Ba2O6Te2
MatHub3d-12943-Ba2O6Te2
| Property | Value |
|---|---|
| Space group | (11, "'P2_1/m'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 2.72 |
| Total energy (eV) | -59.196 |
| Total energy / atom (eV) | -5.920 |
| a, b, c (Å): | 4.630 | 5.940 | 7.100 |
| α, β, γ(°): | 90.0 | 106.0 | 90.0 |
| a, b, c (Å): | 4.650 | 6.070 | 7.260 |
| α, β, γ(°): | 90.0 | 107.0 | 90.0 |
| n_type (eV): | 1.642 |
| p_type (eV): | 1.824 |
Ba2O6Te2
| Property | Value |
|---|---|
| Bulk-modulus | 87.298 GPa |
Ba2O6Te2
| Property | Value |
|---|---|
| Band gap | 2.72 eV |
| Band degeneracy(CBM) | 1.00 |
| Band degeneracy(VBM) | 8.00 |
n-type Seebeck coefficient (700K)
p-type Seebeck coefficient (700K)
n-type conductivity (700K)
p-type conductivity (700K)
n-type power factor (700K)
p-type power factor (700K)
| Eband_VBM | -4.01417 |
| Eband_CBM | -5.33224 |
| Property | Value |
|---|---|
| Source | icsd-10106-Ba2O6Te2 |