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Title: Materials Data on Li3In by Materials Project

Abstract

Li3In is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent Li and four equivalent In atoms to form a mixture of distorted face, edge, and corner-sharing LiLi4In4 tetrahedra. All Li–Li bond lengths are 2.88 Å. All Li–In bond lengths are 2.88 Å. In the second Li site, Li is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent In atoms. All Li–In bond lengths are 3.33 Å. In is bonded in a body-centered cubic geometry to fourteen Li atoms.

Publication Date:
Other Number(s):
mp-867226
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; In-Li; Li3In; crystal structure
OSTI Identifier:
1311890
DOI:
https://doi.org/10.17188/1311890

Citation Formats

Materials Data on Li3In by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1311890.
Materials Data on Li3In by Materials Project. United States. doi:https://doi.org/10.17188/1311890
2020. "Materials Data on Li3In by Materials Project". United States. doi:https://doi.org/10.17188/1311890. https://www.osti.gov/servlets/purl/1311890. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1311890,
title = {Materials Data on Li3In by Materials Project},
abstractNote = {Li3In is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent Li and four equivalent In atoms to form a mixture of distorted face, edge, and corner-sharing LiLi4In4 tetrahedra. All Li–Li bond lengths are 2.88 Å. All Li–In bond lengths are 2.88 Å. In the second Li site, Li is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent In atoms. All Li–In bond lengths are 3.33 Å. In is bonded in a body-centered cubic geometry to fourteen Li atoms.},
doi = {10.17188/1311890},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}