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Title: Materials Data on Er5(In2Ni)2 by Materials Project

Abstract

Er5Ni2In4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.20 Å) and four longer (3.31 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Ni and six In atoms. There are two shorter (2.89 Å) and two longer (2.90 Å) Er–Ni bond lengths. There are a spread of Er–In bond distances ranging from 3.21–3.34 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Ni and six In atoms. Both Er–Ni bond lengths are 2.71 Å. There are a spread of Er–In bond distances ranging from 3.14–3.36 Å. Ni is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Ni–In bond distances ranging from 2.81–3.20 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Ni, and one In atom. The In–In bond length is 3.29 Å. In the second In site,more » In is bonded in a 11-coordinate geometry to eight Er, two equivalent Ni, and one In atom.« less

Publication Date:
Other Number(s):
mp-1192568
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; Er5(In2Ni)2; Er-In-Ni
OSTI Identifier:
1665350
DOI:
https://doi.org/10.17188/1665350

Citation Formats

The Materials Project. Materials Data on Er5(In2Ni)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1665350.
The Materials Project. Materials Data on Er5(In2Ni)2 by Materials Project. United States. doi:https://doi.org/10.17188/1665350
The Materials Project. 2019. "Materials Data on Er5(In2Ni)2 by Materials Project". United States. doi:https://doi.org/10.17188/1665350. https://www.osti.gov/servlets/purl/1665350. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1665350,
title = {Materials Data on Er5(In2Ni)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Er5Ni2In4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.20 Å) and four longer (3.31 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Ni and six In atoms. There are two shorter (2.89 Å) and two longer (2.90 Å) Er–Ni bond lengths. There are a spread of Er–In bond distances ranging from 3.21–3.34 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Ni and six In atoms. Both Er–Ni bond lengths are 2.71 Å. There are a spread of Er–In bond distances ranging from 3.14–3.36 Å. Ni is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Ni–In bond distances ranging from 2.81–3.20 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Ni, and one In atom. The In–In bond length is 3.29 Å. In the second In site, In is bonded in a 11-coordinate geometry to eight Er, two equivalent Ni, and one In atom.},
doi = {10.17188/1665350},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}