• Formula : CoSI
  • Space Group : F-43m (216)
    Centrosymmetric : False
    Dimensionality : 1D
  • Structure parameters
    a = 10.71
    b = 10.71
    c = 10.71
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 3
    Total number of electrons per primitive cell = 30
  • Band gap = 0.0 eV
    Direct Gap = 0.001 eV
    Metallicity = 0.251
    Topological Z2 indices ν = ?
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Weitere Beobachtungen ueber Isomorphie bei kubischen Kristallen von Hexammine- und Pentammin-Aquokomplexsalzen _cod_database_code 1010781,
    Norsk Geologisk Tidsskrift 10, 92 (1928)

Band structure with spin-orbit coupling