Dy1Se2Tl1
MatHub3d-40490-Dy1Se2Tl1
| Property | Value |
|---|---|
| Space group | (166, "'R-3m'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 1.29 |
| Total energy (eV) | -19.320 |
| Total energy / atom (eV) | -4.830 |
| a, b, c (Å): | 4.140 | 4.140 | 23.090 |
| α, β, γ(°): | 90.0 | 90.0 | 120.0 |
| a, b, c (Å): | 8.130 | 8.130 | 8.130 |
| α, β, γ(°): | 30.0 | 30.0 | 30.0 |
| n_type (eV): | 3.183 |
| p_type (eV): | 0.326 |
Dy1Se2Tl1
| Property | Value |
|---|---|
| Bulk-modulus | 48.013 GPa |
Dy1Se2Tl1
| Property | Value |
|---|---|
| Band gap | 1.29 eV |
| Band degeneracy(CBM) | 6.00 |
| Band degeneracy(VBM) | 1.00 |
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 | -0.20191 |
| Eband_CBM | -7.25841 |
| Property | Value |
|---|---|
| Source | icsd-106991-Dy1Se2Tl1 |