Formula Te4Fe2
Reduced formula Te2Fe
Stoichiometry AB2
Number of species 2
Number of atoms 6
Unique ID Fe2Te4
Unit cell volume [Å3] 127.438
Heat of formation [eV/atom] -0.193
Energy [eV] -32.062
Maximum force [eV/Å] 0.007
Maximum stress component [eV/Å3] 0.001
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 3.884 0.000 0.000 Yes
2 0.000 5.250 0.000 Yes
3 0.000 0.000 6.250 Yes
Lengths [Å] 3.884 5.250 6.250
Angles [°] 90.000 90.000 90.000
This work is licensed under a Creative Commons Attribution-Noncomercial 4.0 International License.
Creative Commons License
Powered by Bottle and CAMD-Web