U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiAgF3 by Materials Project
Abstract
LiAgF3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 4-coordinate geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.94–2.56 Å. In the second Li1+ site, Li1+ is bonded in a 5-coordinate geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.94–2.55 Å. There are four inequivalent Ag2+ sites. In the first Ag2+ site, Ag2+ is bonded in a distorted square co-planar geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.09–2.74 Å. In the second Ag2+ site, Ag2+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.47 Å. In the third Ag2+ site, Ag2+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.48 Å. In the fourth Ag2+ site, Ag2+ is bonded in a distorted square co-planar geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.09–2.74 Å. There are six inequivalentmore »
- Publication Date:
- Other Number(s):
- mp-752837
- 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; Ag-F-Li; LiAgF3; crystal structure
- OSTI Identifier:
- 1288824
- DOI:
- https://doi.org/10.17188/1288824
Citation Formats
Materials Data on LiAgF3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1288824.
Materials Data on LiAgF3 by Materials Project. United States. doi:https://doi.org/10.17188/1288824
2020.
"Materials Data on LiAgF3 by Materials Project". United States. doi:https://doi.org/10.17188/1288824. https://www.osti.gov/servlets/purl/1288824. Pub date:Thu Jun 04 04:00:00 UTC 2020
@article{osti_1288824,
title = {Materials Data on LiAgF3 by Materials Project},
abstractNote = {LiAgF3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 4-coordinate geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.94–2.56 Å. In the second Li1+ site, Li1+ is bonded in a 5-coordinate geometry to five F1- atoms. There are a spread of Li–F bond distances ranging from 1.94–2.55 Å. There are four inequivalent Ag2+ sites. In the first Ag2+ site, Ag2+ is bonded in a distorted square co-planar geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.09–2.74 Å. In the second Ag2+ site, Ag2+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.47 Å. In the third Ag2+ site, Ag2+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.17–2.48 Å. In the fourth Ag2+ site, Ag2+ is bonded in a distorted square co-planar geometry to six F1- atoms. There are a spread of Ag–F bond distances ranging from 2.09–2.74 Å. There are six inequivalent F1- sites. In the first F1- site, F1- is bonded in a 4-coordinate geometry to two equivalent Li1+ and two Ag2+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two Ag2+ atoms. In the third F1- site, F1- is bonded in a 4-coordinate geometry to two Li1+ and two Ag2+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Li1+ and two Ag2+ atoms. In the fifth F1- site, F1- is bonded in a 4-coordinate geometry to two equivalent Li1+ and two Ag2+ atoms. In the sixth F1- site, F1- is bonded in a 4-coordinate geometry to two Li1+ and two Ag2+ atoms.},
doi = {10.17188/1288824},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {6}
}