Collection: 2dmaterials, Doc: 2dm-3641
Formula: CaAsH5O6
Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-24120
Exfoliation energy: 70.0 meV/atom
Decomposition energy: 65.6 meV/atom
a: 5.90 Å
b: 6.19 Å
(c: 28.03 Å)
Spacegroup: Pc
Magnetic moment: -0.0 μB/unit cell
Bandgap: 3936.0 meV (direct) (PBE)
Bandstructure and Density of States
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