Li5Tl2

MatHub3d-60885-Li5Tl2

Basic properties

Property Value
Space group (166, "'R-3m'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -15.659
Total energy / atom (eV) -2.237

Lattice Parameters(from the source)

a, b, c (Å): 4.720 4.720 20.400
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 7.390 7.390 7.390
α, β, γ(°): 37.0 37.0 37.0

Energy and volume

Li5Tl2
.
Property Value
Bulk-modulus 24.865 GPa

Density of States (DOS)







Electronic band structure (PBE)

Li5Tl2
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-10053-Li5Tl2