U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Li2AgF3 by Materials Project
Abstract
Li2AgF3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a distorted rectangular see-saw-like geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.91–2.72 Å. In the second Li1+ site, Li1+ is bonded to five F1- atoms to form edge-sharing LiF5 square pyramids. There are a spread of Li–F bond distances ranging from 1.94–2.02 Å. Ag1+ is bonded in a 1-coordinate geometry to four F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.59 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded to five Li1+ atoms to form edge-sharing FLi5 square pyramids. In the second F1- site, F1- is bonded in a trigonal non-coplanar geometry to two equivalent Li1+ and one Ag1+ atom. In the third F1- site, F1- is bonded in a 2-coordinate geometry to three Li1+ and three equivalent Ag1+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-760805
- 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; Li2AgF3; Ag-F-Li
- OSTI Identifier:
- 1291711
- DOI:
- https://doi.org/10.17188/1291711
Citation Formats
The Materials Project. Materials Data on Li2AgF3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1291711.
The Materials Project. Materials Data on Li2AgF3 by Materials Project. United States. doi:https://doi.org/10.17188/1291711
The Materials Project. 2020.
"Materials Data on Li2AgF3 by Materials Project". United States. doi:https://doi.org/10.17188/1291711. https://www.osti.gov/servlets/purl/1291711. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1291711,
title = {Materials Data on Li2AgF3 by Materials Project},
author = {The Materials Project},
abstractNote = {Li2AgF3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a distorted rectangular see-saw-like geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.91–2.72 Å. In the second Li1+ site, Li1+ is bonded to five F1- atoms to form edge-sharing LiF5 square pyramids. There are a spread of Li–F bond distances ranging from 1.94–2.02 Å. Ag1+ is bonded in a 1-coordinate geometry to four F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.59 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded to five Li1+ atoms to form edge-sharing FLi5 square pyramids. In the second F1- site, F1- is bonded in a trigonal non-coplanar geometry to two equivalent Li1+ and one Ag1+ atom. In the third F1- site, F1- is bonded in a 2-coordinate geometry to three Li1+ and three equivalent Ag1+ atoms.},
doi = {10.17188/1291711},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}