Ca4H4O16P4
MatHub3d-25634-Ca4H4O16P4
| Property | Value |
|---|---|
| Space group | (1, "'P1'") |
| Magnetic | False |
| Band gap (PBE) (eV) | 5.58 |
| Total energy (eV) | -189.475 |
| Total energy / atom (eV) | -6.767 |
| a, b, c (Å): | 6.620 | 6.920 | 6.950 |
| α, β, γ(°): | 76.0 | 84.0 | 88.0 |
| a, b, c (Å): | 6.690 | 7.030 | 7.010 |
| α, β, γ(°): | 76.0 | 84.0 | 88.0 |
| n_type (eV): | -1.907 |
| p_type (eV): | 5.479 |
Ca4H4O16P4
| Property | Value |
|---|---|
| Bulk-modulus | 146.534 GPa |
Ca4H4O16P4
| Property | Value |
|---|---|
| Band gap | 5.58 eV |
| Band degeneracy(CBM) | 1.00 |
| Band degeneracy(VBM) | 1.00 |
| Property | Value |
|---|---|
| Source | icsd-10504-Ca4H4O16P4 |