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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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data/MD/4240/MD_9985399391223336507104240.json
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| 2025-04-16T18:59:47
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag12Au4
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A3B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4918979569136982680878477
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| 2025-04-16T20:58:52
|
DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Au32
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A
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag21Au11
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A21B11
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| 2025-04-16T21:27:46
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag2Au14
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AgAu7
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A7B
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|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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AgAu15
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A15B
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data/MD/4240/MD_9985399391223336507104240.json
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag11Au5
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Ag11Au5
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A11B5
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4923514999120815338364731
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| 2025-04-16T17:32:52
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag4Au12
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AgAu3
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A3B
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4923818823344484897735835
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| 2025-04-16T20:11:54
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag31Au
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Ag31Au
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A31B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4923357025695935540547089
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| 2025-04-17T18:16:17
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag6Au10
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Ag3Au5
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A5B3
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4923447157666721529618547
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| 2025-04-17T17:45:49
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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true
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Ag7Au41
|
Ag7Au41
|
A41B7
|
[
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4923734485727932153961634
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| 2025-04-16T20:53:47
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -65.371265
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Ag32
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Ag
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A
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data/MD/4240/MD_9985399391223336507104240.json
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag3Au13
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Ag3Au13
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A13B3
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4922674943495275768841026
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| 2025-04-16T16:31:52
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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CO_4149070450684415180582739
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Ag7Au9
|
Ag7Au9
|
A9B7
|
[
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[
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4922407878837296952262269
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| 2025-04-16T19:57:31
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
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AgAu15
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A15B
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data/MD/4240/MD_9985399391223336507104240.json
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| 2025-04-16T21:37:17
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag11Au5
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Ag11Au5
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A11B5
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PO_4922073631977813189719677
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| 2025-04-16T15:44:05
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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AgAu31
|
AgAu31
|
A31B
|
[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4922306919210194642829042
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| 2025-04-16T21:29:37
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
| -55.152059
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DS_t0ec1irmeo59_0
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Au32
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A
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag5Au27
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Ag5Au27
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A27B5
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PO_4924139498081836401296700
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| 2025-04-16T21:28:46
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag3Au13
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Ag3Au13
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A13B3
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4924469860811387055027763
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| 2025-04-16T21:56:50
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag16
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Ag
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A
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4924053687745614758703262
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| 2025-04-16T18:04:40
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag9Au23
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Ag9Au23
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A23B9
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4924196850783368803507989
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag15Au
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Ag15Au
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A15B
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| 2025-04-16T17:47:45
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag32
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Ag
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A
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4924696109951105011444850
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| 2025-04-16T20:25:42
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag28Au4
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Ag7Au
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A7B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4924494896755530278702385
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| 2025-04-16T17:31:20
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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CO_6570201717793620748938004
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Ag4Au12
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AgAu3
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A3B
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4924142434809912790918116
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| 2025-04-16T21:09:01
|
DS_t0ec1irmeo59_0
| 1
|
VASP
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DFT-PBE-D3
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| null | null | null | null | null | 0.133928
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CO_1308942446618530568421830
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true
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Ag5Au11
|
Ag5Au11
|
A11B5
|
[
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[
0.3125,
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| 2
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|
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4921707961577279919711950
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| 2025-04-16T18:55:55
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -29.029656
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| null | null | null | null | null | 6.373993
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CO_7937978129371815723431835
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[
true,
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true
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Ag12
|
Ag
|
A
|
[
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[
1
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[
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| 1
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|
[
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[
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data/MD/4240/MD_9985399391223336507104240.json
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag21Au11
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A21B11
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data/MD/4240/MD_9985399391223336507104240.json
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| 2025-04-16T18:33:21
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag22Au2
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Ag11Au
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A11B
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[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925885283041151077770860
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| 2025-04-16T20:13:01
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag12Au4
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Ag3Au
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A3B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925964680175343111561024
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| 2025-04-16T18:07:46
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag16
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Ag
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A
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925908385225881364781724
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| 2025-04-16T18:29:57
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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CO_2591659659582939022497087
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Ag26Au6
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Ag13Au3
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A13B3
|
[
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[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925023280443664682988401
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| 2025-04-16T17:18:55
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag30Au2
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Ag15Au
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A15B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925100354886964890690109
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag2Au14
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AgAu7
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A7B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4925405981715315322781391
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| 2025-04-16T18:47:34
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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AgAu31
|
AgAu31
|
A31B
|
[
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[
0.03125,
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4929806696136845499233808
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| 2025-04-16T16:32:50
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -40.09356
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DS_t0ec1irmeo59_0
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VASP
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Ag10Au6
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A5B3
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4929380440959338819084740
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| 2025-04-16T17:17:12
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag8Au8
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AgAu
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AB
|
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4928177784129097143418817
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| 2025-04-16T16:31:50
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Au16
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Au
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A
|
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1
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79,
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| 1
| 0
|
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0
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4928976009513443043743747
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| 2025-04-16T16:33:14
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag17Au15
|
Ag17Au15
|
A17B15
|
[
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[
0.53125,
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79,
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79,
79,
79
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| 2
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|
[
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0
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4927894342265845424087549
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| 2025-04-16T21:37:22
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -15.935517
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CO_1501653363222232292827060
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Au6
|
Au
|
A
|
[
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[
1
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[
79,
79,
79,
79,
79,
79
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| 1
| 0
|
[
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0
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
PO_4927925109465479147419558
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| 2025-04-16T20:39:54
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -55.329956
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| null | null | null | null | null | 0.416946
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CO_4532462832687672957904488
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[
true,
true,
true
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Ag10Au6
|
Ag5Au3
|
A5B3
|
[
"Ag",
"Au"
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[
0.625,
0.375
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47,
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79,
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79,
79,
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] | 16
| 2
| 0
|
[
0,
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0
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[
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] | null |
data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
PO_4927094986213343845310958
|
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| 2025-04-16T17:54:05
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -52.973187
|
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| 2025-04-16T20:20:36
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag2Au30
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A15B
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PO_4927725743435932769766702
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| 2025-04-16T20:16:22
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag3Au29
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Ag3Au29
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A29B3
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[
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4933287045112439876455621
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag44Au4
|
Ag11Au
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A11B
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| 2
| 0
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[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4933627352904034678331596
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|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
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CO_2613376620671248176659973
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Ag14Au2
|
Ag7Au
|
A7B
|
[
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[
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4933396795552633143703926
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| 2025-04-16T16:42:47
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -95.808817
|
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| null | null | null | null | null | 2.893104
| 1.255952
| null |
CO_2864007287626228011269236
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true
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Ag2Au30
|
AgAu15
|
A15B
|
[
"Ag",
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[
0.0625,
0.9375
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| 2
| 0
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[
0,
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0
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[
"data.583_set.000_7"
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4933645375469315919539132
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| 2025-04-16T18:33:38
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -55.240511
|
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| null | null | null | null | null | 1.346824
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CO_7525675903563112847830901
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true
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Au16
|
Au
|
A
|
[
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[
1
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79,
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79,
79,
79
] | 16
| 1
| 0
|
[
0,
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0
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[
"data.034_set.000_60"
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
PO_4933875878540188638444546
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| 2025-04-16T16:01:25
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -42.478528
|
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| null | null | null | null | null | 1.81075
| 0.786534
| null |
CO_1099378760577125866851075
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[
true,
true,
true
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Au12
|
Au
|
A
|
[
"Au"
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[
1
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[
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79,
79,
79,
79,
79,
79,
79,
79,
79
] | 12
| 1
| 0
|
[
0,
0,
0
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[
"data.025_set.000_94"
] | null |
data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
{"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"}
|
PO_4933248006664355247467623
|
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| 2025-04-16T21:37:22
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -32.670954
|
[
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DS_t0ec1irmeo59_0
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VASP
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Ag8Au24
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AgAu3
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A3B
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| 2025-04-16T20:19:31
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Au32
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Au
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A
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1
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4934118132932215034750771
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| 2025-04-16T18:07:48
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag19Au13
|
Ag19Au13
|
A19B13
|
[
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[
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4934091689017535867920886
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| 2025-04-16T22:03:29
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
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CO_1117547887397244364802090
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Ag2Au14
|
AgAu7
|
A7B
|
[
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[
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| 2
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4934747064160810131141212
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| 2025-04-16T20:27:55
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
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DS_t0ec1irmeo59_0
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Ag5Au11
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A11B5
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DS_t0ec1irmeo59_0
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VASP
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DS_t0ec1irmeo59_0
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DS_t0ec1irmeo59_0
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true
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Ag22Au10
|
Ag11Au5
|
A11B5
|
[
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[
0.6875,
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| 2
| 0
|
[
0,
0,
0
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4931792195721901730742391
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| 2025-04-16T20:58:52
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
| -50.268495
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CO_6527445183283913035015073
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Ag16
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Ag
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A
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1
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| 1
| 0
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[
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0
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4931227278957665861633626
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| 2025-04-16T21:51:46
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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| null | null | null | null | null | 0.113435
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CO_7752516827204808396246446
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Ag3Au13
|
Ag3Au13
|
A13B3
|
[
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[
0.1875,
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| 2
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|
[
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
PO_4931462026192667286005829
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| 2025-04-16T18:59:53
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -45.977957
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| null | null | null | null | null | 0.053004
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CO_1263359684025107626288848
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[
true,
true,
true
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Ag16
|
Ag
|
A
|
[
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[
1
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47,
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47,
47,
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47,
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] | 16
| 1
| 0
|
[
0,
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0
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[
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] | null |
data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
PO_4931266569866638800544938
|
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| 2025-04-16T17:59:02
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -123.092496
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag15Au
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A15B
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data/MD/4240/MD_9985399391223336507104240.json
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| 2025-04-16T18:21:55
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Au12
|
Au
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A
|
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4936278256209543762997942
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| 2025-04-16T18:22:38
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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DS_t0ec1irmeo59_0
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Ag15Au
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A15B
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PO_4936024366338583713755352
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DS_t0ec1irmeo59_0
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A7B5
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| 2025-04-16T16:21:06
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DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
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CO_1092080119847581069492282
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Ag5Au11
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Ag5Au11
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A11B5
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4936429036688539697278960
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| 2025-04-16T16:54:28
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag9Au23
|
Ag9Au23
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A23B9
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4937507697094448669789536
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| 2025-04-16T20:57:06
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -89.372099
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A25B7
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DS_t0ec1irmeo59_0
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Ag9Au23
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Ag9Au23
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A23B9
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag17Au15
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Ag17Au15
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A17B15
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data/MD/4240/MD_9985399391223336507104240.json
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag16Au16
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AB
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| 2025-04-16T20:46:51
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag14Au18
|
Ag7Au9
|
A9B7
|
[
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[
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4939015108438977938332921
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| 2025-04-16T16:09:58
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -39.875548
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Ag9Au7
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Ag9Au7
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A9B7
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data/MD/4240/MD_9985399391223336507104240.json
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DS_t0ec1irmeo59_0
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Ag9Au7
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Ag9Au7
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A9B7
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4939171480112225714042134
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| 2025-04-16T16:03:51
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag8Au8
|
AgAu
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AB
|
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_4939349293622223168950049
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| 2025-04-17T18:48:22
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag15Au
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A15B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4930054795427571557755898
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| 2025-04-16T15:44:28
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag15Au
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Ag15Au
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A15B
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PO_4930545339588061750533965
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| 2025-04-16T19:03:50
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag28Au4
|
Ag7Au
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A7B
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data/MD/4240/MD_9985399391223336507104240.json
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PO_4930057267475079256455502
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| 2025-04-16T18:52:57
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Au16
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Au
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A
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data/MD/4240/MD_9985399391223336507104240.json
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| 2025-04-16T16:05:15
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DS_t0ec1irmeo59_0
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| 2025-04-16T20:58:52
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DS_t0ec1irmeo59_0
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag6Au26
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Ag3Au13
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A13B3
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data/MD/4240/MD_9985399391223336507104240.json
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PO_1004078371367613563230705
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| 2025-04-16T21:27:46
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DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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Ag13Au3
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Ag13Au3
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A13B3
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_1004006855077017999560135
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| 2025-04-16T21:29:37
|
DS_t0ec1irmeo59_0
| 1
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VASP
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DFT-PBE-D3
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CO_1213282334002404304101624
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Ag12Au4
|
Ag3Au
|
A3B
|
[
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[
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_1004205955684949595778090
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| 2025-04-16T17:42:15
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -27.32327
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CO_1216796642648230358822147
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DS_t0ec1irmeo59_0
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| 2025-04-16T20:33:11
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DS_t0ec1irmeo59_0
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| 2025-04-16T15:44:40
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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Ag18Au14
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Ag9Au7
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A9B7
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[
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data/MD/4240/MD_9985399391223336507104240.json
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PO_1004285365394809525399513
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| 2025-04-16T21:52:07
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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CO_3509253703425359554063834
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Ag17Au15
|
Ag17Au15
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A17B15
|
[
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| 2
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_1004440409141064417243164
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| 2025-04-16T21:09:01
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
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CO_9287046090496234537214467
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Ag3Au13
|
Ag3Au13
|
A13B3
|
[
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| 2
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[
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data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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PO_1004425529390806844283182
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| 2025-04-16T16:32:54
|
DS_t0ec1irmeo59_0
| 1
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VASP
|
DFT-PBE-D3
| -93.54393
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DS_t0ec1irmeo59_0
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A13B3
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DS_t0ec1irmeo59_0
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VASP
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DFT-PBE-D3
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[
true,
true,
true
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Au16
|
Au
|
A
|
[
"Au"
] |
[
1
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[
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79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79,
79
] | 16
| 1
| 0
|
[
0,
0,
0
] |
[
"deepmd_set.000_49"
] | null |
data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
{"input": {"encut": {"value": 650, "units": "eV"}}, "hash": "9985399391223336507104240349147387433243557514633906439105331955381975213318101075814762881954519768656981458682509405813528289710302917162391265942695039", "id": "MD_9985399391223336507104240"}
|
PO_1004325828351201096965959
|
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| 2025-04-16T21:23:51
|
DS_t0ec1irmeo59_0
| 1
|
VASP
|
DFT-PBE-D3
| -102.385932
|
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| null | null | null | null | null | 1.009888
| 0.476944
| null |
CO_4702536032070554402794965
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[
true,
true,
true
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Au32
|
Au
|
A
|
[
"Au"
] |
[
1
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[
79,
79,
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79,
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79,
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| 1
| 0
|
[
0,
0,
0
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[
"deepmd_set.000_550"
] | null |
data/MD/4240/MD_9985399391223336507104240.json
| null | null | null |
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|
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