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Formula : MgWO
4
Space Group :
P2/c (13)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 4.69
b = 5.67
c = 4.93
α = 90.0
β = 89.67
γ = 90.0
Number of atoms per primitive cell = 12
Total number of electrons per primitive cell = 96
Band gap = 0.0 eV
Direct Gap = 0.001 eV
Metallicity = 1.000
Topological Z2 indices ν = (1;010)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 36310
Band structure with spin-orbit coupling