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Formula : Al
9
Rh
2
Space Group :
P2_1/c (14)
Centrosymmetric : True
Dimensionality : 3D
Structure parameters
a = 6.3501
b = 6.4266
c = 8.7181
α = 90.0
β = 94.809
γ = 90.0
Number of atoms per primitive cell = 22
Total number of electrons per primitive cell = 122
Band gap = 0.0 eV
Direct Gap = 0.000 eV
Metallicity = 0.858
Topological Z2 indices ν = (0;010)
scf.in
-
scf.out
-
bands.in
-
bands.out
Reference:
ICSD Collection Code: 414304
Band structure with spin-orbit coupling