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Title: Materials Data on Er5(In2Pd)2 by Materials Project

Abstract

Er5(PdIn2)2 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 (3.19 Å) and four longer (3.32 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.94 Å) and two longer (2.96 Å) Er–Pd bond lengths. There are a spread of Er–In bond distances ranging from 3.31–3.43 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Er–Pd bond lengths are 2.84 Å. There are a spread of Er–In bond distances ranging from 3.21–3.40 Å. Pd is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Pd–In bond distances ranging from 2.95–3.30 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Pd, and one In atom. The In–In bond length is 3.31 Å. In the second In site,more » In is bonded in a 11-coordinate geometry to eight Er, two equivalent Pd, and one In atom.« less

Authors:
Publication Date:
Other Number(s):
mp-1190725
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; Er5(In2Pd)2; Er-In-Pd
OSTI Identifier:
1682824
DOI:
https://doi.org/10.17188/1682824

Citation Formats

The Materials Project. Materials Data on Er5(In2Pd)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1682824.
The Materials Project. Materials Data on Er5(In2Pd)2 by Materials Project. United States. doi:https://doi.org/10.17188/1682824
The Materials Project. 2019. "Materials Data on Er5(In2Pd)2 by Materials Project". United States. doi:https://doi.org/10.17188/1682824. https://www.osti.gov/servlets/purl/1682824. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1682824,
title = {Materials Data on Er5(In2Pd)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Er5(PdIn2)2 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 (3.19 Å) and four longer (3.32 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.94 Å) and two longer (2.96 Å) Er–Pd bond lengths. There are a spread of Er–In bond distances ranging from 3.31–3.43 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Er–Pd bond lengths are 2.84 Å. There are a spread of Er–In bond distances ranging from 3.21–3.40 Å. Pd is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Pd–In bond distances ranging from 2.95–3.30 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Pd, and one In atom. The In–In bond length is 3.31 Å. In the second In site, In is bonded in a 11-coordinate geometry to eight Er, two equivalent Pd, and one In atom.},
doi = {10.17188/1682824},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}