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Title: Materials Data on LaCrO3 by Materials Project

Abstract

LaCrO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. La3+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.39 Å) and six longer (2.80 Å) La–O bond lengths. Cr3+ is bonded to six equivalent O2- atoms to form corner-sharing CrO6 octahedra. The corner-sharing octahedral tilt angles are 24°. All Cr–O bond lengths are 2.02 Å. O2- is bonded in a 5-coordinate geometry to three equivalent La3+ and two equivalent Cr3+ atoms.

Publication Date:
Other Number(s):
mp-19357
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; LaCrO3; Cr-La-O
OSTI Identifier:
1194363
DOI:
https://doi.org/10.17188/1194363

Citation Formats

The Materials Project. Materials Data on LaCrO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1194363.
The Materials Project. Materials Data on LaCrO3 by Materials Project. United States. doi:https://doi.org/10.17188/1194363
The Materials Project. 2020. "Materials Data on LaCrO3 by Materials Project". United States. doi:https://doi.org/10.17188/1194363. https://www.osti.gov/servlets/purl/1194363. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1194363,
title = {Materials Data on LaCrO3 by Materials Project},
author = {The Materials Project},
abstractNote = {LaCrO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. La3+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.39 Å) and six longer (2.80 Å) La–O bond lengths. Cr3+ is bonded to six equivalent O2- atoms to form corner-sharing CrO6 octahedra. The corner-sharing octahedral tilt angles are 24°. All Cr–O bond lengths are 2.02 Å. O2- is bonded in a 5-coordinate geometry to three equivalent La3+ and two equivalent Cr3+ atoms.},
doi = {10.17188/1194363},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}