Collection: 2dmaterials, Doc: 2dm-3690

Formula: Tl3BSe3

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-28490

Exfoliation energy: meV/atom
Decomposition energy: 0.0 meV/atom

a: 5.64 Å
b: 10.16 Å

(c: 26.24 Å)

Spacegroup: P2_1/m

Magnetic moment: 0.0 μB/unit cell

Bandgap: 1739.3 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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