Collection: 2dmaterials, Doc: 2dm-3041

Formula: FeHO2

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1078943

Exfoliation energy: 20.8 meV/atom
Decomposition energy: 527.4 meV/atom

a: 2.64 Å
b: 4.00 Å

(c: 25.85 Å)

Spacegroup: Pmn2_1

Magnetic moment: 10.0045607 μB/unit cell

Bandgap: 1062.1 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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