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Title: Materials Data on Zr2InCo2 by Materials Project

Abstract

Zr2Co2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Co and four equivalent In atoms. There are two shorter (2.67 Å) and four longer (2.71 Å) Zr–Co bond lengths. All Zr–In bond lengths are 3.15 Å. Co is bonded in a 6-coordinate geometry to six equivalent Zr, one Co, and two equivalent In atoms. The Co–Co bond length is 2.58 Å. Both Co–In bond lengths are 2.85 Å. In is bonded to eight equivalent Zr, four equivalent Co, and two equivalent In atoms to form a mixture of distorted corner and face-sharing InZr8In2Co4 cuboctahedra. Both In–In bond lengths are 3.30 Å.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-22150
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; Zr2InCo2; Co-In-Zr
OSTI Identifier:
1197379
DOI:
10.17188/1197379

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Zr2InCo2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1197379.
Persson, Kristin, & Project, Materials. Materials Data on Zr2InCo2 by Materials Project. United States. doi:10.17188/1197379.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Zr2InCo2 by Materials Project". United States. doi:10.17188/1197379. https://www.osti.gov/servlets/purl/1197379. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1197379,
title = {Materials Data on Zr2InCo2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Zr2Co2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Co and four equivalent In atoms. There are two shorter (2.67 Å) and four longer (2.71 Å) Zr–Co bond lengths. All Zr–In bond lengths are 3.15 Å. Co is bonded in a 6-coordinate geometry to six equivalent Zr, one Co, and two equivalent In atoms. The Co–Co bond length is 2.58 Å. Both Co–In bond lengths are 2.85 Å. In is bonded to eight equivalent Zr, four equivalent Co, and two equivalent In atoms to form a mixture of distorted corner and face-sharing InZr8In2Co4 cuboctahedra. Both In–In bond lengths are 3.30 Å.},
doi = {10.17188/1197379},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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