• Formula : ZrTiTe4
  • Space Group : P2/m (10)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 6.533
    b = 3.855
    c = 6.655
    α = 90.0
    β = 90.06
    γ = 90.0
  • Number of atoms per primitive cell = 6
    Total number of electrons per primitive cell = 40
  • Band gap = 0.0 eV
    Direct Gap = 0.018 eV
    Metallicity = 0.262
    Topological Z2 indices ν = (1;010)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 40496

Band structure with spin-orbit coupling