Datasets:
colabfit
/
Au-PBE_MSMSE_2021

Dataset card Data Studio Files Community
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CO_1179298577366175667828716
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
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CO_1179298577366175667828716
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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[ 3 ]
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[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
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CO_1181565397467664339404769
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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[ 3 ]
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[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
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CO_1181565397467664339404769
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
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MD_9985399391223336507104240
2024-08-16T15:30:17
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1182334514475103388755969
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:30:17
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1182334514475103388755969
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
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2023-12-01T18:25:53
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:21:42
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[ "data.000_set.000_18" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1184593151323939554573322
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
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0
19,433
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:21:42
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null
null
null
[ "data.000_set.000_18" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1184593151323939554573322
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:06:12
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null
null
null
[ "data.020_set.000_8" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1186801603207834846899833
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
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MD_9985399391223336507104240
2024-08-16T15:06:12
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PO_5395344758336070626132998
null
null
null
[ "data.020_set.000_8" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
11868016032078348468998339316128869665526564743997060930825068771160956038552292515274555744028274176447318472354434424095709368523516621509487724722196627
CO_1186801603207834846899833
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:13:47
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null
null
null
[ "deepmd_set.000_386" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1186963207370299630434551
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:13:47
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PO_3969911532186511317629428
null
null
null
[ "deepmd_set.000_386" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
11869632073702996304345514451082950318415547111918121868397642794877259370838397551742428751928460521552827849235440694607373593639365965632032922868698913
CO_1186963207370299630434551
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:36:34
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null
null
null
[ "data.026_set.000_65" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1187860817451846238267679
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:36:34
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null
null
null
[ "data.026_set.000_65" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1187860817451846238267679
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
6
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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true
null
null
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MD_9985399391223336507104240
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CO_1187998765081093322668796
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:28:47
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2023-12-01T23:25:28
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CO_1187998765081093322668796
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
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[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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[ "Au" ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:36:13
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PO_1132129813552295630781528
null
null
null
[ "deepmd_set.000_61" ]
[ "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1188534059403465359188715
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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310,792
0
19,433
0
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:47:52
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null
null
[ "data.039_set.000_86" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1188841131061348828489179
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:47:52
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[ "data.039_set.000_86" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1188841131061348828489179
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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MD_9985399391223336507104240
2024-08-16T14:47:32
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2023-12-01T23:25:27
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CO_1190340320210234833339777
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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19,434
310,792
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19,433
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2023-12-01T18:25:53
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:47:32
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null
null
null
[ "data.033_set.000_59" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1190340320210234833339777
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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310,792
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:15:23
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PO_4680787606773601314924879
null
null
null
[ "deepmd_set.000_516" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1190607216546886410476251
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:15:23
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PO_4033441698638702222598301
null
null
null
[ "deepmd_set.000_516" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1190607216546886410476251
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,433
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2023-12-01T18:25:53
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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[ "Au" ]
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:50:53
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PO_5373565382822017309482587
null
null
null
[ "data.002_set.000_49" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
11907522638791280203553912452108808252337619066924392564934521564187565040816057738508777789183168444591148375384774718976300765194331869105107570439543525
CO_1190752263879128020355391
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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VASP, DP-GEN
DFT-PBE-D3
null
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null
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true
null
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MD_9985399391223336507104240
2024-08-16T14:50:53
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PO_1047474199351193550384304
null
null
null
[ "data.002_set.000_49" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1190752263879128020355391
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
6
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1
VASP, DP-GEN
DFT-PBE-D3
null
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true
null
null
-9.995353
null
1.943975
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MD_9985399391223336507104240
2024-08-16T14:34:40
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PO_2519353301313890945730753
null
null
null
[ "data.037_set.000_79" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1192265992619070024855452
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
6
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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true
null
null
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null
1.953738
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MD_9985399391223336507104240
2024-08-16T14:34:40
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PO_1266927972253079784789104
null
null
null
[ "data.037_set.000_79" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
11922659926190700248554520103055901923975762101571563185562163414297161688918930737984635428579555721967703672428737109587747078040776016659595012186689677
CO_1192265992619070024855452
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
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true
null
null
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null
0.020369
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{"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"}
MD_9985399391223336507104240
2024-08-16T15:32:40
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PO_7414621743041968648916404
null
null
null
[ "deepmd_set.000_252" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
11930543173348020353537630233322742232831732137939157945864393140123901358735964491043397623932625834907832340379815427681894215714607922258980341279630164
CO_1193054317334802035353763
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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[ true, true, true ]
[ 1, 1, 1 ]
3
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:32:40
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null
null
null
[ "deepmd_set.000_252" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1193054317334802035353763
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
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19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:22:01
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[ "data.026_set.000_17" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1193536214616225133460050
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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1
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:22:01
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null
null
null
[ "data.026_set.000_17" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1193536214616225133460050
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:48:15
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PO_9400775954428941819371136
null
null
null
[ "deepmd_set.000_220" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1196077891794901322314679
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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[ "Au" ]
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:48:15
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PO_5197357621500797644269689
null
null
null
[ "deepmd_set.000_220" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1196077891794901322314679
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
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MD_9985399391223336507104240
2024-08-16T15:01:30
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PO_1067270934675181331292158
null
null
null
[ "data.008_set.000_80" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
11968896185396998887859381885922699911505247475189546633683410910330968736441589936648836433584301897722647454929790410096208789473219790931854504808825531
CO_1196889618539699888785938
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
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MD_9985399391223336507104240
2024-08-16T15:01:30
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PO_1016349024549945773934154
null
null
null
[ "data.008_set.000_80" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
11968896185396998887859381885922699911505247475189546633683410910330968736441589936648836433584301897722647454929790410096208789473219790931854504808825531
CO_1196889618539699888785938
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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MD_9985399391223336507104240
2024-08-16T14:21:04
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2023-12-01T23:25:28
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CO_1199488077967886807293460
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
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2023-12-01T18:25:53
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2023
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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1
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DFT-PBE-D3
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2024-08-16T14:21:04
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1199488077967886807293460
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:19:13
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1201268588312676553936487
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:19:13
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1201268588312676553936487
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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DFT-PBE-D3
null
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true
null
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MD_9985399391223336507104240
2024-08-16T15:21:22
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PO_8006141818652591811576549
null
null
null
[ "data.002_set.000_5" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1202061368559679465986911
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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19,433
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1,056.13888
0
2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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1
VASP, DP-GEN
DFT-PBE-D3
null
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true
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MD_9985399391223336507104240
2024-08-16T15:21:22
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PO_1040192003403310266049203
null
null
null
[ "data.002_set.000_5" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
12020613685596794659869113474767483915064627249682454739936765583161078237395369485572188175263604365714987435014569337161395828017382353563593074939637713
CO_1202061368559679465986911
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
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true
null
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1.658079
{"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"}
MD_9985399391223336507104240
2024-08-16T14:56:07
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PO_2370307950413766504676702
null
null
null
[ "data.027_set.000_87" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
12042508344499608787790939492314264489538631111678047747915599159757871798761706780800143746595329203692853463907898335150232661397323277409444002397789634
CO_1204250834449960878779093
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:56:07
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null
null
null
[ "data.027_set.000_87" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1204250834449960878779093
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
null
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null
null
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MD_9985399391223336507104240
2024-08-16T15:15:04
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PO_1178942274487503479682488
null
null
null
[ "deepmd_set.000_137" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
12045616871488508571324511878111395582507360957406910572235133855657452862409234117944645166017270855087428217006302003366556145646068560180936016706571811
CO_1204561687148850857132451
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
null
3.596542
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MD_9985399391223336507104240
2024-08-16T15:15:04
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PO_9971949555735464579119523
null
null
null
[ "deepmd_set.000_137" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
12045616871488508571324511878111395582507360957406910572235133855657452862409234117944645166017270855087428217006302003366556145646068560180936016706571811
CO_1204561687148850857132451
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
32
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1
VASP, DP-GEN
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null
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MD_9985399391223336507104240
2024-08-16T15:21:45
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[ "data.000_set.000_32" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1205633321603104601281515
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:21:45
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null
null
null
[ "data.000_set.000_32" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1205633321603104601281515
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
12
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:59:17
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[ "data.027_set.000_61" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1205711310385743499060122
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
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2023-12-01T23:25:27
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CO_1205711310385743499060122
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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19,434
310,792
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
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DFT-PBE-D3
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2024-08-16T15:03:29
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1205777032585460585758987
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:03:29
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null
null
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[ "data.018_set.000_76" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1205777032585460585758987
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:12:15
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null
null
[ "data.008_set.000_20" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1211282334631506966178670
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
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0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:12:15
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[ "data.008_set.000_20" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1211282334631506966178670
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:13:02
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null
null
null
[ "data.032_set.000_42" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1211333740757207903360355
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:13:02
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[ "data.032_set.000_42" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1211333740757207903360355
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:19:47
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null
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[ "deepmd_set.000_398" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1215064207941959256085305
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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MD_9985399391223336507104240
2024-08-16T15:19:47
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[ "deepmd_set.000_398" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1215064207941959256085305
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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MD_9985399391223336507104240
2024-08-16T14:21:52
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1216806537331306903014326
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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19,434
310,792
0
19,433
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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MD_9985399391223336507104240
2024-08-16T14:21:52
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[ "deepmd_set.000_239" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1216806537331306903014326
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:10:30
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null
null
null
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1218116687950629730851144
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
0
2023-12-01T18:25:53
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
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1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:10:30
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[ "data.037_set.000_55" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1218116687950629730851144
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:46:56
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null
null
null
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1221195321050231821058989
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:46:56
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null
null
null
[ "deepmd_set.000_51" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1221195321050231821058989
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
6
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VASP, DP-GEN
DFT-PBE-D3
null
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2024-08-16T15:31:01
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CO_1221784886314385760776808
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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19,434
310,792
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
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VASP, DP-GEN
DFT-PBE-D3
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2024-08-16T15:31:01
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2023-12-01T23:25:28
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CO_1221784886314385760776808
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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0
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
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MD_9985399391223336507104240
2024-08-16T14:50:58
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2023-12-01T23:25:28
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CO_1225319583884729796585228
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
0
19,433
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:50:58
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2023-12-01T23:25:28
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CO_1225319583884729796585228
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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310,792
0
19,433
0
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19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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MD_9985399391223336507104240
2024-08-16T14:29:58
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1225330589323948110485630
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
0
19,433
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19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
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MD_9985399391223336507104240
2024-08-16T14:29:58
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[ "data.019_set.000_16" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
12253305893239481104856303316009521640842299541097595419957623419116426161640042412412378205867320600660777358661720183005073335520445234203314739076108207
CO_1225330589323948110485630
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:35:10
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null
null
null
[ "deepmd_set.000_290" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1228501744037256046464876
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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310,792
0
19,433
0
19,433
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:35:10
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PO_8623480648871010649052415
null
null
null
[ "deepmd_set.000_290" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1228501744037256046464876
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:34:06
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[ "data.026_set.000_59" ]
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2023-12-01T23:25:28
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CO_1228907625446943970185010
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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310,792
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2023-12-01T18:25:53
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2023
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:34:06
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2023-12-01T23:25:28
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CO_1228907625446943970185010
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
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2023-12-01T18:25:53
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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MD_9985399391223336507104240
2024-08-16T14:51:37
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[ "data.004_set.000_13" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1229099253235467996358758
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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MD_9985399391223336507104240
2024-08-16T14:51:37
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[ "data.004_set.000_13" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1229099253235467996358758
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:21:56
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null
null
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[ "data.016_set.000_24" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1230138861927797787633072
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:21:56
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null
null
null
[ "data.016_set.000_24" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1230138861927797787633072
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:36:36
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null
null
null
[ "data.024_set.000_2" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1230385127095208849547973
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:36:36
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null
null
null
[ "data.024_set.000_2" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1230385127095208849547973
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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[ "Au" ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:24:41
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PO_1035982070162550743476316
null
null
null
[ "deepmd_set.000_30" ]
[ "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1230535169241196640482430
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:27:14
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null
null
null
[ "data.035_set.000_36" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1231824695226747531114395
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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null
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MD_9985399391223336507104240
2024-08-16T15:27:14
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null
null
null
[ "data.035_set.000_36" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1231824695226747531114395
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
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MD_9985399391223336507104240
2024-08-16T14:35:12
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1233595024885319975104967
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
12
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:35:12
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null
null
[ "data.026_set.000_2" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1233595024885319975104967
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:22:11
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null
null
null
[ "data.009_set.000_30" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1234280641190828067535130
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
16
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:22:11
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null
null
null
[ "data.009_set.000_30" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1234280641190828067535130
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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MD_9985399391223336507104240
2024-08-16T15:11:17
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null
null
null
[ "deepmd_set.000_712" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235375559694404979411845
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:11:17
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null
null
null
[ "deepmd_set.000_712" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235375559694404979411845
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:26:26
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null
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null
[ "data.026_set.000_47" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235511959639527898946519
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:26:26
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[ "data.026_set.000_47" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235511959639527898946519
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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19,434
310,792
0
19,433
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19,433
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19,433
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1,056.13888
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2023-12-01T18:25:53
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[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:45:55
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null
null
null
[ "data.008_set.000_21" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235721405543342408414911
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
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1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:45:55
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null
null
null
[ "data.008_set.000_21" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1235721405543342408414911
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T14:33:50
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PO_5743315371334062982511748
null
null
null
[ "deepmd_set.000_581" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1235896996461356082099402
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au16
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
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VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T14:33:50
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PO_8211734902683789565396330
null
null
null
[ "deepmd_set.000_581" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1235896996461356082099402
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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1
VASP, DP-GEN
DFT-PBE-D3
null
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MD_9985399391223336507104240
2024-08-16T15:05:12
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null
null
null
[ "data.027_set.000_17" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1237914704829306639128793
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au12
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
[ 1 ]
1
12
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[ true, true, true ]
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1
VASP, DP-GEN
DFT-PBE-D3
null
[ [ -1.1949036374231814, -0.4504232929491007, 1.1226543642128768 ], [ -0.2814926426939417, -2.199046658972389, 3.1246232332923034 ], [ 0.1775308264423115, 0.14346279602192452, 0.2003793497026093 ], [ 0.023699553624084355, 2.751782150538994, -3.361183506722923 ], [ 0.218968166335573, -1.684465005355436, 0.21377877908850756 ], [ 1.2105802123220115, -1.437396174438872, 0.7674332114275285 ], [ -0.4992679530537786, 0.8619462802410108, 0.49671130590667434 ], [ 0.4003205847863365, 1.3794029903662108, -0.7334650942864721 ], [ -0.12888046015653243, 1.0271667288459765, -1.3750903958285814 ], [ 0.08804538823422618, -0.16185924127535822, 0.44480899181483324 ], [ -0.20726793049119202, -0.09253688154893339, -0.5041961191389253 ], [ 0.1926669085974424, -0.13803362441880027, -0.39645324029991363 ] ]
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MD_9985399391223336507104240
2024-08-16T15:05:12
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null
null
null
[ "data.027_set.000_17" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
12379147048293066391287935043566216351042082796019053172790698061504041525543515984317149147501719248378573071136339415920104287765459924463997497228580087
CO_1237914704829306639128793
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
19,433
0
19,433
0
19,433
-44.096294
1,056.13888
0
2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
2802025880753154267221489340519389059687490450969945696010258088058317431206872618514935754227354442191399130320279276932874029233709264614018879729764747
DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
[ 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ "Au" ]
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1
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1
VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
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[ "data.003_set.000_4" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
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CO_1240403760749407544365190
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
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LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au32
Au
A
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DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:00:26
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null
null
null
[ "data.003_set.000_4" ]
[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:28
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CO_1240403760749407544365190
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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310,792
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2023-12-01T18:25:53
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2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
[ 79, 79, 79, 79, 79, 79 ]
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VASP, DP-GEN
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MD_9985399391223336507104240
2024-08-16T15:01:58
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1241774616861564135565650
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
19,433
19,434
310,792
0
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1,056.13888
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0
Au6
Au
A
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VASP, DP-GEN
DFT-PBE-D3
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MD_9985399391223336507104240
2024-08-16T15:01:58
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[ "DS_t0ec1irmeo59_0", "DS_tydu7u0h0hhz_0" ]
2023-12-01T23:25:27
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CO_1241774616861564135565650
Au-PBE_MSMSE_2021
[ "Yinan Wang", "Xiaoyang Wang", "Linfeng Zhang", "Ben Xu", "Han Wang" ]
Approximately 20,000 configurations of Au used as part of a training dataset for a DP-GEN-based ML model for a Ag-Au nanoalloy potential.
[ "Au" ]
1
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0
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2023-12-01T18:25:53
[ [ 1, 1, 1 ] ]
[ 3 ]
2023
[ 1 ]
LGPL-3.0-only
{'source-publication': 'https://doi.org/10.48550/arXiv.2108.06232', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=Au-PBE', 'other': None}
10.60732/c4492535
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DS_tydu7u0h0hhz_0
Au-PBE_MSMSE_2021__Wang-Wang-Zhang-Xu-Wang__DS_tydu7u0h0hhz_0