Collection: 2dmaterials, Doc: 2dm-3191

Formula: Al2Zn2S5

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1096789

Exfoliation energy: 26.3 meV/atom
Decomposition energy: 150.6 meV/atom

a: 3.67 Å
b: 3.67 Å

(c: 31.89 Å)

Spacegroup: P-3m1

Magnetic moment: -0.0 μB/unit cell

Bandgap: 1234.7 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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