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Formula : Ag
2
Te
2
O
7
Space Group :
Imma (74)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 7.266
b = 10.143
c = 7.6021
α = 90.0
β = 90.0
γ = 90.0
Number of atoms per primitive cell = 22
Total number of electrons per primitive cell = 152
Band gap = 0.0117 eV
Direct Gap = 0.024 eV
Metallicity = 0.000
Topological Z2 indices ν = (0;000)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 416281
Band structure with spin-orbit coupling