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Formula : SrSnS
3
Space Group :
Pnma (62)
Centrosymmetric : True
Dimensionality : 2D
Structure parameters
a = 8.264
b = 3.867
c = 14.116
α = 90.0
β = 90.0
γ = 90.0
Number of atoms per primitive cell = 20
Total number of electrons per primitive cell = 168
Band gap = 1.0794 eV
Direct Gap = 1.289 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 651032
Band structure with spin-orbit coupling