• Formula : Ag2O
  • Space Group : Pn-3m (224)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.76
    b = 4.76
    c = 4.76
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 6
    Total number of electrons per primitive cell = 56
  • Band gap = 0.0 eV
    Direct Gap = 0.003 eV
    Metallicity = 0.004
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The Crystal Structure of Silver Oxide (Ag~2~ O),
    American Journal of Science, Serie 5(1,1921-1938) 3, 184 (1922)

Band structure with spin-orbit coupling