• Formula : YCo5
  • Space Group : P6/mmm (191)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.951
    b = 4.951
    c = 3.975
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 6
    Total number of electrons per primitive cell = 96
  • Band gap = 0.0 eV
    Direct Gap = 0.005 eV
    Metallicity = 0.817
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Re-investigation of the Y-Co system,
    Zeitschrift fuer Metallkunde 82, 73 (1991)

Band structure with spin-orbit coupling