U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiCoF2 by Materials Project
Abstract
LiCoF2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Li1+ is bonded to six equivalent F1- atoms to form LiF6 octahedra that share corners with six equivalent CoF6 octahedra, edges with six equivalent LiF6 octahedra, and edges with six equivalent CoF6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Li–F bond lengths are 2.02 Å. Co1+ is bonded to six equivalent F1- atoms to form distorted CoF6 octahedra that share corners with six equivalent LiF6 octahedra, edges with six equivalent LiF6 octahedra, and edges with six equivalent CoF6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Co–F bond lengths are 2.30 Å. F1- is bonded to three equivalent Li1+ and three equivalent Co1+ atoms to form a mixture of corner and edge-sharing FLi3Co3 octahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-1097040
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Co-F-Li; LiCoF2; crystal structure
- OSTI Identifier:
- 1718356
- DOI:
- https://doi.org/10.17188/1718356
Citation Formats
Materials Data on LiCoF2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1718356.
Materials Data on LiCoF2 by Materials Project. United States. doi:https://doi.org/10.17188/1718356
2020.
"Materials Data on LiCoF2 by Materials Project". United States. doi:https://doi.org/10.17188/1718356. https://www.osti.gov/servlets/purl/1718356. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1718356,
title = {Materials Data on LiCoF2 by Materials Project},
abstractNote = {LiCoF2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Li1+ is bonded to six equivalent F1- atoms to form LiF6 octahedra that share corners with six equivalent CoF6 octahedra, edges with six equivalent LiF6 octahedra, and edges with six equivalent CoF6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Li–F bond lengths are 2.02 Å. Co1+ is bonded to six equivalent F1- atoms to form distorted CoF6 octahedra that share corners with six equivalent LiF6 octahedra, edges with six equivalent LiF6 octahedra, and edges with six equivalent CoF6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Co–F bond lengths are 2.30 Å. F1- is bonded to three equivalent Li1+ and three equivalent Co1+ atoms to form a mixture of corner and edge-sharing FLi3Co3 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1718356},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}