• Formula : Cr2Te3
  • Space Group : P-31c (163)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.814
    b = 6.814
    c = 12.073
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 184
  • Band gap = 0.0 eV
    Direct Gap = 0.004 eV
    Metallicity = 0.226
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The magnetic structure of Cr2 Te3, Cr3 Te4, and Cr5 Te6,
    Acta Chemica Scandinavica (1-27,1973-42,1988) 24, 3495 (1970)

Band structure with spin-orbit coupling