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Title: Materials Data on NdIr5 by Materials Project

Abstract

NdIr5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Nd is bonded in a 6-coordinate geometry to eighteen Ir atoms. There are six shorter (3.09 Å) and twelve longer (3.44 Å) Nd–Ir bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded to four equivalent Nd and eight Ir atoms to form a mixture of edge, face, and corner-sharing IrNd4Ir8 cuboctahedra. There are four shorter (2.66 Å) and four longer (2.68 Å) Ir–Ir bond lengths. In the second Ir site, Ir is bonded in a 12-coordinate geometry to three equivalent Nd and six equivalent Ir atoms.

Publication Date:
Other Number(s):
mp-569264
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; NdIr5; Ir-Nd
OSTI Identifier:
1275006
DOI:
10.17188/1275006

Citation Formats

The Materials Project. Materials Data on NdIr5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1275006.
The Materials Project. Materials Data on NdIr5 by Materials Project. United States. doi:10.17188/1275006.
The Materials Project. 2020. "Materials Data on NdIr5 by Materials Project". United States. doi:10.17188/1275006. https://www.osti.gov/servlets/purl/1275006. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1275006,
title = {Materials Data on NdIr5 by Materials Project},
author = {The Materials Project},
abstractNote = {NdIr5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Nd is bonded in a 6-coordinate geometry to eighteen Ir atoms. There are six shorter (3.09 Å) and twelve longer (3.44 Å) Nd–Ir bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded to four equivalent Nd and eight Ir atoms to form a mixture of edge, face, and corner-sharing IrNd4Ir8 cuboctahedra. There are four shorter (2.66 Å) and four longer (2.68 Å) Ir–Ir bond lengths. In the second Ir site, Ir is bonded in a 12-coordinate geometry to three equivalent Nd and six equivalent Ir atoms.},
doi = {10.17188/1275006},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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