Collection: 2dmaterials, Doc: 2dm-3138

Formula: MgO2

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1096803

Exfoliation energy: 69.7 meV/atom
Decomposition energy: 687.3 meV/atom

a: 3.05 Å
b: 3.42 Å

(c: 21.61 Å)

Spacegroup: C2/m

Magnetic moment: 2.0072417 μB/unit cell

Bandgap: 1060.8 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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