Be2Li2Sb2

MatHub3d-15047-Be2Li2Sb2

Basic properties

Property Value
Space group (186, "'P6_3mc'")
Magnetic False
Band gap (PBE) (eV) 0.89
Total energy (eV) -21.119
Total energy / atom (eV) -3.520

Lattice Parameters(from the source)

a, b, c (Å): 4.150 4.150 6.740
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 4.170 4.170 6.780
α, β, γ(°): 90.0 90.0 120.0

Deformation Potential

n_type (eV): -0.018
p_type (eV): -0.341

Energy and volume

Be2Li2Sb2
.
Property Value
Bulk-modulus 56.323 GPa

Density of States (DOS)







Electronic band structure (PBE)

Be2Li2Sb2
  
Property Value
Band gap 0.89 eV
Band degeneracy(CBM) 3.00
Band degeneracy(VBM) 1.00

Data source

Property Value
Source icsd-100114-Be2Li2Sb2