Configuration Set
Hydrogen-induced_insulating_state_SmNiO3_6H_apical__CS_qa3htulpm4ug_0
| Name | Hydrogen-induced_insulating_state_SmNiO3_6H_apical |
|---|---|
| Extended ID | Hydrogen-induced_insulating_state_SmNiO3_6H_apical__CS_qa3htulpm4ug_0 |
| Description | Configurations with 6 H atoms bonded to apical oxygen from Hydrogen-induced_insulating_state_SmNiO3 dataset |
| Elements |
H (13.04%) Ni (17.39%) O (52.17%) Sm (17.39%) |
| Number of Configurations | 6 |
| Number of Atoms | 276 |
| Configurations |
CO_1366600851679191282 CO_831264096704001600 CO_93899095704529739 CO_625895051182803980 CO_983924800200986762 CO_1112807877138655460 |
| Datasets |
DS_r1sl5dye35kg_0 |
| ColabFit ID | CS_qa3htulpm4ug_0 |
| Files | colabfitspec.json |
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