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Title: Materials Data on YAlO3 by Materials Project

Abstract

YAlO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Y3+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.26 Å) and six longer (2.65 Å) Y–O bond lengths. Al3+ is bonded to six equivalent O2- atoms to form corner-sharing AlO6 octahedra. The corner-sharing octahedral tilt angles are 24°. All Al–O bond lengths are 1.91 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Y3+ and two equivalent Al3+ atoms.

Publication Date:
Other Number(s):
mp-756214
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; YAlO3; Al-O-Y
OSTI Identifier:
1290446
DOI:
10.17188/1290446

Citation Formats

The Materials Project. Materials Data on YAlO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1290446.
The Materials Project. Materials Data on YAlO3 by Materials Project. United States. doi:10.17188/1290446.
The Materials Project. 2020. "Materials Data on YAlO3 by Materials Project". United States. doi:10.17188/1290446. https://www.osti.gov/servlets/purl/1290446. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1290446,
title = {Materials Data on YAlO3 by Materials Project},
author = {The Materials Project},
abstractNote = {YAlO3 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Y3+ is bonded in a 3-coordinate geometry to nine equivalent O2- atoms. There are three shorter (2.26 Å) and six longer (2.65 Å) Y–O bond lengths. Al3+ is bonded to six equivalent O2- atoms to form corner-sharing AlO6 octahedra. The corner-sharing octahedral tilt angles are 24°. All Al–O bond lengths are 1.91 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Y3+ and two equivalent Al3+ atoms.},
doi = {10.17188/1290446},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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