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Title: Materials Data on ErCrO4 by Materials Project

Abstract

ErCrO4 is Zircon-like structured and crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Er3+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are four shorter (2.32 Å) and four longer (2.40 Å) Er–O bond lengths. Cr5+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Cr–O bond lengths are 1.73 Å. O2- is bonded in a 3-coordinate geometry to two equivalent Er3+ and one Cr5+ atom.

Publication Date:
Other Number(s):
mp-1101893
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; ErCrO4; Cr-Er-O
OSTI Identifier:
1685686
DOI:
https://doi.org/10.17188/1685686

Citation Formats

The Materials Project. Materials Data on ErCrO4 by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1685686.
The Materials Project. Materials Data on ErCrO4 by Materials Project. United States. doi:https://doi.org/10.17188/1685686
The Materials Project. 2018. "Materials Data on ErCrO4 by Materials Project". United States. doi:https://doi.org/10.17188/1685686. https://www.osti.gov/servlets/purl/1685686. Pub date:Wed Jul 18 00:00:00 EDT 2018
@article{osti_1685686,
title = {Materials Data on ErCrO4 by Materials Project},
author = {The Materials Project},
abstractNote = {ErCrO4 is Zircon-like structured and crystallizes in the tetragonal I4_1/a space group. The structure is three-dimensional. Er3+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are four shorter (2.32 Å) and four longer (2.40 Å) Er–O bond lengths. Cr5+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Cr–O bond lengths are 1.73 Å. O2- is bonded in a 3-coordinate geometry to two equivalent Er3+ and one Cr5+ atom.},
doi = {10.17188/1685686},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}