• Formula : Re3As7
  • Space Group : Im-3m (229)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 8.714
    b = 8.714
    c = 8.714
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 160
  • Band gap = 0.0 eV
    Direct Gap = 0.010 eV
    Metallicity = 0.230
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Untersuchungen an Re~3~ As~7~,
    Journal of the Less-Common Metals 11, 298 (1966)

Band structure with spin-orbit coupling