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Formula : InBr
3
Space Group :
C2/m (12)
Centrosymmetric : True
Dimensionality : 2D
Structure parameters
a = 6.646
b = 11.641
c = 6.633
α = 90.0
β = 108.99
γ = 90.0
Number of atoms per primitive cell = 8
Total number of electrons per primitive cell = 68
Band gap = 2.6722 eV
Direct Gap = 2.697 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 65198
Band structure with spin-orbit coupling