Collection: twodmaterials, Doc: 2dm-4281

Formula: NbI2O

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-549720

Exfoliation energy: 67.6 meV/atom
Decomposition energy: 0.0 meV/atom

a: 3.94 Å
b: 7.54 Å

(c: 24.60 Å)

Spacegroup: Pmm2

Magnetic moment: 0.0 μB/unit cell

Bandgap: 780.7 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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