Collection: 2dmaterials, Doc: 2dm-3663

Formula: IrBr3

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-27397

Exfoliation energy: 80.7 meV/atom
Decomposition energy: 0.0 meV/atom

a: 6.41 Å
b: 6.41 Å

(c: 22.78 Å)

Spacegroup: P-31m

Magnetic moment: -0.0 μB/unit cell

Bandgap: 1815.1 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

Full document

RESTful link: http://localhost:5000/2dmaterials/doc/2dm-3663/json

Rendered JSON (click +/- to expand/collapse):