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Title: Materials Data on Yb3Y3Al10O24 by Materials Project

Abstract

Yb3Y3Al10O24 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. Yb3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.37 Å) and four longer (2.46 Å) Yb–O bond lengths. Y3+ is bonded in a distorted body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.33 Å) and four longer (2.46 Å) Y–O bond lengths. There are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to six O2- atoms to form corner-sharing AlO6 octahedra. There is three shorter (1.92 Å) and three longer (1.95 Å) Al–O bond length. In the second Al3+ site, Al3+ is bonded to four O2- atoms to form corner-sharing AlO4 tetrahedra. The corner-sharing octahedra tilt angles range from 48–50°. There is two shorter (1.78 Å) and two longer (1.79 Å) Al–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Y3+ and two Al3+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Yb3+ and two Al3+ atoms.

Publication Date:
Other Number(s):
mp-1215938
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; Yb3Y3Al10O24; Al-O-Y-Yb
OSTI Identifier:
1710622
DOI:
https://doi.org/10.17188/1710622

Citation Formats

The Materials Project. Materials Data on Yb3Y3Al10O24 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1710622.
The Materials Project. Materials Data on Yb3Y3Al10O24 by Materials Project. United States. doi:https://doi.org/10.17188/1710622
The Materials Project. 2020. "Materials Data on Yb3Y3Al10O24 by Materials Project". United States. doi:https://doi.org/10.17188/1710622. https://www.osti.gov/servlets/purl/1710622. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1710622,
title = {Materials Data on Yb3Y3Al10O24 by Materials Project},
author = {The Materials Project},
abstractNote = {Yb3Y3Al10O24 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. Yb3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.37 Å) and four longer (2.46 Å) Yb–O bond lengths. Y3+ is bonded in a distorted body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.33 Å) and four longer (2.46 Å) Y–O bond lengths. There are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to six O2- atoms to form corner-sharing AlO6 octahedra. There is three shorter (1.92 Å) and three longer (1.95 Å) Al–O bond length. In the second Al3+ site, Al3+ is bonded to four O2- atoms to form corner-sharing AlO4 tetrahedra. The corner-sharing octahedra tilt angles range from 48–50°. There is two shorter (1.78 Å) and two longer (1.79 Å) Al–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Y3+ and two Al3+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Yb3+ and two Al3+ atoms.},
doi = {10.17188/1710622},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}