Formula Ti2Cl6
Reduced formula TiCl3
Stoichiometry AB3
Number of species 2
Number of atoms 8
Unique ID Ti2Cl6
Unit cell length [Å] 5.726
X Ti
Y Cl
XY3 formula units 2
Workfunction [V] 5.279
Energy [eV] -335.549
Maximum force [eV/Å] 0.007
Total magnetic moment [μB] 0.000
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 19.496 0.000 0.000 No
2 0.000 19.893 0.000 No
3 0.000 0.000 5.726 Yes
Lengths [Å] 19.496 19.893 5.726
Angles [°] 90.000 90.000 90.000
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