• Formula : Sr
  • Space Group : Im-3m (229)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 4.87
    b = 4.87
    c = 4.87
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 1
    Total number of electrons per primitive cell = 10
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.347
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The barium-strontium equilibrium system Locality: synthetic Sample: at T = 628 C note: known as beta-strontium,
    Journal of Physical Chemistry 60, 302 (1956)

Band structure with spin-orbit coupling