• Formula : Ba2NaO
  • Space Group : Cmme (67)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 6.5907
    b = 15.327
    c = 6.9385
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 70
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.537
    Topological Z2 indices ν = (0;001)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 411905

Band structure with spin-orbit coupling