Formula Nb6Se8
Reduced formula Nb3Se4
Stoichiometry A3B4
Number of species 2
Number of atoms 14
Unique ID Nb6Se8
Unit cell volume [Å3] 308.924
Heat of formation [eV/atom] -0.912
Energy [eV] -102.583
Maximum force [eV/Å] 0.169
Maximum stress component [eV/Å3] 0.005
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 10.130 -0.000 0.000 Yes
2 -5.065 8.773 0.000 Yes
3 0.000 0.000 3.476 Yes
Lengths [Å] 10.130 10.130 3.476
Angles [°] 90.000 90.000 120.004
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