Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-3998 | Ag2Au | P-3m1 | -3m | 14.2378 | CdI2(hP3) | 0.00 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
2.95 | 2.95 | 7.18 | 90.00 | 90.00 | 120.00 |
building block id 1 | building block id 2 |
---|---|
2di-592 | 2di-49 |