• Formula : Sr3Li2
  • Space Group : P4_2/mnm (136)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 9.628
    b = 9.628
    c = 8.55
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 144
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.522
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The crystal structure of Sr6 Li23 and Sr3 Li2,
    Journal of Physical Chemistry 66, 2142 (1962)

Band structure with spin-orbit coupling