Ir1Sc1

MatHub3d-56380-Ir1Sc1

Basic properties

Property Value
Space group (221, "'Pm-3m'")
Magnetic False
Band gap (PBE) (eV) 0.03
Total energy (eV) -13.216
Total energy / atom (eV) -6.608

Lattice Parameters(from the source)

a, b, c (Å): 3.210 3.210 3.210
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 3.250 3.250 3.250
α, β, γ(°): 90.0 90.0 90.0

Energy and volume

Ir1Sc1
.
Property Value
Bulk-modulus 162.868 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ir1Sc1
  
Property Value
Band gap 0.03 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-104557-Ir1Sc1