Collection: 2dmaterials, Doc: 2dm-3158

Formula: H2C2S

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1096982

Exfoliation energy: 28.5 meV/atom
Decomposition energy: 1028.5 meV/atom

a: 2.84 Å
b: 2.84 Å

(c: 24.10 Å)

Spacegroup: P-3m1

Magnetic moment: -0.0 μB/unit cell

Bandgap: 204.1 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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