Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-5587 | YBiSe3 | P3m1 | 3m | 34.1044 | p38 | 1.24 | True |
a | b | c | α | β | γ |
---|---|---|---|---|---|
4.14 | 4.14 | 9.75 | 90.00 | 90.00 | 120.00 |
building block id 1 | building block id 2 |
---|---|
2di-708 | 2di-537 |