Formula Au2Se2
Reduced formula AuSe
Stoichiometry AB
Number of species 2
Number of atoms 4
Unique ID Au2Se2
Unit cell volume [Å3] 94.931
Heat of formation [eV/atom] -0.105
Energy [eV] -13.647
Maximum force [eV/Å] 0.029
Maximum stress component [eV/Å3] 0.017
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 0.000 -3.707 0.000 Yes
2 4.211 1.853 -0.005 Yes
3 -1.750 0.000 6.083 Yes
Lengths [Å] 3.707 4.601 6.330
Angles [°] 104.715 90.000 113.753
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