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Title: Materials Data on LiMg by Materials Project

Abstract

LiMg crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are three inequivalent Li sites. In the first Li site, Li is bonded in a 8-coordinate geometry to four Li and four Mg atoms. There are two shorter (2.84 Å) and two longer (2.95 Å) Li–Li bond lengths. There are two shorter (2.99 Å) and two longer (3.03 Å) Li–Mg bond lengths. In the second Li site, Li is bonded in a distorted body-centered cubic geometry to four Li and four Mg atoms. Both Li–Li bond lengths are 2.84 Å. All Li–Mg bond lengths are 2.94 Å. In the third Li site, Li is bonded in a 9-coordinate geometry to four Li and five Mg atoms. There are a spread of Li–Mg bond distances ranging from 2.97–3.25 Å. There are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a 4-coordinate geometry to four Li atoms. In the second Mg site, Mg is bonded in a 12-coordinate geometry to four Li atoms. In the third Mg site, Mg is bonded in a 4-coordinate geometry to five Li atoms.

Authors:
Publication Date:
Other Number(s):
mp-976262
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; LiMg; Li-Mg
OSTI Identifier:
1315071
DOI:
https://doi.org/10.17188/1315071

Citation Formats

The Materials Project. Materials Data on LiMg by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1315071.
The Materials Project. Materials Data on LiMg by Materials Project. United States. doi:https://doi.org/10.17188/1315071
The Materials Project. 2020. "Materials Data on LiMg by Materials Project". United States. doi:https://doi.org/10.17188/1315071. https://www.osti.gov/servlets/purl/1315071. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1315071,
title = {Materials Data on LiMg by Materials Project},
author = {The Materials Project},
abstractNote = {LiMg crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are three inequivalent Li sites. In the first Li site, Li is bonded in a 8-coordinate geometry to four Li and four Mg atoms. There are two shorter (2.84 Å) and two longer (2.95 Å) Li–Li bond lengths. There are two shorter (2.99 Å) and two longer (3.03 Å) Li–Mg bond lengths. In the second Li site, Li is bonded in a distorted body-centered cubic geometry to four Li and four Mg atoms. Both Li–Li bond lengths are 2.84 Å. All Li–Mg bond lengths are 2.94 Å. In the third Li site, Li is bonded in a 9-coordinate geometry to four Li and five Mg atoms. There are a spread of Li–Mg bond distances ranging from 2.97–3.25 Å. There are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a 4-coordinate geometry to four Li atoms. In the second Mg site, Mg is bonded in a 12-coordinate geometry to four Li atoms. In the third Mg site, Mg is bonded in a 4-coordinate geometry to five Li atoms.},
doi = {10.17188/1315071},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}