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Formula : V
3
As
Space Group :
Pm-3n (223)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 4.75
b = 4.75
c = 4.75
α = 90.0
β = 90.0
γ = 90.0
Number of atoms per primitive cell = 8
Total number of electrons per primitive cell = 88
Band gap = 0.0 eV
Direct Gap = 0.000 eV
Metallicity = 0.281
Topological Z2 indices ν = (1;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 44084
Band structure with spin-orbit coupling