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Formula : RbSn
2
Br
5
Space Group :
I4/mcm (140)
Centrosymmetric : True
Dimensionality : 2D
Structure parameters
a = 8.4339
b = 8.4339
c = 14.7502
α = 90.0
β = 90.0
γ = 90.0
Number of atoms per primitive cell = 16
Total number of electrons per primitive cell = 144
Band gap = 2.2355 eV
Direct Gap = 2.427 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 151989
Band structure with spin-orbit coupling