Collection: 2dmaterials, Doc: 2dm-3966

Formula: HgI2

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-567471

Exfoliation energy: meV/atom
Decomposition energy: 6.4 meV/atom

a: 8.83 Å
b: 8.83 Å

(c: 26.75 Å)

Spacegroup: P-4m2

Magnetic moment: 0.0 μB/unit cell

Bandgap: 1900.6 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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