Crystal structure | Band structure | Phonon dispersion |
---|---|---|
Structure id | Formula | Space group | Point group | Ehull (meV/atom) | Prototype | Band gap (eV) | Is vdW? |
---|---|---|---|---|---|---|---|
s-2093 | Ba2MnFe2Se2O3 | P4/mmm | 4/mmm | 79.3072 | p60 | 0.00 | False |
a | b | c | α | β | γ |
---|---|---|---|---|---|
4.27 | 4.27 | 10.23 | 90.00 | 90.00 | 90.00 |
building block id 1 | building block id 2 |
---|---|
2di-401 | 2di-210 |