Collection: 2dmaterials, Doc: 2dm-3918

Formula: ZrIN

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-580886

Exfoliation energy: 39.7 meV/atom
Decomposition energy: 27.9 meV/atom

a: 3.75 Å
b: 3.75 Å

(c: 27.02 Å)

Spacegroup: P-3m1

Magnetic moment: 0.0 μB/unit cell

Bandgap: 1832.0 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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