• Formula : CdP4
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 5.27
    b = 5.19
    c = 7.66
    α = 90.0
    β = 80.53
    γ = 90.0
  • Number of atoms per primitive cell = 10
    Total number of electrons per primitive cell = 64
  • Band gap = 0.4602 eV
    Direct Gap = 0.528 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 25605

Band structure with spin-orbit coupling

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