Formula Cu6Se4
Reduced formula Cu3Se2
Stoichiometry A2B3
Number of species 2
Number of atoms 10
Unique ID Se4Cu6
Unit cell volume [Å3] 176.131
Heat of formation [eV/atom] -0.150
Energy [eV] -37.484
Maximum force [eV/Å] 0.042
Maximum stress component [eV/Å3] 0.010
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 6.377 0.000 0.000 Yes
2 0.000 6.377 0.000 Yes
3 0.000 0.000 4.332 Yes
Lengths [Å] 6.377 6.377 4.332
Angles [°] 90.000 90.000 90.000
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