Collection: 2dmaterials, Doc: 2dm-3732

Formula: BiTeCl

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-28944

Exfoliation energy: 103.7 meV/atom
Decomposition energy: 0.0 meV/atom

a: 4.29 Å
b: 4.29 Å

(c: 23.41 Å)

Spacegroup: P3m1

Magnetic moment: -0.0 μB/unit cell

Bandgap: 1803.7 meV (direct) (PBE)

VASP inputs

Bandstructure and Density of States

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