Collection: 2dmaterials, Doc: 2dm-3886

Formula: BiTeIO3

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-559332

Exfoliation energy: 50.8 meV/atom
Decomposition energy: 12.8 meV/atom

a: 7.08 Å
b: 8.05 Å

(c: 26.64 Å)

Spacegroup: P2_1/c

Magnetic moment: -0.0 μB/unit cell

Bandgap: 2401.3 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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