Formula | CsIPbBr2 |
Reduced formula | CsIPbBr2 |
Stoichiometry | ABCD2 |
Number of species | 4 |
Number of atoms | 5 |
Unique ID | 8 |
Unit cell volume [Å3] | 220.865 |
Direct GLLB-SC+SOC bandgap [eV] | 2.077 |
Indirect GLLB-SC+SOC bandgap [eV] | 1.909 |
GLLB-SC Derivative discontinuity [eV] | 0.871 |
Name given to the crystal structure | CsPbIBr2 |
Symmetry of the crystal | cubic |
Space group of the crystal | Pm-3m |
Energy [eV] | -16.076 |