As6S6
MatHub3d-6559-As6S6
| Property | Value |
|---|---|
| Space group | (36, "'Cmc2_1'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 0 |
| Total energy (eV) | -51.127 |
| Total energy / atom (eV) | -4.261 |
| a, b, c (Å): | 20.380 | 8.510 | 11.220 |
| α, β, γ(°): | 90.0 | 90.0 | 90.0 |
| a, b, c (Å): | 6.100 | 6.100 | 9.730 |
| α, β, γ(°): | 90.0 | 90.0 | 48.0 |
As6S6
| Property | Value |
|---|---|
| Band gap | 0 eV |
| Band degeneracy(CBM) | 0.00 |
| Property | Value |
|---|---|
| Source | icsd-10338-As6S6 |