• Formula : Sb
  • Space Group : R-3m (166)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.50661
    b = 4.50661
    c = 4.50661
    α = 57.108
    β = 57.108
    γ = 57.108
  • Number of atoms per primitive cell = 2
    Total number of electrons per primitive cell = 10
  • Band gap = 0.0 eV
    Direct Gap = 0.081 eV
    Metallicity = 0.025
    Topological Z2 indices ν = (1;111)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Second edition. Interscience Publishers, New York, New York,
    Crystal Structures 1, 7 (1963)

Band structure with spin-orbit coupling