Li8O6Pb1
MatHub3d-61397-Li8O6Pb1
| Property | Value |
|---|---|
| Space group | (148, "'R-3'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 2.34 |
| Total energy (eV) | -74.302 |
| Total energy / atom (eV) | -4.953 |
Lattice Parameters(from the source)
| a, b, c (Å): | 5.540 | 5.540 | 15.630 |
| α, β, γ(°): | 90.0 | 90.0 | 120.0 |
Lattice Parameters(computed)
| a, b, c (Å): | 6.180 | 6.180 | 6.180 |
| α, β, γ(°): | 54.0 | 54.0 | 54.0 |
Deformation Potential
| n_type (eV): | -4.235 |
| p_type (eV): | 2.434 |
Li8O6Pb1
| Property | Value |
|---|---|
| Bulk-modulus | 94.220 GPa |
Li8O6Pb1
| Property | Value |
|---|---|
| Band gap | 2.34 eV |
| Band degeneracy(CBM) | 1.00 |
| Band degeneracy(VBM) | 2.00 |
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 | -21.44596 |
| Eband_CBM | -0.51564 |
| Property | Value |
|---|---|
| Source | icsd-10062-Li8O6Pb1 |