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string | structure_hash
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list | nsites
int32 | nelements
int32 | nperiodic_dimensions
int32 | dimension_types
list | names
list | labels
list | property_metadata_path
string | configuration_metadata_path
string | hash
string | configuration_metadata
string | property_metadata
string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
PO_4468648475388243537017170
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| 2025-04-16T22:04:30
|
DS_lfyd4jv627cr_0
| 1
|
VASP
|
DFT-PBE
| -560.151174
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DS_lfyd4jv627cr_0
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VASP
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DFT-PBE
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DS_lfyd4jv627cr_0
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VASP
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DFT-PBE
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|
10684467563070008623891098084106617340932607201477543858782682018714257857458903145364615924771452085617949042253345731552728779987521176495248159788228995
| 2025-04-16T21:09:01
|
DS_lfyd4jv627cr_0
| 1
|
VASP
|
DFT-PBE
| -605.167546
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