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Formula : Bi
4
RuBr
2
Space Group :
C2/m (12)
Centrosymmetric : True
Dimensionality : 2D
Structure parameters
a = 12.119
b = 10.726
c = 6.639
α = 90.0
β = 90.0
γ = 91.63
Number of atoms per primitive cell = 14
Total number of electrons per primitive cell = 180
Band gap = 0.3607 eV
Direct Gap = 0.457 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 406951
Band structure with spin-orbit coupling