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Title: Materials Data on LiAuF6 by Materials Project

Abstract

LiAuF6 is Upper Bainite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent F1- atoms to form LiF6 octahedra that share corners with six equivalent AuF6 octahedra. The corner-sharing octahedral tilt angles are 44°. All Li–F bond lengths are 2.06 Å. Au5+ is bonded to six equivalent F1- atoms to form AuF6 octahedra that share corners with six equivalent LiF6 octahedra. The corner-sharing octahedral tilt angles are 44°. All Au–F bond lengths are 1.95 Å. F1- is bonded in a distorted bent 150 degrees geometry to one Li1+ and one Au5+ atom.

Publication Date:
Other Number(s):
mp-1079483
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; Au-F-Li; LiAuF6; crystal structure
OSTI Identifier:
1726976
DOI:
https://doi.org/10.17188/1726976

Citation Formats

Materials Data on LiAuF6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1726976.
Materials Data on LiAuF6 by Materials Project. United States. doi:https://doi.org/10.17188/1726976
2020. "Materials Data on LiAuF6 by Materials Project". United States. doi:https://doi.org/10.17188/1726976. https://www.osti.gov/servlets/purl/1726976. Pub date:Sat May 09 04:00:00 UTC 2020
@article{osti_1726976,
title = {Materials Data on LiAuF6 by Materials Project},
abstractNote = {LiAuF6 is Upper Bainite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent F1- atoms to form LiF6 octahedra that share corners with six equivalent AuF6 octahedra. The corner-sharing octahedral tilt angles are 44°. All Li–F bond lengths are 2.06 Å. Au5+ is bonded to six equivalent F1- atoms to form AuF6 octahedra that share corners with six equivalent LiF6 octahedra. The corner-sharing octahedral tilt angles are 44°. All Au–F bond lengths are 1.95 Å. F1- is bonded in a distorted bent 150 degrees geometry to one Li1+ and one Au5+ atom.},
doi = {10.17188/1726976},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}