Collection: 2dmaterials, Doc: 2dm-3603

Formula: CaClF

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-27546

Exfoliation energy: meV/atom
Decomposition energy: 24.2 meV/atom

a: 3.75 Å
b: 3.75 Å

(c: 25.76 Å)

Spacegroup: P4/nmm

Magnetic moment: -0.0 μB/unit cell

Bandgap: 6110.8 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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