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Formula : Ga
2
Te
5
Space Group :
I4/m (87)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 7.96
b = 7.96
c = 6.96
α = 90.0
β = 90.0
γ = 90.0
Number of atoms per primitive cell = 7
Total number of electrons per primitive cell = 56
Band gap = 0.7831 eV
Direct Gap = 0.801 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 635505
Band structure with spin-orbit coupling