• Formula : GaAg
  • Space Group : Pm-3m (221)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 3.171
    b = 3.171
    c = 3.171
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 2
    Total number of electrons per primitive cell = 24
  • Band gap = 0.0 eV
    Direct Gap = 0.101 eV
    Metallicity = 0.607
    Topological Z2 indices ν = (0;111)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Un nouveau compose intermetallique tres timide: Ag Ga,
    Journal of the Less-Common Metals 171, 157 (1991)

Band structure with spin-orbit coupling