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Title: Materials Data on Cu8O by Materials Project

Abstract

Cu8O crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are four inequivalent Cu sites. In the first Cu site, Cu is bonded in a 11-coordinate geometry to eleven Cu atoms. There are a spread of Cu–Cu bond distances ranging from 2.50–2.72 Å. In the second Cu site, Cu is bonded in a single-bond geometry to two equivalent Cu and one O atom. The Cu–O bond length is 1.93 Å. In the third Cu site, Cu is bonded in a single-bond geometry to four equivalent Cu and one O atom. The Cu–O bond length is 2.05 Å. In the fourth Cu site, Cu is bonded in a single-bond geometry to four equivalent Cu and one O atom. The Cu–O bond length is 2.06 Å. O is bonded in an octahedral geometry to six Cu atoms.

Publication Date:
Other Number(s):
mp-31217
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; Cu8O; Cu-O
OSTI Identifier:
1205514
DOI:
https://doi.org/10.17188/1205514

Citation Formats

The Materials Project. Materials Data on Cu8O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205514.
The Materials Project. Materials Data on Cu8O by Materials Project. United States. doi:https://doi.org/10.17188/1205514
The Materials Project. 2020. "Materials Data on Cu8O by Materials Project". United States. doi:https://doi.org/10.17188/1205514. https://www.osti.gov/servlets/purl/1205514. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1205514,
title = {Materials Data on Cu8O by Materials Project},
author = {The Materials Project},
abstractNote = {Cu8O crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are four inequivalent Cu sites. In the first Cu site, Cu is bonded in a 11-coordinate geometry to eleven Cu atoms. There are a spread of Cu–Cu bond distances ranging from 2.50–2.72 Å. In the second Cu site, Cu is bonded in a single-bond geometry to two equivalent Cu and one O atom. The Cu–O bond length is 1.93 Å. In the third Cu site, Cu is bonded in a single-bond geometry to four equivalent Cu and one O atom. The Cu–O bond length is 2.05 Å. In the fourth Cu site, Cu is bonded in a single-bond geometry to four equivalent Cu and one O atom. The Cu–O bond length is 2.06 Å. O is bonded in an octahedral geometry to six Cu atoms.},
doi = {10.17188/1205514},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}