Property | Value |
---|---|
Space group | (191, "'P6/mmm'") |
Magnetic | False |
Band gap (PBE) (eV) | 0 |
Total energy (eV) | -12.584 |
Total energy / atom (eV) | -4.195 |
a, b, c (Å): | 4.370 | 4.370 | 3.450 |
α, β, γ(°): | 90.0 | 90.0 | 120.0 |
a, b, c (Å): | 4.410 | 4.410 | 3.480 |
α, β, γ(°): | 90.0 | 90.0 | 120.0 |
Property | Value |
---|---|
Bulk-modulus | 89.779 GPa |
Property | Value |
---|---|
Source | icsd-103124-Cu2Th1 |