Collection: 2dmaterials, Doc: 2dm-3846

Formula: ZrBrN

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-570157

Exfoliation energy: 41.9 meV/atom
Decomposition energy: 13.1 meV/atom

a: 3.64 Å
b: 4.16 Å

(c: 25.99 Å)

Spacegroup: Pmmn

Magnetic moment: -0.0 μB/unit cell

Bandgap: 1736.0 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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