Ga1Ir1Li2

MatHub3d-48598-Ga1Ir1Li2

Basic properties

Property Value
Space group (216, "'F-43m'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -14.679
Total energy / atom (eV) -3.670

Lattice Parameters(from the source)

a, b, c (Å): 6.040 6.040 6.040
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 4.190 4.190 4.190
α, β, γ(°): 60.0 60.0 60.0

Energy and volume

Ga1Ir1Li2
.
Property Value
Bulk-modulus 98.523 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ga1Ir1Li2
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-107085-Ga1Ir1Li2