Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-4820 | Ba2Mn2Sb2F2 | R-3m | -3m | 76.6299 | NdZnPO | 0.30 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
4.68 | 4.68 | 35.66 | 90.00 | 90.00 | 120.00 |
building block id 1 | building block id 2 |
---|---|
2di-765 | 2di-446 |