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Formula : Tl
2
Te
3
Space Group :
Cc (9)
Centrosymmetric : False
Dimensionality : 3D
Structure parameters
a = 17.413
b = 6.552
c = 7.91
α = 90.0
β = 133.16
γ = 90.0
Number of atoms per primitive cell = 10
Total number of electrons per primitive cell = 88
Band gap = 0.0 eV
Direct Gap = 0.015 eV
Metallicity = 1.000
Topological Z2 indices ν = ?
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 26282
Band structure with spin-orbit coupling