Collection: 2dmaterials, Doc: 2dm-3096
Formula: HgNCl
Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-1077462
Exfoliation energy: 417.6 meV/atom
Decomposition energy: 1336.3 meV/atom
a: 3.95 Å
b: 7.40 Å
(c: 22.80 Å)
Spacegroup: Pmma
Magnetic moment: 4.0014585 μB/unit cell
Bandgap: 170.6 meV (direct) (PBE)
Bandstructure and Density of States
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