Collection: 2dmaterials, Doc: 2dm-3711
Formula: CuHgSCl
Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-23567
Exfoliation energy: 102.8 meV/atom
Decomposition energy: 58.2 meV/atom
a: 3.97 Å
b: 9.90 Å
(c: 28.59 Å)
Spacegroup: Pmc2_1
Magnetic moment: -0.0 μB/unit cell
Bandgap: 675.5 meV (indirect) (PBE)
Bandstructure and Density of States
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