Al9Ba1Ni2

MatHub3d-4412-Al9Ba1Ni2

Basic properties

Property Value
Space group (191, "'P6/mmm'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -44.825
Total energy / atom (eV) -3.735

Lattice Parameters(from the source)

a, b, c (Å): 7.930 7.930 3.960
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 7.920 7.920 3.960
α, β, γ(°): 90.0 90.0 120.0

Energy and volume

Al9Ba1Ni2
.
Property Value
Bulk-modulus 84.007 GPa

Density of States (DOS)







Electronic band structure (PBE)

Al9Ba1Ni2
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-107746-Al9Ba1Ni2