| Crystal structure | Band structure | Phonon dispersion |
|---|---|---|
| |
|
| Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
|---|---|---|---|---|---|---|---|
| s-163 | As2Ir2Pb2O2 | P4/nmm | 4/mmm | 64.4965 | ZrCuSiAs | 0.00 | False |
| a | b | c | α | β | γ |
|---|---|---|---|---|---|
| 4.00 | 4.00 | 11.53 | 90.00 | 90.00 | 90.00 |
| building block id 1 | building block id 2 |
|---|---|
| 2di-261 | 2di-105 |