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Formula : Sb
2
WO
6
Space Group :
P1 (1)
Centrosymmetric : False
Dimensionality : 3D
Structure parameters
a = 5.554
b = 4.941
c = 9.209
α = 90.05
β = 96.98
γ = 90.2
Number of atoms per primitive cell = 18
Total number of electrons per primitive cell = 148
Band gap = 0.0 eV
Direct Gap = 1.132 eV
Metallicity = 1.000
Topological Z2 indices ν = ?
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 75595
Band structure with spin-orbit coupling