Collection: 2dmaterials, Doc: 2dm-3215

Formula: NaI

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1064979

Exfoliation energy: 109.5 meV/atom
Decomposition energy: 124.5 meV/atom

a: 4.40 Å
b: 4.40 Å

(c: 20.00 Å)

Spacegroup: P4/mmm

Magnetic moment: 0.0 μB/unit cell

Bandgap: 3863.1 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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