Collection: 2dmaterials, Doc: 2dm-3839
Formula: Zr(MoO4)2
Discovery Process: Exfoliation from layered material
Obtained from 3D: mp-627151
Exfoliation energy: 84.4 meV/atom
Decomposition energy: 113.9 meV/atom
a: 6.17 Å
b: 6.17 Å
(c: 22.31 Å)
Spacegroup: P-3m1
Magnetic moment: 0.0 μB/unit cell
Bandgap: 3228.5 meV (indirect) (PBE)
Bandstructure and Density of States
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