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Title: Materials Data on Lu5(In2Ni)2 by Materials Project

Abstract

Lu5Ni2In4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a 8-coordinate geometry to two equivalent Ni and six In atoms. Both Lu–Ni bond lengths are 2.70 Å. There are a spread of Lu–In bond distances ranging from 3.11–3.35 Å. In the second Lu site, Lu is bonded in a 10-coordinate geometry to four equivalent Ni and six In atoms. There are two shorter (2.85 Å) and two longer (2.88 Å) Lu–Ni bond lengths. There are a spread of Lu–In bond distances ranging from 3.19–3.31 Å. In the third Lu site, Lu is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.15 Å) and four longer (3.27 Å) Lu–In bond lengths. Ni is bonded in a 9-coordinate geometry to six Lu and three In atoms. There are a spread of Ni–In bond distances ranging from 2.79–3.25 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Lu and one Ni atom. In the second In site, In is bonded in a 9-coordinate geometry to eightmore » Lu and two equivalent Ni atoms.« less

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-646321
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; Lu5(In2Ni)2; In-Lu-Ni
OSTI Identifier:
1280619
DOI:
10.17188/1280619

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Lu5(In2Ni)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280619.
Persson, Kristin, & Project, Materials. Materials Data on Lu5(In2Ni)2 by Materials Project. United States. doi:10.17188/1280619.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Lu5(In2Ni)2 by Materials Project". United States. doi:10.17188/1280619. https://www.osti.gov/servlets/purl/1280619. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1280619,
title = {Materials Data on Lu5(In2Ni)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Lu5Ni2In4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a 8-coordinate geometry to two equivalent Ni and six In atoms. Both Lu–Ni bond lengths are 2.70 Å. There are a spread of Lu–In bond distances ranging from 3.11–3.35 Å. In the second Lu site, Lu is bonded in a 10-coordinate geometry to four equivalent Ni and six In atoms. There are two shorter (2.85 Å) and two longer (2.88 Å) Lu–Ni bond lengths. There are a spread of Lu–In bond distances ranging from 3.19–3.31 Å. In the third Lu site, Lu is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.15 Å) and four longer (3.27 Å) Lu–In bond lengths. Ni is bonded in a 9-coordinate geometry to six Lu and three In atoms. There are a spread of Ni–In bond distances ranging from 2.79–3.25 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Lu and one Ni atom. In the second In site, In is bonded in a 9-coordinate geometry to eight Lu and two equivalent Ni atoms.},
doi = {10.17188/1280619},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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