Formula | Ca2Pb2Ti2Zr2O12 |
Reduced formula | CaPbTiZrO6 |
Stoichiometry | ABCDE6 |
Number of species | 5 |
Number of atoms | 20 |
Unique ID | 21 |
Unit cell volume [Å3] | 268.870 |
Direct bandgap GLLB-SC [eV] | 4.443 |
Indirect bandgap GLLB-SC [eV] | 4.347 |
Derivative discontinuity GLLB-SC [eV] | 0.892 |
double ruddlesden-popper or dion-jacobsen | double |
Composition | PbZrCaTi-ox |
Energy [eV] | -159.668 |