• Formula : AgTe4Au
  • Space Group : P2/c (13)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 8.95
    b = 4.478
    c = 14.62
    α = 90.0
    β = 145.35
    γ = 90.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 92
  • Band gap = 0.0 eV
    Direct Gap = 0.183 eV
    Metallicity = 0.035
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Kristallchemie natuerlicher Telluride. I: Verfeinerung der Kristallstruktur des Sylvanits, Au Ag Te4,
    TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-) 33, 203 (1984)

Band structure with spin-orbit coupling