U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiVCuO4 by Materials Project
Abstract
LiCuVO4 crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Li1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are four shorter (2.17 Å) and two longer (2.64 Å) Li–O bond lengths. V5+ is bonded in a distorted tetrahedral geometry to four O2- atoms. There is two shorter (1.69 Å) and two longer (1.84 Å) V–O bond length. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.95 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Li1+ and one V5+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one Li1+, one V5+, and two equivalent Cu2+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1103775
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; LiVCuO4; Cu-Li-O-V
- OSTI Identifier:
- 1678369
- DOI:
- https://doi.org/10.17188/1678369
Citation Formats
The Materials Project. Materials Data on LiVCuO4 by Materials Project. United States: N. p., 2018.
Web. doi:10.17188/1678369.
The Materials Project. Materials Data on LiVCuO4 by Materials Project. United States. doi:https://doi.org/10.17188/1678369
The Materials Project. 2018.
"Materials Data on LiVCuO4 by Materials Project". United States. doi:https://doi.org/10.17188/1678369. https://www.osti.gov/servlets/purl/1678369. Pub date:Wed Jul 18 00:00:00 EDT 2018
@article{osti_1678369,
title = {Materials Data on LiVCuO4 by Materials Project},
author = {The Materials Project},
abstractNote = {LiCuVO4 crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Li1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are four shorter (2.17 Å) and two longer (2.64 Å) Li–O bond lengths. V5+ is bonded in a distorted tetrahedral geometry to four O2- atoms. There is two shorter (1.69 Å) and two longer (1.84 Å) V–O bond length. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.95 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Li1+ and one V5+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one Li1+, one V5+, and two equivalent Cu2+ atoms.},
doi = {10.17188/1678369},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 18 00:00:00 EDT 2018},
month = {Wed Jul 18 00:00:00 EDT 2018}
}