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Title: Materials Data on Zr2Cu by Materials Project

Abstract

Zr2Cu crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 2-coordinate geometry to four equivalent Cu atoms. There are two shorter (2.90 Å) and two longer (3.20 Å) Zr–Cu bond lengths. In the second Zr site, Zr is bonded in a 6-coordinate geometry to six equivalent Cu atoms. All Zr–Cu bond lengths are 2.67 Å. Cu is bonded in a 12-coordinate geometry to nine Zr and three equivalent Cu atoms. All Cu–Cu bond lengths are 2.92 Å.

Publication Date:
Other Number(s):
mp-583800
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; Zr2Cu; Cu-Zr
OSTI Identifier:
1272584
DOI:
10.17188/1272584

Citation Formats

The Materials Project. Materials Data on Zr2Cu by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1272584.
The Materials Project. Materials Data on Zr2Cu by Materials Project. United States. doi:10.17188/1272584.
The Materials Project. 2020. "Materials Data on Zr2Cu by Materials Project". United States. doi:10.17188/1272584. https://www.osti.gov/servlets/purl/1272584. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1272584,
title = {Materials Data on Zr2Cu by Materials Project},
author = {The Materials Project},
abstractNote = {Zr2Cu crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 2-coordinate geometry to four equivalent Cu atoms. There are two shorter (2.90 Å) and two longer (3.20 Å) Zr–Cu bond lengths. In the second Zr site, Zr is bonded in a 6-coordinate geometry to six equivalent Cu atoms. All Zr–Cu bond lengths are 2.67 Å. Cu is bonded in a 12-coordinate geometry to nine Zr and three equivalent Cu atoms. All Cu–Cu bond lengths are 2.92 Å.},
doi = {10.17188/1272584},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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