Formula Y3F9
Reduced formula YF3
Stoichiometry AB3
Number of species 2
Number of atoms 12
Unique ID Y3F9
Unit cell volume [Å3] 145.632
Heat of formation [eV/atom] -4.065
Energy [eV] -77.133
Maximum force [eV/Å] 0.098
Maximum stress component [eV/Å3] 0.025
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 5.261 0.000 0.000 Yes
2 0.000 5.261 0.000 Yes
3 0.000 0.000 5.261 Yes
Lengths [Å] 5.261 5.261 5.261
Angles [°] 90.000 90.000 90.000
This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.
Creative Commons License