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Title: Materials Data on CuClO by Materials Project

Abstract

CuOCl crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one CuOCl sheet oriented in the (0, 0, 1) direction. Cu3+ is bonded in a 6-coordinate geometry to three equivalent O2- and three equivalent Cl1- atoms. There are a spread of Cu–O bond distances ranging from 1.88–1.94 Å. There are a spread of Cu–Cl bond distances ranging from 2.20–2.78 Å. O2- is bonded in a trigonal non-coplanar geometry to three equivalent Cu3+ atoms. Cl1- is bonded in a 1-coordinate geometry to three equivalent Cu3+ atoms.

Publication Date:
Other Number(s):
mp-1102554
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; CuClO; Cl-Cu-O
OSTI Identifier:
1707399
DOI:
https://doi.org/10.17188/1707399

Citation Formats

The Materials Project. Materials Data on CuClO by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1707399.
The Materials Project. Materials Data on CuClO by Materials Project. United States. doi:https://doi.org/10.17188/1707399
The Materials Project. 2018. "Materials Data on CuClO by Materials Project". United States. doi:https://doi.org/10.17188/1707399. https://www.osti.gov/servlets/purl/1707399. Pub date:Wed Jul 18 00:00:00 EDT 2018
@article{osti_1707399,
title = {Materials Data on CuClO by Materials Project},
author = {The Materials Project},
abstractNote = {CuOCl crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one CuOCl sheet oriented in the (0, 0, 1) direction. Cu3+ is bonded in a 6-coordinate geometry to three equivalent O2- and three equivalent Cl1- atoms. There are a spread of Cu–O bond distances ranging from 1.88–1.94 Å. There are a spread of Cu–Cl bond distances ranging from 2.20–2.78 Å. O2- is bonded in a trigonal non-coplanar geometry to three equivalent Cu3+ atoms. Cl1- is bonded in a 1-coordinate geometry to three equivalent Cu3+ atoms.},
doi = {10.17188/1707399},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}