Collection: 2dmaterials, Doc: 2dm-3775

Formula: TlF

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-557835

Exfoliation energy: 921.8 meV/atom
Decomposition energy: 716.6 meV/atom

a: 4.37 Å
b: 4.37 Å

(c: 22.49 Å)

Spacegroup: P4mm

Magnetic moment: -0.0 μB/unit cell

Bandgap: 2339.0 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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