| Formula | Fe |
| Reduced formula | Fe |
| Stoichiometry | A |
| Number of species | 1 |
| Number of atoms | 1 |
| Unique ID | Fe |
| Unit cell volume [Å3] | 11.191 |
| Heat of formation [eV/atom] | 0.000 |
| Energy [eV] | -9.042 |
| Maximum force [eV/Å] | 0.000 |
| Maximum stress component [eV/Å3] | 0.043 |
| Total magnetic moment [μB] | 2.216 |