• Formula : Ba2Ni5Ge4
  • Space Group : C2/m (12)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 12.523
    b = 4.0564
    c = 9.503
    α = 90.0
    β = 118.65
    γ = 90.0
  • Number of atoms per primitive cell = 11
    Total number of electrons per primitive cell = 86
  • Band gap = 0.0 eV
    Direct Gap = 0.011 eV
    Metallicity = 0.901
    Topological Z2 indices ν = (0;111)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 423268

Band structure with spin-orbit coupling