Ac1Cu1O3

MatHub3d-26-Ac1Cu1O3

Basic properties

Property Value
Space group (221, "'Pm-3m'")
Magnetic False
Band gap (PBE) (eV) 0.03
Total energy (eV) -31.144
Total energy / atom (eV) -6.229

Lattice Parameters(conventional cell, from the source)

a, b, c (Å): 3.940 3.940 3.940
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(conventional cell, relaxed)

a, b, c (Å): 3.940 3.940 3.940
α, β, γ(°): 90.0 90.0 90.0

Energy and volume

Ac1Cu1O3
.
Property Value
Bulk-modulus 159.173 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ac1Cu1O3
  
Property Value
Band gap 0.03 eV

Data source

Property Value
Source mp-864606-Ac1Cu1O3