| Formula | P42 |
| Reduced formula | P |
| Stoichiometry | A |
| Number of species | 1 |
| Number of atoms | 42 |
| Unique ID | P42 |
| Unit cell volume [Å3] | 1000.299 |
| Heat of formation [eV/atom] | 0.000 |
| Energy [eV] | -225.311 |
| Maximum force [eV/Å] | 0.122 |
| Maximum stress component [eV/Å3] | 0.006 |