U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiFe2F5 by Materials Project
Abstract
LiFe2F5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Li1+ is bonded in a distorted trigonal pyramidal geometry to four F1- atoms. There are a spread of Li–F bond distances ranging from 1.85–1.99 Å. There are two inequivalent Fe2+ sites. In the first Fe2+ site, Fe2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Fe–F bond distances ranging from 2.04–2.58 Å. In the second Fe2+ site, Fe2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Fe–F bond distances ranging from 2.04–2.68 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two equivalent Fe2+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two equivalent Fe2+ atoms. In the third F1- site, F1- is bonded in a 3-coordinate geometry to one Li1+ and three Fe2+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and three equivalent Fe2+ atoms. In the fifth F1- site, F1- is bonded in amore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-777684
- 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; LiFe2F5; F-Fe-Li
- OSTI Identifier:
- 1305246
- DOI:
- https://doi.org/10.17188/1305246
Citation Formats
The Materials Project. Materials Data on LiFe2F5 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1305246.
The Materials Project. Materials Data on LiFe2F5 by Materials Project. United States. doi:https://doi.org/10.17188/1305246
The Materials Project. 2017.
"Materials Data on LiFe2F5 by Materials Project". United States. doi:https://doi.org/10.17188/1305246. https://www.osti.gov/servlets/purl/1305246. Pub date:Fri Jul 21 00:00:00 EDT 2017
@article{osti_1305246,
title = {Materials Data on LiFe2F5 by Materials Project},
author = {The Materials Project},
abstractNote = {LiFe2F5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Li1+ is bonded in a distorted trigonal pyramidal geometry to four F1- atoms. There are a spread of Li–F bond distances ranging from 1.85–1.99 Å. There are two inequivalent Fe2+ sites. In the first Fe2+ site, Fe2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Fe–F bond distances ranging from 2.04–2.58 Å. In the second Fe2+ site, Fe2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Fe–F bond distances ranging from 2.04–2.68 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two equivalent Fe2+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two equivalent Fe2+ atoms. In the third F1- site, F1- is bonded in a 3-coordinate geometry to one Li1+ and three Fe2+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and three equivalent Fe2+ atoms. In the fifth F1- site, F1- is bonded in a 4-coordinate geometry to four Fe2+ atoms.},
doi = {10.17188/1305246},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri Jul 21 00:00:00 EDT 2017},
month = {Fri Jul 21 00:00:00 EDT 2017}
}