| Formula | Ag4Ta4S12 |
| Reduced formula | AgTaS3 |
| Stoichiometry | ABC3 |
| Number of species | 3 |
| Number of atoms | 20 |
| Unique ID | 12 |
| Unit cell volume [Å3] | 375.366 |
| E-hull [eV] | 0.026 |
| Energy per atom [eV] | 0.179 |
| E-hull Uncertainty [eV] | 0.080 |
| Energy uncertainty [eV] | 0.056 |
| Direct band gap (GLLB-SC) [eV] | 0.225 |
| Indirect band gap (GLLB-SC) [eV] | 0.045 |
| Band gap (PBEsol) [eV] | 0.000 |
| prototype name | GdFeO3 |
| Short chemical formula | AgTaS3 |
| Is reference | 0 |
| Energy [eV] | -1943.906 |