Collection: 2dmaterials, Doc: 2dm-3852

Formula: Si2Hg6O7

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-28712

Exfoliation energy: 343.8 meV/atom
Decomposition energy: 177.1 meV/atom

a: 6.23 Å
b: 10.87 Å

(c: 23.81 Å)

Spacegroup: P2/m

Magnetic moment: 0.0 μB/unit cell

Bandgap: 1915.0 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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