Collection: 2dmaterials, Doc: 2dm-4035

Formula: Zn2SeCl2O3

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-561112

Exfoliation energy: 42.6 meV/atom
Decomposition energy: 6.3 meV/atom

a: 7.71 Å
b: 10.37 Å

(c: 25.93 Å)

Spacegroup: P2_1/c

Magnetic moment: -0.0 μB/unit cell

Bandgap: 4102.0 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

Full document

RESTful link: http://localhost:5000/2dmaterials/doc/2dm-4035/json

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