Ni2Th1

MatHub3d-67648-Ni2Th1

Basic properties

Property Value
Space group (191, "'P6/mmm'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -13.442
Total energy / atom (eV) -4.481

Lattice Parameters(from the source)

a, b, c (Å): 3.960 3.960 3.830
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 4.070 4.070 3.680
α, β, γ(°): 90.0 90.0 120.0

Density of States (DOS)







Electronic band structure (PBE)

Ni2Th1
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-105405-Ni2Th1