Mg2Sb2Sr1
MatHub3d-62773-Mg2Sb2Sr1
| Property | Value |
|---|---|
| Space group | (164, "'P-3m1'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 0.98 |
| Total energy (eV) | -16.718 |
| Total energy / atom (eV) | -3.344 |
| a, b, c (Å): | 4.700 | 4.700 | 7.830 |
| α, β, γ(°): | 90.0 | 90.0 | 120.0 |
| a, b, c (Å): | 4.750 | 4.750 | 7.880 |
| α, β, γ(°): | 90.0 | 90.0 | 120.0 |
| n_type (eV): | 3.648 |
| p_type (eV): | 2.662 |
Mg2Sb2Sr1
| Property | Value |
|---|---|
| Bulk-modulus | 39.555 GPa |
Mg2Sb2Sr1
| Property | Value |
|---|---|
| Band gap | 0.98 eV |
| Band degeneracy(CBM) | 3.00 |
| Band degeneracy(VBM) | 3.00 |
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 | -1.45532 |
| Eband_CBM | -1.88361 |
| Property | Value |
|---|---|
| Source | icsd-100046-Mg2Sb2Sr1 |