• Formula : AgBiTe2
  • Space Group : R-3m (166)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.24
    b = 4.24
    c = 20.67
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 4
    Total number of electrons per primitive cell = 38
  • Band gap = 0.0 eV
    Direct Gap = 0.400 eV
    Metallicity = 0.164
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Electron diffraction study of the compound Ag Bi Te2,
    Kristallografiya 9, 347 (1964)

Band structure with spin-orbit coupling