Formula | Cu6I6Se18 |
Reduced formula | CuISe3 |
Stoichiometry | ABC3 |
Number of species | 3 |
Number of atoms | 30 |
Unique ID | Cu6I6Se18 |
Unit cell volume [Å3] | 848.171 |
Heat of formation [eV/atom] | -0.108 |
Energy [eV] | -96.856 |
Maximum force [eV/Å] | 0.074 |
Maximum stress component [eV/Å3] | 0.004 |