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Title: Materials Data on La2Ni3 by Materials Project

Abstract

La2Ni3 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to ten Ni atoms. There are a spread of La–Ni bond distances ranging from 2.95–3.53 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to eight equivalent La and four equivalent Ni atoms to form a mixture of distorted corner, edge, and face-sharing NiLa8Ni4 cuboctahedra. All Ni–Ni bond lengths are 2.51 Å. In the second Ni site, Ni is bonded in a 10-coordinate geometry to six equivalent La and four Ni atoms. Both Ni–Ni bond lengths are 2.52 Å.

Authors:
Publication Date:
Other Number(s):
mp-1691
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; La2Ni3; La-Ni
OSTI Identifier:
1192231
DOI:
https://doi.org/10.17188/1192231

Citation Formats

The Materials Project. Materials Data on La2Ni3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192231.
The Materials Project. Materials Data on La2Ni3 by Materials Project. United States. doi:https://doi.org/10.17188/1192231
The Materials Project. 2020. "Materials Data on La2Ni3 by Materials Project". United States. doi:https://doi.org/10.17188/1192231. https://www.osti.gov/servlets/purl/1192231. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1192231,
title = {Materials Data on La2Ni3 by Materials Project},
author = {The Materials Project},
abstractNote = {La2Ni3 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to ten Ni atoms. There are a spread of La–Ni bond distances ranging from 2.95–3.53 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to eight equivalent La and four equivalent Ni atoms to form a mixture of distorted corner, edge, and face-sharing NiLa8Ni4 cuboctahedra. All Ni–Ni bond lengths are 2.51 Å. In the second Ni site, Ni is bonded in a 10-coordinate geometry to six equivalent La and four Ni atoms. Both Ni–Ni bond lengths are 2.52 Å.},
doi = {10.17188/1192231},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}