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Formula : SiS
4
Space Group :
P2_1/m (11)
Centrosymmetric : True
Dimensionality : 1D
Structure parameters
a = 6.8934
b = 7.7675
c = 6.1241
α = 90.0
β = 91.225
γ = 90.0
Number of atoms per primitive cell = 10
Total number of electrons per primitive cell = 56
Band gap = 0.0 eV
Direct Gap = 0.017 eV
Metallicity = 0.532
Topological Z2 indices ν = (0;010)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 59708
Band structure with spin-orbit coupling