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Title: Materials Data on Li4H6Ru by Materials Project

Abstract

Li4RuH6 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 6-coordinate geometry to six equivalent H1- atoms. All Li–H bond lengths are 2.04 Å. In the second Li1+ site, Li1+ is bonded in a 8-coordinate geometry to eight equivalent H1- atoms. There are a spread of Li–H bond distances ranging from 2.12–2.33 Å. Ru2+ is bonded in an octahedral geometry to six equivalent H1- atoms. All Ru–H bond lengths are 1.72 Å. H1- is bonded in a 6-coordinate geometry to five Li1+ and one Ru2+ atom.

Publication Date:
Other Number(s):
mp-642847
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; Li4H6Ru; H-Li-Ru
OSTI Identifier:
1280217
DOI:
10.17188/1280217

Citation Formats

The Materials Project. Materials Data on Li4H6Ru by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280217.
The Materials Project. Materials Data on Li4H6Ru by Materials Project. United States. doi:10.17188/1280217.
The Materials Project. 2020. "Materials Data on Li4H6Ru by Materials Project". United States. doi:10.17188/1280217. https://www.osti.gov/servlets/purl/1280217. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1280217,
title = {Materials Data on Li4H6Ru by Materials Project},
author = {The Materials Project},
abstractNote = {Li4RuH6 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 6-coordinate geometry to six equivalent H1- atoms. All Li–H bond lengths are 2.04 Å. In the second Li1+ site, Li1+ is bonded in a 8-coordinate geometry to eight equivalent H1- atoms. There are a spread of Li–H bond distances ranging from 2.12–2.33 Å. Ru2+ is bonded in an octahedral geometry to six equivalent H1- atoms. All Ru–H bond lengths are 1.72 Å. H1- is bonded in a 6-coordinate geometry to five Li1+ and one Ru2+ atom.},
doi = {10.17188/1280217},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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