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Title: Materials Data on Zr2CoNi by Materials Project

Abstract

Zr2CoNi crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 7-coordinate geometry to three equivalent Co and four equivalent Ni atoms. There are one shorter (2.70 Å) and two longer (2.79 Å) Zr–Co bond lengths. All Zr–Ni bond lengths are 2.69 Å. In the second Zr site, Zr is bonded in a 7-coordinate geometry to four equivalent Co and three equivalent Ni atoms. All Zr–Co bond lengths are 2.68 Å. There are two shorter (2.75 Å) and one longer (2.76 Å) Zr–Ni bond lengths. Co is bonded in a 9-coordinate geometry to seven Zr and two equivalent Ni atoms. Both Co–Ni bond lengths are 2.64 Å. Ni is bonded in a 9-coordinate geometry to seven Zr and two equivalent Co atoms.

Authors:
Publication Date:
Other Number(s):
mp-1215600
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; Zr2CoNi; Co-Ni-Zr
OSTI Identifier:
1731924
DOI:
https://doi.org/10.17188/1731924

Citation Formats

The Materials Project. Materials Data on Zr2CoNi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1731924.
The Materials Project. Materials Data on Zr2CoNi by Materials Project. United States. doi:https://doi.org/10.17188/1731924
The Materials Project. 2020. "Materials Data on Zr2CoNi by Materials Project". United States. doi:https://doi.org/10.17188/1731924. https://www.osti.gov/servlets/purl/1731924. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1731924,
title = {Materials Data on Zr2CoNi by Materials Project},
author = {The Materials Project},
abstractNote = {Zr2CoNi crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 7-coordinate geometry to three equivalent Co and four equivalent Ni atoms. There are one shorter (2.70 Å) and two longer (2.79 Å) Zr–Co bond lengths. All Zr–Ni bond lengths are 2.69 Å. In the second Zr site, Zr is bonded in a 7-coordinate geometry to four equivalent Co and three equivalent Ni atoms. All Zr–Co bond lengths are 2.68 Å. There are two shorter (2.75 Å) and one longer (2.76 Å) Zr–Ni bond lengths. Co is bonded in a 9-coordinate geometry to seven Zr and two equivalent Ni atoms. Both Co–Ni bond lengths are 2.64 Å. Ni is bonded in a 9-coordinate geometry to seven Zr and two equivalent Co atoms.},
doi = {10.17188/1731924},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}