• Formula : NbCoTe2
  • Space Group : Cmce (64)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 7.84
    b = 14.431
    c = 6.237
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 16
    Total number of electrons per primitive cell = 168
  • Band gap = 0.0 eV
    Direct Gap = 0.004 eV
    Metallicity = 0.563
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    New layered ternary niobium tellurides: synthesis, structure and properties of NbMTe~2~ (M=Fe, Co),
    Inorganic Chemistry 31, 1050 (1992)

Band structure with spin-orbit coupling