Cluster id | Formula | Space group | Source k | Valence | Functionality | Reference |
---|---|---|---|---|---|---|
2di-253 | FeS2 | P-4m2 | [1.15, 1.05, 1.3, 1.2, 1.1] | [-1.0] |
a | b | c | α | β | γ |
---|---|---|---|---|---|
3.70 | 3.70 | 25.00 | 90.00 | 90.00 | 90.00 |
Database | Material id | Formula |
---|---|---|
mp | mp-12776 | Tl2 Fe2 S4 |