Collection: 2dmaterials, Doc: 2dm-3762

Formula: TlI

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-22858

Exfoliation energy: 136.7 meV/atom
Decomposition energy: 45.5 meV/atom

a: 4.95 Å
b: 4.92 Å

(c: 23.63 Å)

Spacegroup: P4/nmm

Magnetic moment: 0.0 μB/unit cell

Bandgap: 2705.8 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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