Collection: twodmaterials, Doc: 2dm-5745

Formula: Bi2S3

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-22856

Exfoliation energy: 146.4 meV/atom
Decomposition energy: 0.0 meV/atom

a: 4.03 Å
b: 9.48 Å

(c: 24.95 Å)

Spacegroup: P2_1/m

Magnetic moment: -0.0 μB/unit cell

Bandgap: 1483.1 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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