Collection: 2dmaterials, Doc: 2dm-4044
Formula: CuHgSBr
Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-554879
Exfoliation energy: 99.8 meV/atom
Decomposition energy: 71.6 meV/atom
a: 4.02 Å
b: 10.02 Å
(c: 28.95 Å)
Spacegroup: Pmc2_1
Magnetic moment: 0.0 μB/unit cell
Bandgap: 549.8 meV (indirect) (PBE)
Bandstructure and Density of States
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