Collection: 2dmaterials, Doc: 2dm-3808

Formula: CaP2(HO)4

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-24130

Exfoliation energy: 28.7 meV/atom
Decomposition energy: 14.3 meV/atom

a: 5.67 Å
b: 6.63 Å

(c: 26.57 Å)

Spacegroup: P2/c

Magnetic moment: 0.0 μB/unit cell

Bandgap: 5508.7 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

Full document

RESTful link: http://localhost:5000/2dmaterials/doc/2dm-3808/json

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