Ag1F4Li1

MatHub3d-248-Ag1F4Li1

Basic properties

Property Value
Space group (10, "'P2/m'")
Magnetic True
Band gap (PBE) (eV) 0.53
Total energy (eV) -19.780
Total energy / atom (eV) -3.297

Lattice Parameters(conventional cell, from the source)

a, b, c (Å): 4.640 3.470 4.660
α, β, γ(°): 90.0 92.0 90.0

Lattice Parameters(conventional cell, relaxed)

a, b, c (Å): 4.620 3.420 4.630
α, β, γ(°): 90.0 92.3 90.0

Deformation Potential

n_type (eV): -1.189
p_type (eV): -0.006

Energy and volume

Ag1F4Li1
.
Property Value
Bulk-modulus 79.031 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ag1F4Li1
  
Property Value
Band gap 0.53 eV

Data source

Property Value
Source mp-753209-Ag1F4Li1