Ir6Ta6

MatHub3d-56624-Ir6Ta6

Basic properties

Property Value
Space group (51, "'Pmma'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -104.100
Total energy / atom (eV) -8.675

Lattice Parameters(from the source)

a, b, c (Å): 13.660 2.830 4.800
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 13.860 2.880 4.850
α, β, γ(°): 90.0 90.0 90.0

Energy and volume

Ir6Ta6
.
Property Value
Bulk-modulus 271.161 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ir6Ta6
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-104565-Ir6Ta6