Home
Formula : WN
2
Space Group :
P-6m2 (187)
Centrosymmetric : False
Dimensionality : 3D
Structure parameters
a = 2.923
b = 2.923
c = 3.909
α = 90.0
β = 90.0
γ = 120.0
Number of atoms per primitive cell = 3
Total number of electrons per primitive cell = 24
Band gap = 0.8125 eV
Direct Gap = 1.046 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 290433
Band structure with spin-orbit coupling