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Formula : Os
Space Group :
P2_1/c (14)
Centrosymmetric : True
Dimensionality : 1D
Structure parameters
a = 9.17
b = 11.5
c = 11.97
α = 90.0
β = 109.0
γ = 90.0
Number of atoms per primitive cell = 8
Total number of electrons per primitive cell = 128
Band gap = 0.0 eV
Direct Gap = 0.001 eV
Metallicity = 0.042
Topological Z2 indices ν = (1;001)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 27568
Band structure with spin-orbit coupling