Materials Data on LiCuO2 by Materials Project
LiCuO2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form distorted edge-sharing LiO6 pentagonal pyramids. There are two shorter (2.10 Å) and four longer (2.28 Å) Li–O bond lengths. Cu3+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.84 Å. O2- is bonded to three equivalent Li1+ and two equivalent Cu3+ atoms to form a mixture of face, edge, and corner-sharing OLi3Cu2 trigonal bipyramids.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1317104
- Report Number(s):
- mp-996986
- Country of Publication:
- United States
- Language:
- English
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