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Title: Materials Data on SrLi4N2 by Materials Project

Abstract

Li4SrN2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a trigonal planar geometry to three equivalent N3- atoms. There are one shorter (2.12 Å) and two longer (2.14 Å) Li–N bond lengths. In the second Li1+ site, Li1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Li–N bond lengths are 1.92 Å. Sr2+ is bonded in a 4-coordinate geometry to four equivalent N3- atoms. All Sr–N bond lengths are 2.66 Å. N3- is bonded to five Li1+ and two equivalent Sr2+ atoms to form a mixture of distorted edge and corner-sharing NSr2Li5 pentagonal bipyramids.

Publication Date:
Other Number(s):
mp-15845
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; SrLi4N2; Li-N-Sr
OSTI Identifier:
1191417
DOI:
10.17188/1191417

Citation Formats

The Materials Project. Materials Data on SrLi4N2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1191417.
The Materials Project. Materials Data on SrLi4N2 by Materials Project. United States. doi:10.17188/1191417.
The Materials Project. 2020. "Materials Data on SrLi4N2 by Materials Project". United States. doi:10.17188/1191417. https://www.osti.gov/servlets/purl/1191417. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1191417,
title = {Materials Data on SrLi4N2 by Materials Project},
author = {The Materials Project},
abstractNote = {Li4SrN2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a trigonal planar geometry to three equivalent N3- atoms. There are one shorter (2.12 Å) and two longer (2.14 Å) Li–N bond lengths. In the second Li1+ site, Li1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Li–N bond lengths are 1.92 Å. Sr2+ is bonded in a 4-coordinate geometry to four equivalent N3- atoms. All Sr–N bond lengths are 2.66 Å. N3- is bonded to five Li1+ and two equivalent Sr2+ atoms to form a mixture of distorted edge and corner-sharing NSr2Li5 pentagonal bipyramids.},
doi = {10.17188/1191417},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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