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Formula : Mn
2
Ge
Space Group :
P6_3/mmc (194)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 4.171
b = 4.171
c = 5.278
α = 90.0
β = 90.0
γ = 120.0
Number of atoms per primitive cell = 6
Total number of electrons per primitive cell = 68
Band gap = 0.0 eV
Direct Gap = 0.003 eV
Metallicity = 0.727
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 57080
Band structure with spin-orbit coupling