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Title: Materials Data on Li2AgF3 by Materials Project

Abstract

Li2AgF3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Li1+ is bonded to six F1- atoms to form a mixture of distorted edge, face, and corner-sharing LiF6 octahedra. The corner-sharing octahedra tilt angles range from 18–26°. There are a spread of Li–F bond distances ranging from 2.06–2.20 Å. Ag1+ is bonded in a trigonal planar geometry to three F1- atoms. There are one shorter (2.26 Å) and two longer (2.29 Å) Ag–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent Li1+ and one Ag1+ atom. In the second F1- site, F1- is bonded to four equivalent Li1+ and one Ag1+ atom to form distorted edge-sharing FLi4Ag square pyramids.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-759198
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Li2AgF3; Ag-F-Li
OSTI Identifier:
1291360
DOI:
10.17188/1291360

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Li2AgF3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1291360.
Persson, Kristin, & Project, Materials. Materials Data on Li2AgF3 by Materials Project. United States. doi:10.17188/1291360.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Li2AgF3 by Materials Project". United States. doi:10.17188/1291360. https://www.osti.gov/servlets/purl/1291360. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1291360,
title = {Materials Data on Li2AgF3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Li2AgF3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Li1+ is bonded to six F1- atoms to form a mixture of distorted edge, face, and corner-sharing LiF6 octahedra. The corner-sharing octahedra tilt angles range from 18–26°. There are a spread of Li–F bond distances ranging from 2.06–2.20 Å. Ag1+ is bonded in a trigonal planar geometry to three F1- atoms. There are one shorter (2.26 Å) and two longer (2.29 Å) Ag–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent Li1+ and one Ag1+ atom. In the second F1- site, F1- is bonded to four equivalent Li1+ and one Ag1+ atom to form distorted edge-sharing FLi4Ag square pyramids.},
doi = {10.17188/1291360},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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