Formula OK2
Reduced formula OK2
Stoichiometry AB2
Number of species 2
Number of atoms 3
Unique ID OK2
Unit cell volume [Å3] 64.794
Heat of formation [eV/atom] -1.046
Energy [eV] -10.701
Maximum force [eV/Å] 0.007
Maximum stress component [eV/Å3] 0.010
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 3.188 -3.188 0.000 Yes
2 -3.188 0.000 -3.188 Yes
3 3.188 3.188 0.000 Yes
Lengths [Å] 4.508 4.508 4.508
Angles [°] 120.000 90.000 120.000
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