• Formula : KMnF4
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 7.7063
    b = 7.6568
    c = 5.7889
    α = 90.0
    β = 90.434
    γ = 90.0
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 208
  • Band gap = 0.0 eV
    Direct Gap = 0.013 eV
    Metallicity = 0.220
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Neutron powder diffraction experiments on AMnF~4~ (A = K, Rb): nuclear and magnetic structures,
    Physica B (152, 1988-) 180, 125 (1992)

Band structure with spin-orbit coupling