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2025-04-16T18:10:37
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2025-04-17T17:56:16
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2025-04-16T18:33:43
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2025-04-16T17:23:25
DS_eltotrjoqonr_0
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2025-04-16T15:18:37
DS_eltotrjoqonr_0
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2025-04-16T15:44:12
DS_eltotrjoqonr_0
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2025-04-16T16:07:26
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2025-04-16T16:33:13
DS_eltotrjoqonr_0
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2025-04-16T18:56:45
DS_eltotrjoqonr_0
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2025-04-16T17:57:27
DS_eltotrjoqonr_0
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2025-04-16T21:12:08
DS_eltotrjoqonr_0
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DFT-PBE
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2025-04-16T18:49:16
DS_eltotrjoqonr_0
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DFT-PBE
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2025-04-16T18:21:24
DS_eltotrjoqonr_0
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2025-04-17T18:37:27
DS_eltotrjoqonr_0
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2025-04-16T18:45:49
DS_eltotrjoqonr_0
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2025-04-16T16:55:51
DS_eltotrjoqonr_0
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2025-04-16T18:47:53
DS_eltotrjoqonr_0
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2025-04-16T17:55:33
DS_eltotrjoqonr_0
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2025-04-16T21:29:37
DS_eltotrjoqonr_0
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Si63
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2025-04-16T21:13:01
DS_eltotrjoqonr_0
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2025-04-16T16:56:18
DS_eltotrjoqonr_0
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VASP
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2025-04-16T18:43:09
DS_eltotrjoqonr_0
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VASP
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2025-04-16T19:57:28
DS_eltotrjoqonr_0
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2025-04-16T15:43:10
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2025-04-16T21:27:46
DS_eltotrjoqonr_0
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2025-04-16T21:12:08
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2025-04-16T20:22:40
DS_eltotrjoqonr_0
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2025-04-17T18:06:06
DS_eltotrjoqonr_0
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2025-04-16T20:13:01
DS_eltotrjoqonr_0
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2025-04-16T16:26:36
DS_eltotrjoqonr_0
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2025-04-16T20:24:25
DS_eltotrjoqonr_0
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Si
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18
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data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T16:32:15
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
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2025-04-16T18:58:19
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si64
Si
A
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2025-04-16T17:20:23
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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64
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data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T17:29:10
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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63
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null
data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T20:31:48
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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63
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null
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2025-04-16T21:23:51
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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64
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2025-04-16T21:21:56
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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63
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null
data/MD/5428/MD_3029330070173112270945428.json
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null
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2025-04-16T20:25:42
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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2025-04-16T15:41:29
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T20:35:09
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si64
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2025-04-16T21:27:46
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si64
Si
A
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2025-04-16T21:56:50
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-345.182849
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Si64
Si
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null
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2025-04-16T18:42:12
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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2025-04-16T20:51:24
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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2025-04-16T17:19:33
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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data/MD/5428/MD_3029330070173112270945428.json
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null
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2025-04-16T17:27:48
DS_eltotrjoqonr_0
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2025-04-16T21:17:28
DS_eltotrjoqonr_0
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2025-04-16T21:37:22
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T18:09:37
DS_eltotrjoqonr_0
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VASP
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2025-04-16T15:44:22
DS_eltotrjoqonr_0
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VASP
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2025-04-16T18:04:13
DS_eltotrjoqonr_0
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2025-04-16T17:29:43
DS_eltotrjoqonr_0
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VASP
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2025-04-16T20:27:55
DS_eltotrjoqonr_0
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Si
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2025-04-17T17:56:16
DS_eltotrjoqonr_0
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2025-04-16T18:20:07
DS_eltotrjoqonr_0
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Si64
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2025-04-16T16:26:36
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si64
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2025-04-16T16:29:31
DS_eltotrjoqonr_0
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DFT-PBE
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Si
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2025-04-16T18:57:04
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T15:44:05
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T22:04:30
DS_eltotrjoqonr_0
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2025-04-16T17:27:47
DS_eltotrjoqonr_0
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2025-04-16T17:28:31
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2025-04-16T16:09:21
DS_eltotrjoqonr_0
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2025-04-16T17:39:34
DS_eltotrjoqonr_0
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2025-04-16T16:55:24
DS_eltotrjoqonr_0
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2025-04-16T21:12:08
DS_eltotrjoqonr_0
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2025-04-16T15:43:48
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2025-04-16T18:39:28
DS_eltotrjoqonr_0
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2025-04-16T17:44:41
DS_eltotrjoqonr_0
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2025-04-16T22:04:30
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T17:29:28
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si63
Si
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2025-04-16T16:32:30
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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Si64
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2025-04-16T16:28:27
DS_eltotrjoqonr_0
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VASP
DFT-PBE
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2025-04-16T17:47:41
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si
A
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2025-04-17T18:16:17
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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63
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null
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2025-04-16T18:57:08
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si63
Si
A
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63
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null
data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T18:38:16
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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64
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data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T20:10:30
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-294.935596
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Si63
Si
A
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63
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[ 1, 1, 1 ]
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null
data/MD/5428/MD_3029330070173112270945428.json
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null
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2025-04-16T15:42:27
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-295.952082
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Si63
Si
A
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63
1
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[ 1, 1, 1 ]
[ "train_Snapshot_29_of_32_of_Vacancy_AIMD_NVT_simulation_at_300_K" ]
null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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2025-04-16T16:25:26
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-335.356997
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Si64
Si
A
[ "Si" ]
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64
1
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[ 1, 1, 1 ]
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null
data/MD/5428/MD_3029330070173112270945428.json
null
null
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2025-04-16T20:16:51
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-346.965831
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Si64
Si
A
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64
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null
data/MD/5428/MD_3029330070173112270945428.json
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2025-04-16T16:57:14
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-125.982937
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Si24
Si
A
[ "Si" ]
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24
1
3
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[ "train_Si_surface_mp_Si_mp-149__1_1_1__reconstructed" ]
null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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2025-04-16T18:36:30
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-300.527116
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Si64
Si
A
[ "Si" ]
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64
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null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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2025-04-16T21:43:25
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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64
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null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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PO_9701293233523188806105814
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2025-04-16T18:30:08
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-297.314011
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Si63
Si
A
[ "Si" ]
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63
1
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[ 1, 1, 1 ]
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null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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2025-04-16T20:25:42
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-186.10708
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Si36
Si
A
[ "Si" ]
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36
1
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[ "train_Si_surface_mp_Si_mp-149__2_2_1_", "Interstitial-enhanced_Training_Set_57", "Vacancy-enhanced_Training_Set_57" ]
null
data/MD/5428/MD_3029330070173112270945428.json
data/MD/5202/MD_1086845055867124744315202.json
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PO_3796988241874337746982824
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2025-04-16T17:17:43
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-297.150282
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Si64
Si
A
[ "Si" ]
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64
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null
data/MD/5428/MD_3029330070173112270945428.json
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null
null
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2025-04-16T21:52:07
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-62.658297
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null
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Si12
Si
A
[ "Si" ]
[ 1 ]
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12
1
3
[ 1, 1, 1 ]
[ "train_Si_surface_mp_Si_mp-149__1_1_1_", "Interstitial-enhanced_Training_Set_54", "Vacancy-enhanced_Training_Set_54" ]
null
data/MD/5428/MD_3029330070173112270945428.json
data/MD/5202/MD_1086845055867124744315202.json
null
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2025-04-16T15:23:14
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-82.010383
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null
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null
null
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Si16
Si
A
[ "Si" ]
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16
1
3
[ 1, 1, 1 ]
[ "train_Si_surface_mp_Si_mp-149__1_0_0__reconstructed", "Interstitial-enhanced_Training_Set_60", "Vacancy-enhanced_Training_Set_60" ]
null
data/MD/5428/MD_3029330070173112270945428.json
data/MD/5202/MD_1086845055867124744315202.json
null
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2025-04-16T19:02:23
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-298.608197
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Si64
Si
A
[ "Si" ]
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64
1
3
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null
data/MD/5428/MD_3029330070173112270945428.json
null
null
null
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2025-04-16T21:14:40
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
-294.951482
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null
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Si64
Si
A
[ "Si" ]
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64
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null
data/MD/5428/MD_3029330070173112270945428.json
data/MD/5202/MD_1086845055867124744315202.json
null
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2025-04-16T21:56:50
DS_eltotrjoqonr_0
1
VASP
DFT-PBE
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Si64
Si
A
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2025-04-16T17:10:51
DS_eltotrjoqonr_0
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2025-04-16T20:49:43
DS_eltotrjoqonr_0
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2025-04-17T18:37:27
DS_eltotrjoqonr_0
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2025-04-16T17:41:23
DS_eltotrjoqonr_0
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2025-04-16T20:16:51
DS_eltotrjoqonr_0
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2025-04-16T21:13:01
DS_eltotrjoqonr_0
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2025-04-16T19:02:23
DS_eltotrjoqonr_0
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