Formula | LaOTaN2 |
Reduced formula | LaOTaN2 |
Stoichiometry | ABCD2 |
Number of species | 4 |
Number of atoms | 5 |
Unique ID | 10 |
Unit cell volume [Å3] | 71.044 |
Name of the structure | LaTaON2 |
Perovskite phase | cubic |
Direct bandgap GLLB-SC [eV] | 1.818 |
Indirect bandgap GLLB-SC [eV] | 1.527 |
Derivative discontinuity GLLB-SC [eV] | 0.377 |
Calculated efficiency (thickness 1 nm) [eV] | 0.211 |
Calculated efficiency (infinite thickness) [eV] | 0.282 |
Energy [eV] | -46.283 |
Total magnetic moment [μB] | 0.000 |