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Title: Materials Data on Co2CuO4 by Materials Project

Abstract

CuCo2O4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Co3+ is bonded to six equivalent O2- atoms to form CoO6 octahedra that share corners with six equivalent CuO4 tetrahedra and edges with six equivalent CoO6 octahedra. All Co–O bond lengths are 1.99 Å. Cu2+ is bonded to four equivalent O2- atoms to form CuO4 tetrahedra that share corners with twelve equivalent CoO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Cu–O bond lengths are 1.95 Å. O2- is bonded to three equivalent Co3+ and one Cu2+ atom to form a mixture of distorted edge and corner-sharing OCo3Cu trigonal pyramids.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-34146
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; Co2CuO4; Co-Cu-O
OSTI Identifier:
1206730
DOI:
10.17188/1206730

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Co2CuO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1206730.
Persson, Kristin, & Project, Materials. Materials Data on Co2CuO4 by Materials Project. United States. doi:10.17188/1206730.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Co2CuO4 by Materials Project". United States. doi:10.17188/1206730. https://www.osti.gov/servlets/purl/1206730. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1206730,
title = {Materials Data on Co2CuO4 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CuCo2O4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Co3+ is bonded to six equivalent O2- atoms to form CoO6 octahedra that share corners with six equivalent CuO4 tetrahedra and edges with six equivalent CoO6 octahedra. All Co–O bond lengths are 1.99 Å. Cu2+ is bonded to four equivalent O2- atoms to form CuO4 tetrahedra that share corners with twelve equivalent CoO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Cu–O bond lengths are 1.95 Å. O2- is bonded to three equivalent Co3+ and one Cu2+ atom to form a mixture of distorted edge and corner-sharing OCo3Cu trigonal pyramids.},
doi = {10.17188/1206730},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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