Collection: 2dmaterials, Doc: 2dm-3749

Formula: WS2

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-224

Exfoliation energy: 56.4 meV/atom
Decomposition energy: 1.6 meV/atom

a: 3.19 Å
b: 3.19 Å

(c: 23.13 Å)

Spacegroup: P-6m2

Magnetic moment: 0.0 μB/unit cell

Bandgap: 1802.4 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

Full document

RESTful link: http://localhost:5000/2dmaterials/doc/2dm-3749/json

Rendered JSON (click +/- to expand/collapse):