• Formula : Cu(SbO3)2
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.62
    b = 4.62
    c = 9.28
    α = 90.0
    β = 88.5
    γ = 90.0
  • Number of atoms per primitive cell = 18
    Total number of electrons per primitive cell = 114
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.944
    Topological Z2 indices ν = (0;010)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The crystal structure of zinc metantimonate and similar compounds Locality: synthetic,
    Arkiv for Kemi, Mineralogi och Geologi, 15B4, 1 (1942)

Band structure with spin-orbit coupling