Configuration Set
ferroelectricity_and_metallicity_in_BaTiO3_JMCC2021_supercell_niobium__CS_d3000dy7swfe_0
| Name | ferroelectricity_and_metallicity_in_BaTiO3_JMCC2021_supercell_niobium |
|---|---|
| Extended ID | ferroelectricity_and_metallicity_in_BaTiO3_JMCC2021_supercell_niobium__CS_d3000dy7swfe_0 |
| Description | Configurations of supercell BaTiO3 doped with niobium from ferroelectricity_and_metallicity_in_BaTiO3_JMCC2021 dataset |
| Elements |
Ba (20.0%) Nb (2.5%) O (60.0%) Ti (17.5%) |
| Number of Configurations | 75 |
| Number of Atoms | 3,000 |
| Configurations | |
| Datasets |
DS_w5kzth1uof2y_0 |
| ColabFit ID | CS_d3000dy7swfe_0 |
| Files | colabfitspec.json |
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