Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-3760 | YGaO3 | R3m | 3m | 79.8124 | α-In2Se3 | 2.74 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
3.54 | 3.54 | 17.78 | 90.00 | 90.00 | 120.00 |
building block id 1 | building block id 2 |
---|---|
2di-725 | 2di-29 |