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PO_4567982524271306647601316
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DS_gzbvdicu231p_0
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VASP
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A
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PO_4567158280671581435131759
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| 2025-04-16T18:25:21
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DS_gzbvdicu231p_0
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PO_4567097480487876829632640
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| 2025-04-16T16:55:27
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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data/MD/9926/MD_3140906615584827818889926.json
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PO_4588290844692532941306131
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_1179677559744792301882566
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Re16
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Re
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A
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[
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data/MD/9926/MD_3140906615584827818889926.json
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PO_4588988913731902508305242
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| 2025-04-16T17:12:08
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_9797495003131823411209210
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Re16
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Re
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A
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[
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_4589164990911510875902117
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| 2025-04-17T18:16:17
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_3399527315526037553898489
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Re17
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_4587165731557260963084550
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| 2025-04-16T15:41:55
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_1494104314036308421956695
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Re17
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Re
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A
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[
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1017531709257066065843623
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| 2025-04-16T18:45:21
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re8
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Re
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A
|
[
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3322/MD_8097482567437995173613322.json
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PO_1056426791021207675259841
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| 2025-04-16T16:51:12
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
| -201.182129
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[
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Re17
|
Re
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A
|
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1
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[
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/2008/MD_1951564499902567866502008.json
| null |
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PO_1056367691724851494153683
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| 2025-04-16T21:29:37
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
| -187.643585
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Re17
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Re
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A
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1056751881978737252368222
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DS_gzbvdicu231p_0
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Re16
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A
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1056741219665266464351756
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DS_gzbvdicu231p_0
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VASP
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Re17
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1017375180683985103349064
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10173751806839851033490642278029330503529430345955499724082026700516887955682951970020096611783731426021662838517033799495071928051295925000468636258759010
| 2025-04-16T16:25:53
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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data/MD/5003/MD_1166700323867994481595003.json
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PO_1017385636129807755136625
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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PO_4621549165506816620819337
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| 2025-04-16T18:49:16
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DS_gzbvdicu231p_0
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VASP
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Re16
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Re
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A
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data/MD/3559/MD_3894327761601644436733559.json
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PO_1057416242271597063600751
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| 2025-04-16T16:32:22
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DS_gzbvdicu231p_0
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VASP
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Re17
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A
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1058095516742952273645741
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| 2025-04-16T18:45:26
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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Re17
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| 2025-04-16T17:47:42
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DS_gzbvdicu231p_0
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VASP
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_4599213307247216961713992
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| 2025-04-16T16:51:20
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re8
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Re
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A
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PO_4600467320821095912811925
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| 2025-04-16T17:03:14
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re32
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data/MD/9475/MD_4820518588507787498309475.json
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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Re32
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Re
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data/MD/9475/MD_4820518588507787498309475.json
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PO_4625389914243229585457865
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DS_gzbvdicu231p_0
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Re17
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PO_1059657283962142934824305
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DS_gzbvdicu231p_0
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1060013986749438631565721
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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Re32
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Re
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data/MD/9539/MD_8072777543375650454349539.json
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PO_1019398814282577728103004
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DS_gzbvdicu231p_0
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VASP
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Re16
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Re
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A
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1019422158147746070475704
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re17
|
Re
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A
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1
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/2008/MD_1951564499902567866502008.json
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PO_1018303962793917288334869
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| 2025-04-16T20:16:51
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
| -196.480927
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PO_1018396910054988128655759
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DS_gzbvdicu231p_0
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Re17
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PO_1058415245208195224724928
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DS_gzbvdicu231p_0
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VASP
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1058236542669086262726784
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| 2025-04-16T20:44:11
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_5691758184995975634306622
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Re17
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Re
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A
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1058715616188718087664769
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| 2025-04-16T18:10:42
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_1144816554371354527467188
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Re16
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Re
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A
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[
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1
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[
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_1058755328313875278615516
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| 2025-04-16T16:06:22
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_6767463380475432164101425
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Re8
|
Re
|
A
|
[
"Re"
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[
1
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[
75,
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3322/MD_8097482567437995173613322.json
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PO_1058610152976977151919908
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| 2025-04-16T17:52:40
|
DS_gzbvdicu231p_0
| 1
|
VASP
|
DFT-PBE
| -196.511459
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CO_3627019620872569477994475
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[
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true
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Re16
|
Re
|
A
|
[
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[
1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1018822257360566550026312
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| 2025-04-16T18:54:19
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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Re8
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Re
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A
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[
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[
1
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[
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3322/MD_8097482567437995173613322.json
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PO_4629145043566746106507856
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| 2025-04-16T15:43:10
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re17
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Re
|
A
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[
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_4639172470727646272712541
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| 2025-04-16T18:34:37
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re16
|
Re
|
A
|
[
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[
1
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[
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/9926/MD_3140906615584827818889926.json
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PO_4640757865577201029584412
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| 2025-04-16T21:52:07
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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DS_gzbvdicu231p_0
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| 2025-04-16T21:14:40
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re32
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/9539/MD_8072777543375650454349539.json
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PO_4645285477854183511137526
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| 2025-04-16T18:26:34
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_7290761693731209705482662
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_4645383630294259228581213
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| 2025-04-16T21:13:01
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
| -63.406372
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CO_9473118248343152742603800
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DS_gzbvdicu231p_0
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PO_4651412911015180120918353
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_4655066853128451515726309
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DS_gzbvdicu231p_0
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VASP
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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VASP
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PO_1019671236266008741599170
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DS_gzbvdicu231p_0
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1060421848727450450666233
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DS_gzbvdicu231p_0
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VASP
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DS_gzbvdicu231p_0
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Re16
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Re
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1019894889189519445697425
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DS_gzbvdicu231p_0
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Re8
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data/MD/3322/MD_8097482567437995173613322.json
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PO_4669299411970371853672550
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| 2025-04-16T20:35:09
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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Re8
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Re
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A
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[
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[
1
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[
75,
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/5003/MD_1166700323867994481595003.json
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PO_4670605949189215542054759
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| 2025-04-16T21:28:46
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_5040259848110396653811911
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Re16
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Re
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A
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[
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_4671613526703981745849146
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| 2025-04-16T16:28:49
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_1182999382469592929469666
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Re8
|
Re
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A
|
[
"Re"
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[
1
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[
75,
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2668/MD_3580205984756795750502668.json
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PO_4672281687031856568016594
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4672281687031856568016594139462644008058240198223099743906055339191397616800734348489451976604110193239088814739171060870354084735975126078085049916579713
| 2025-04-16T18:13:40
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
| -167.437561
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CO_8468135878118170011039694
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[
true,
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true
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Re15
|
Re
|
A
|
[
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[
1
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| 1
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[
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/3559/MD_3894327761601644436733559.json
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PO_4672021851045374938636297
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| 2025-04-16T20:03:41
|
DS_gzbvdicu231p_0
| 1
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VASP
|
DFT-PBE
| -96.90641
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CO_1005114992058085892359546
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Re8
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Re
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A
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1
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data/MD/5003/MD_1166700323867994481595003.json
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PO_4673478653383860537701707
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| 2025-04-16T16:29:44
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DS_gzbvdicu231p_0
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VASP
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CO_1086983515874686308056568
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Re16
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Re
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A
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_1020784840291116729070621
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| 2025-04-16T16:29:35
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_7301777679313799515284938
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Re8
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Re
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A
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[
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1
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[
75,
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3322/MD_8097482567437995173613322.json
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PO_4667645913137477570894055
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| 2025-04-16T22:04:30
|
DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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CO_4300569395028717679725464
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Re17
|
Re
|
A
|
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1
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/3559/MD_3894327761601644436733559.json
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PO_4661532933218161184078863
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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Re
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data/MD/9475/MD_4820518588507787498309475.json
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PO_1020905968778313754957011
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DS_gzbvdicu231p_0
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VASP
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Re16
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data/MD/2008/MD_1951564499902567866502008.json
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PO_1021215462523041219299128
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| 2025-04-16T21:43:25
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DS_gzbvdicu231p_0
| 1
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VASP
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Re16
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Re
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A
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/9926/MD_3140906615584827818889926.json
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PO_1021673449346613098159387
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| 2025-04-16T16:54:17
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DS_gzbvdicu231p_0
| 1
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VASP
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DFT-PBE
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DS_gzbvdicu231p_0
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DS_gzbvdicu231p_0
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PO_1063492209415534347373275
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DS_gzbvdicu231p_0
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PO_1022173590681612207821555
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DS_gzbvdicu231p_0
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PO_4715135299294631451576247
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DS_gzbvdicu231p_0
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PO_4717951824314273907345323
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DS_gzbvdicu231p_0
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VASP
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Re
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A
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PO_4694583490314678265489050
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| 2025-04-16T15:44:21
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DS_gzbvdicu231p_0
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VASP
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data/MD/8121/MD_1213582242930949697188121.json
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data/MD/2008/MD_1951564499902567866502008.json
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PO_4721512085398757391959108
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DS_gzbvdicu231p_0
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VASP
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CO_1807734321991974702185350
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Re32
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Re
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A
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[
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[
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/9539/MD_8072777543375650454349539.json
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{"input": {"ALGO": "fast", "EDIFF": "1E-8", "ENCUT": "400", "IBRION": "0", "ICHARG": "0", "ISIF": "2", "ISMEAR": "1", "ISTART": "0", "ISYM": "0", "KBLOCK": "10", "KGAMMA": "F", "KPAR": "16", "KSPACING": "0.24", "LCHARG": "T", "LREAL": "F", "LWAVE": "F", "MAXMIX": "50", "NBLOCK": "1", "NELM": "200", "NELMIN": "4", "NPAR": "8", "POTIM": "2", "PREC": "A", "PSTRESS": "0", "SIGMA": "0.15", "SMASS": "-1", "file-type": "INCAR"}, "hash": "12135822429309496971881212100548754870478961791137930949625877367285087883313386750731592539663054471050405358418449513543996992751906584969573924479043013", "id": "MD_1213582242930949697188121"}
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PO_4725597435734154950252396
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DS_gzbvdicu231p_0
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VASP
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DFT-PBE
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CO_1041000767598951134447561
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Re16
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Re
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A
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[
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data/MD/8121/MD_1213582242930949697188121.json
|
data/MD/9926/MD_3140906615584827818889926.json
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