Collection: 2dmaterials, Doc: 2dm-3817

Formula: Pr2I5

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-22854

Exfoliation energy: 88.1 meV/atom
Decomposition energy: 0.0 meV/atom

a: 4.32 Å
b: 16.92 Å

(c: 25.77 Å)

Spacegroup: P2_1/m

Magnetic moment: 2.0015229 μB/unit cell

Bandgap: 155.9 meV (indirect) (PBE)

VASP inputs

Bandstructure and Density of States

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