Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-839 | Sr3Fe4S2O6 | P4/mmm | 4/mmm | 30.4113 | p10 | 1.02 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
4.04 | 4.04 | 13.71 | 90.00 | 90.00 | 90.00 |
building block id 1 | building block id 2 |
---|---|
2di-375 | 2di-130 |