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Title: Materials Data on LiMgN by Materials Project

Abstract

LiMgN crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li1+ is bonded to four equivalent N3- atoms to form distorted LiN4 tetrahedra that share corners with eight equivalent LiN4 tetrahedra, corners with eight equivalent MgN4 tetrahedra, edges with two equivalent LiN4 tetrahedra, and edges with four equivalent MgN4 tetrahedra. There are a spread of Li–N bond distances ranging from 2.14–2.42 Å. Mg2+ is bonded to four equivalent N3- atoms to form MgN4 tetrahedra that share corners with eight equivalent LiN4 tetrahedra, corners with eight equivalent MgN4 tetrahedra, edges with two equivalent MgN4 tetrahedra, and edges with four equivalent LiN4 tetrahedra. There are a spread of Mg–N bond distances ranging from 2.11–2.18 Å. N3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Mg2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-30156
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; LiMgN; Li-Mg-N
OSTI Identifier:
1204571
DOI:
https://doi.org/10.17188/1204571

Citation Formats

The Materials Project. Materials Data on LiMgN by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204571.
The Materials Project. Materials Data on LiMgN by Materials Project. United States. doi:https://doi.org/10.17188/1204571
The Materials Project. 2020. "Materials Data on LiMgN by Materials Project". United States. doi:https://doi.org/10.17188/1204571. https://www.osti.gov/servlets/purl/1204571. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1204571,
title = {Materials Data on LiMgN by Materials Project},
author = {The Materials Project},
abstractNote = {LiMgN crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li1+ is bonded to four equivalent N3- atoms to form distorted LiN4 tetrahedra that share corners with eight equivalent LiN4 tetrahedra, corners with eight equivalent MgN4 tetrahedra, edges with two equivalent LiN4 tetrahedra, and edges with four equivalent MgN4 tetrahedra. There are a spread of Li–N bond distances ranging from 2.14–2.42 Å. Mg2+ is bonded to four equivalent N3- atoms to form MgN4 tetrahedra that share corners with eight equivalent LiN4 tetrahedra, corners with eight equivalent MgN4 tetrahedra, edges with two equivalent MgN4 tetrahedra, and edges with four equivalent LiN4 tetrahedra. There are a spread of Mg–N bond distances ranging from 2.11–2.18 Å. N3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Mg2+ atoms.},
doi = {10.17188/1204571},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}