• Formula : Te
  • Space Group : P3_121 (152)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 4.454
    b = 4.454
    c = 5.924
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 3
    Total number of electrons per primitive cell = 18
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.016
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The crystal structure of tellurium,
    Philosophical Magazine, Serie 6 (1901-1925) 48, 477 (1924)

Band structure with spin-orbit coupling

Wannier charge center (WCC) at six time-reversal invariant planes