Formula AuNVO2
Reduced formula AuNVO2
Stoichiometry ABCD2
Number of species 4
Number of atoms 5
Unique ID 15
Unit cell volume [Å3] 60.932
A-ion in the cubic perovskite Au
B-ion in the cubic perovskite V
Anion combination in the perovskite O2N
Direct bandgap GLLB-SC [eV] 0.000
Indirect bandgap GLLB-SC [eV] 0.000
Heat of formation [eV] 1.020
General formula ABO2N
Direct position of the conduction band edge 6.117
Indirect position of the conduction band edge 6.117
Direct position of the valence band edge 6.117
Indirect position of the valence band edge 6.117
Standard energy -0.922
Energy [eV] -29.080
XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 3.935 0.000 0.000 Yes
2 0.000 3.935 0.000 Yes
3 0.000 0.000 3.935 Yes
Lengths [Å] 3.935 3.935 3.935
Angles [°] 90.000 90.000 90.000