• Formula : SrAs3
  • Space Group : C2/m (12)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 9.61
    b = 7.63
    c = 5.88
    α = 90.0
    β = 112.9
    γ = 90.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 50
  • Band gap = 0.0 eV
    Direct Gap = 0.043 eV
    Metallicity = 0.272
    Topological Z2 indices ν = (1;001)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 41831

Band structure with spin-orbit coupling

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