Cl8Li6V1

MatHub3d-29965-Cl8Li6V1

Property Value
Space group (225, "'Fm-3m'")
Magnetic True
Magnetic moment (μB) 3.01
Band gap (PBE) (eV) 3.07
Total energy (eV) -59.352
Total energy / atom (eV) -3.957

Lattice Parameters(from the source)

a, b, c (Å): 10.290 10.290 10.290
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 7.320 7.320 7.320
α, β, γ(°): 60.0 60.0 60.0

Deformation Potential

n_type (eV): 0.067
p_type (eV): 0.123
Cl8Li6V1
.
Property Value
Bulk-modulus 35.597 GPa






Cl8Li6V1
  
Property Value
Band gap 3.07 eV
Band degeneracy(CBM) 1.00
Band degeneracy(VBM) 3.00
Property Value
Source icsd-100834-Cl8Li6V1