Formula Nb4F20
Reduced formula NbF5
Stoichiometry AB5
Number of species 2
Number of atoms 24
Unique ID Nb4F20
Unit cell volume [Å3] 283.206
Heat of formation [eV/atom] -3.221
Energy [eV] -150.352
Maximum force [eV/Å] 1.222
Maximum stress component [eV/Å3] 0.010
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 0.623 0.000 -4.626 Yes
2 -4.511 -6.808 0.107 Yes
3 -4.511 6.808 0.107 Yes
Lengths [Å] 4.668 8.167 8.167
Angles [°] 112.928 94.970 94.970
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