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| 2025-04-17T18:37:27
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4412814450936229175274570
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| 2025-04-16T16:22:41
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -458.262468
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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O2Si
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4423652856458616147486035
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| 2025-04-16T20:16:22
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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[] | null | null | null | null | null | null | 7.26451
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O40Si20
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O2Si
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PO_4430413062630696278544467
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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CO_8227259083542292563803502
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O40Si20
|
O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4430345236169976496996741
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| 2025-04-16T16:07:38
|
DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -458.538378
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4800594836510214023599285
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| 2025-04-16T15:18:28
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -458.698206
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O40Si20
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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O40Si20
|
O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4804835215560330189134367
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| 2025-04-16T18:35:06
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -455.831814
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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| 2025-04-16T16:04:01
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DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -458.29193
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[] | null | null | null | null | null | null | 5.896055
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CO_1094950291699754071993428
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O40Si20
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O2Si
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A2B
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| 2
| 0
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4810820233050155158948224
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| 2025-04-16T17:47:31
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -456.574053
|
[
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[] | null | null | null | null | null | null | 7.443872
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
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O2Si
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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CO_1207443542769140390130908
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4821691291727544243083282
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| 2025-04-16T17:42:29
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -454.37583
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CO_4691648954595400719037094
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O40Si20
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DS_w2ngtxl0ep5d_0
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4824623910460315772528133
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| 2025-04-16T18:42:23
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -458.544612
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O2Si
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PO_4827124283733560848950005
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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CO_2788831232964031898359533
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O40Si20
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O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4827736009817846835469783
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| 2025-04-16T22:03:29
|
DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -454.765429
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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CO_1155263033647891702253964
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O40Si20
|
O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4829202046447449944855837
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| 2025-04-16T18:47:29
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -458.951763
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O40Si20
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O2Si
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A2B
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PO_4831321407427976208866294
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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CO_1317720327402374285547725
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O40Si20
|
O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4831858932098736858164111
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| 2025-04-16T21:13:01
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -455.501991
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[] | null | null | null | null | null | null | 6.415993
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4830122536163771202257209
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| 2025-04-16T21:21:56
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -458.073638
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[] | null | null | null | null | null | null | 6.053314
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CO_5429639589297132744787790
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O40Si20
|
O2Si
|
A2B
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[
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4808402173695722749073229
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| 2025-04-16T21:37:17
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
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[] | null | null | null | null | null | null | 8.657198
| 2.942494
| null |
CO_3129532647308778140164432
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O40Si20
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O2Si
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A2B
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| 2
| 0
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[
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4809726839867275547834600
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| 2025-04-16T19:02:01
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -456.777139
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[] | null | null | null | null | null | null | 8.028844
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CO_1250322145816282725582107
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
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VASP
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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O40Si20
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O2Si
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A2B
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| 2025-04-16T16:07:32
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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CO_9144038454587743309020210
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4840157170954897533650310
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| 2025-04-16T18:29:13
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -456.217938
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4845438298479425236690284
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| 2025-04-16T15:44:54
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -458.944354
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4850083611697360454851028
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| 2025-04-16T21:52:07
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4849574587365957839516270
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| 2025-04-16T16:28:19
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -458.685215
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DS_w2ngtxl0ep5d_0
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VASP
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data/MD/5165/MD_7964639482890510039065165.json
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4871448393549582637540605
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| 2025-04-17T17:56:16
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4853181030341198728558864
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| 2025-04-16T16:32:30
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4851434259102330549304772
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| 2025-04-16T21:30:02
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -459.330772
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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O40Si20
|
O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4860807838093784841956162
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| 2025-04-16T21:35:56
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -456.965491
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O40Si20
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O2Si
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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[] | null | null | null | null | null | null | 6.966883
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CO_1004087062571883107652129
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O40Si20
|
O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4863642101930759734320741
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| 2025-04-16T19:57:46
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -456.219898
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| 2025-04-16T17:32:52
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -457.432193
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[] | null | null | null | null | null | null | 7.855888
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O40Si20
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O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4889528223765369060920693
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| 2025-04-16T18:11:19
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -459.301764
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[] | null | null | null | null | null | null | 9.230961
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4882007947597742643890079
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| 2025-04-16T21:22:14
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
| -455.247745
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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| 2025-04-16T19:49:36
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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PO_4892160416125957961698524
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| 2025-04-16T20:04:32
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -455.92144
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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CO_1114933513775092438708558
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O40Si20
|
O2Si
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A2B
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4894893593671772808447434
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| 2025-04-16T15:44:44
|
DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -457.094454
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DS_w2ngtxl0ep5d_0
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DFT-PBE
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| 2025-04-16T16:55:31
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -457.529582
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[] | null | null | null | null | null | null | 6.591038
| 2.701022
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CO_6059573724878858839915290
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O40Si20
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O2Si
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A2B
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| 2
| 0
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[
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[
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data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
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PO_4896271535294737215436471
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| 2025-04-16T21:04:12
|
DS_w2ngtxl0ep5d_0
| 1
|
VASP
|
DFT-PBE
| -456.384034
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[] | null | null | null | null | null | null | 6.096235
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CO_9978440579751470974053826
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O40Si20
|
O2Si
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A2B
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[
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[
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DS_w2ngtxl0ep5d_0
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DS_w2ngtxl0ep5d_0
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O40Si20
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O2Si
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A2B
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| 2025-04-16T16:26:23
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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O2Si
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DS_w2ngtxl0ep5d_0
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VASP
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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O40Si20
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O2Si
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A2B
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DS_w2ngtxl0ep5d_0
| 1
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VASP
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DFT-PBE
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DS_w2ngtxl0ep5d_0
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VASP
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DFT-PBE
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O40Si20
|
O2Si
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A2B
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data/MD/5165/MD_7964639482890510039065165.json
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| 2025-04-17T17:45:49
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DS_w2ngtxl0ep5d_0
| 1
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VASP
|
DFT-PBE
| -456.626392
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[] | null | null | null | null | null | null | 6.643287
| 2.977342
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CO_3212431083995874804617001
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[
true,
true,
true
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O40Si20
|
O2Si
|
A2B
|
[
"O",
"Si"
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[
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| 2
| 0
|
[
0,
0,
0
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[
"SIMPLE_NN_SiO2_8266"
] | null |
data/MD/5165/MD_7964639482890510039065165.json
| null | null | null |
{"input": {"encut": {"value": 500, "units": "eV"}}, "hash": "7964639482890510039065165051658847026093934348828101062120947938162970662739496050937512370254508847409185916777813992712077345296435453266837166248028598", "id": "MD_7964639482890510039065165"}
|
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