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Title: Materials Data on NdCu5 by Materials Project

Abstract

NdCu5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Nd is bonded in a 6-coordinate geometry to eighteen Cu atoms. There are six shorter (2.95 Å) and twelve longer (3.28 Å) Nd–Cu bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent Nd and six equivalent Cu atoms. All Cu–Cu bond lengths are 2.53 Å. In the second Cu site, Cu is bonded to four equivalent Nd and eight Cu atoms to form a mixture of corner, edge, and face-sharing CuNd4Cu8 cuboctahedra. All Cu–Cu bond lengths are 2.56 Å.

Publication Date:
Other Number(s):
mp-1140
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; NdCu5; Cu-Nd
OSTI Identifier:
1187801
DOI:
https://doi.org/10.17188/1187801

Citation Formats

The Materials Project. Materials Data on NdCu5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187801.
The Materials Project. Materials Data on NdCu5 by Materials Project. United States. doi:https://doi.org/10.17188/1187801
The Materials Project. 2020. "Materials Data on NdCu5 by Materials Project". United States. doi:https://doi.org/10.17188/1187801. https://www.osti.gov/servlets/purl/1187801. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1187801,
title = {Materials Data on NdCu5 by Materials Project},
author = {The Materials Project},
abstractNote = {NdCu5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Nd is bonded in a 6-coordinate geometry to eighteen Cu atoms. There are six shorter (2.95 Å) and twelve longer (3.28 Å) Nd–Cu bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent Nd and six equivalent Cu atoms. All Cu–Cu bond lengths are 2.53 Å. In the second Cu site, Cu is bonded to four equivalent Nd and eight Cu atoms to form a mixture of corner, edge, and face-sharing CuNd4Cu8 cuboctahedra. All Cu–Cu bond lengths are 2.56 Å.},
doi = {10.17188/1187801},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}