551655
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| 2025-04-16T16:05:10
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -67.431442
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| null | null | null | null | null | 2.899592
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CO_1102775476635370459266598
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_4481658227889800131975734
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| 2025-04-16T17:31:20
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -70.525063
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CO_6360405466380621998824565
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true
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In8Se12
|
In2Se3
|
A3B2
|
[
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[
0.4,
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_4481597764713773564537618
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| 2025-04-16T21:44:51
|
DS_v4e6t79tt5xh_0
| 1
|
VASP
|
DFT-PBE
| -18.10511
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In2Se3
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_4480697043538788870995352
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DS_v4e6t79tt5xh_0
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VASP
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In12Se18
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In2Se3
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A3B2
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[
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[
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1051634572459969739172356
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| 2025-04-16T17:15:37
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In8Se12
|
In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
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PO_1015066229463598213516188
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| 2025-04-16T18:55:55
|
DS_v4e6t79tt5xh_0
| 1
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VASP
|
DFT-PBE
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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| 2025-04-16T21:21:56
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1053528656612512231385351
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| 2025-04-16T18:16:20
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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In12Se18
|
In2Se3
|
A3B2
|
[
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1053529117168082843172799
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| 2025-04-16T21:51:00
|
DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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DS_v4e6t79tt5xh_0
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DS_v4e6t79tt5xh_0
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A3B2
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PO_1052983441242867375040613
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| 2025-04-16T15:23:12
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DS_v4e6t79tt5xh_0
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VASP
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A3B2
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DS_v4e6t79tt5xh_0
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A3B2
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PO_1052938228382895232639765
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DS_v4e6t79tt5xh_0
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VASP
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In8Se12
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In2Se3
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A3B2
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data/MD/5160/MD_2726573268070736046235160.json
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PO_1052674611822285757609561
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| 2025-04-16T16:07:38
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DS_v4e6t79tt5xh_0
| 1
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VASP
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DFT-PBE
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[
3.3106400966644287,
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] |
[
true,
true,
true
] |
In8Se12
|
In2Se3
|
A3B2
|
[
"In",
"Se"
] |
[
0.4,
0.6
] |
[
49,
49,
49,
49,
49,
49,
49,
49,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34,
34
] | 20
| 2
| 0
|
[
0,
0,
0
] |
[
"init.003_set.007_62"
] | null |
data/MD/5160/MD_2726573268070736046235160.json
| null | null | null |
{"input": {"encut": {"value": 700, "units": "eV"}, "kspacing": {"value": 0.3, "units": "Ang^-1"}}, "hash": "2726573268070736046235160720521431789644597867968335543317393972166648078320442344803677110877070339084714637106252742807938138795187182689615633929446753", "id": "MD_2726573268070736046235160"}
|
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