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Formula : Co(BO
2
)
2
Space Group :
C2/c (15)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 9.3461
b = 5.6196
c = 4.4332
α = 90.0
β = 108.2
γ = 90.0
Number of atoms per primitive cell = 14
Total number of electrons per primitive cell = 94
Band gap = 0.0 eV
Direct Gap = 0.000 eV
Metallicity = 0.808
Topological Z2 indices ν = (1;011)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 422063
Band structure with spin-orbit coupling