Formula CaO
Reduced formula CaO
Stoichiometry AB
Number of species 2
Number of atoms 2
Unique ID CaO
Unit cell volume [Å3] 27.270
Heat of formation [eV/atom] -2.977
Energy [eV] -13.090
Maximum force [eV/Å] 0.000
Maximum stress component [eV/Å3] 0.025
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 2.389 -2.389 0.000 Yes
2 -2.389 0.000 -2.389 Yes
3 2.389 2.389 0.000 Yes
Lengths [Å] 3.379 3.379 3.379
Angles [°] 120.000 90.000 120.000
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