Collection: 2dmaterials, Doc: 2dm-3958

Formula: LiCu2F5

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-867590

Exfoliation energy: 29.4 meV/atom
Decomposition energy: 98.5 meV/atom

a: 3.14 Å
b: 9.64 Å

(c: 26.24 Å)

Spacegroup: P2_1/m

Magnetic moment: 3.9786574 μB/unit cell

Bandgap: 516.3 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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