| Formula | MnCl2 |
| Reduced formula | MnCl2 |
| Stoichiometry | AB2 |
| Number of species | 2 |
| Number of atoms | 3 |
| Unique ID | MnCl2 |
| Unit cell volume [Å3] | 69.160 |
| Heat of formation [eV/atom] | -1.050 |
| Energy [eV] | -16.437 |
| Maximum force [eV/Å] | 0.002 |
| Maximum stress component [eV/Å3] | 0.009 |
| Total magnetic moment [μB] | 5.000 |