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Title: Materials Data on Dy2CuO4 by Materials Project

Abstract

Dy2CuO4 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Dy3+ is bonded in a 8-coordinate geometry to six O2- atoms. There are a spread of Dy–O bond distances ranging from 2.22–2.43 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.97 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Dy3+ and two equivalent Cu2+ atoms. In the second O2- site, O2- is bonded to four equivalent Dy3+ atoms to form a mixture of corner and edge-sharing ODy4 tetrahedra.

Publication Date:
Other Number(s):
mp-752673
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; Dy2CuO4; Cu-Dy-O
OSTI Identifier:
1288725
DOI:
https://doi.org/10.17188/1288725

Citation Formats

The Materials Project. Materials Data on Dy2CuO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1288725.
The Materials Project. Materials Data on Dy2CuO4 by Materials Project. United States. doi:https://doi.org/10.17188/1288725
The Materials Project. 2020. "Materials Data on Dy2CuO4 by Materials Project". United States. doi:https://doi.org/10.17188/1288725. https://www.osti.gov/servlets/purl/1288725. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1288725,
title = {Materials Data on Dy2CuO4 by Materials Project},
author = {The Materials Project},
abstractNote = {Dy2CuO4 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Dy3+ is bonded in a 8-coordinate geometry to six O2- atoms. There are a spread of Dy–O bond distances ranging from 2.22–2.43 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.97 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Dy3+ and two equivalent Cu2+ atoms. In the second O2- site, O2- is bonded to four equivalent Dy3+ atoms to form a mixture of corner and edge-sharing ODy4 tetrahedra.},
doi = {10.17188/1288725},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}