Formula | BaSnO3 |
Reduced formula | BaSnO3 |
Stoichiometry | ABC3 |
Number of species | 3 |
Number of atoms | 5 |
Unique ID | 1 |
Unit cell volume [Å3] | 68.921 |
Direct bandgap GLLB-SC [eV] | 3.632 |
Indirect bandgap GLLB-SC [eV] | 3.326 |
Derivative discontinuity GLLB-SC [eV] | 0.869 |
Cubic perovskite labeled as A-combination | BaSnO3 |
Cubic perovskite labeled as B-combination | BaTaO2N |
Sequence of A and B layers | A |
GLLBSC Gamma-gap | 3.632 |
Energy [eV] | -33.984 |