Formula CsPbCl3
Reduced formula CsPbCl3
Stoichiometry ABC3
Number of species 3
Number of atoms 5
Unique ID 4
Unit cell volume [Å3] 178.666
Direct GLLB-SC+SOC bandgap [eV] 2.265
Indirect GLLB-SC+SOC bandgap [eV] 2.265
GLLB-SC Derivative discontinuity [eV] 0.903
Name given to the crystal structure CsPbCl3
Symmetry of the crystal cubic
Space group of the crystal Pm-3m
Energy [eV] -18.203
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 5.632 0.000 0.000 Yes
2 0.000 5.632 0.000 Yes
3 0.000 0.000 5.632 Yes
Lengths [Å] 5.632 5.632 5.632
Angles [°] 90.000 90.000 90.000
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