Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-4315 | CuPbSeI | P3m1 | 3m | 93.4407 | p28 | 0.51 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
4.27 | 4.27 | 7.33 | 90.00 | 90.00 | 120.00 |
building block id 1 | building block id 2 |
---|---|
2di-602 | 2di-78 |