Collection: 2dmaterials, Doc: 2dm-3044

Formula: CaFeSO

Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1078415

Exfoliation energy: 295.4 meV/atom
Decomposition energy: 399.9 meV/atom

a: 3.91 Å
b: 3.91 Å

(c: 23.68 Å)

Spacegroup: P3m1

Magnetic moment: 3.9989333 μB/unit cell

Bandgap: 0.0 meV (PBE)

VASP inputs

Bandstructure and Density of States

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