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Title: Materials Data on Gd3Al5O12 by Materials Project

Abstract

Gd3Al5O12 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Gd3+ is bonded in a distorted body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.35 Å) and four longer (2.50 Å) Gd–O bond lengths. There are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to six equivalent O2- atoms to form corner-sharing AlO6 octahedra. All Al–O bond lengths are 1.95 Å. In the second Al3+ site, Al3+ is bonded to four equivalent O2- atoms to form corner-sharing AlO4 tetrahedra. The corner-sharing octahedral tilt angles are 48°. All Al–O bond lengths are 1.79 Å. O2- is bonded in a 4-coordinate geometry to two equivalent Gd3+ and two Al3+ atoms.

Publication Date:
Other Number(s):
mp-14133
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; Gd3Al5O12; Al-Gd-O
OSTI Identifier:
1190183
DOI:
10.17188/1190183

Citation Formats

The Materials Project. Materials Data on Gd3Al5O12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1190183.
The Materials Project. Materials Data on Gd3Al5O12 by Materials Project. United States. doi:10.17188/1190183.
The Materials Project. 2020. "Materials Data on Gd3Al5O12 by Materials Project". United States. doi:10.17188/1190183. https://www.osti.gov/servlets/purl/1190183. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1190183,
title = {Materials Data on Gd3Al5O12 by Materials Project},
author = {The Materials Project},
abstractNote = {Gd3Al5O12 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Gd3+ is bonded in a distorted body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.35 Å) and four longer (2.50 Å) Gd–O bond lengths. There are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to six equivalent O2- atoms to form corner-sharing AlO6 octahedra. All Al–O bond lengths are 1.95 Å. In the second Al3+ site, Al3+ is bonded to four equivalent O2- atoms to form corner-sharing AlO4 tetrahedra. The corner-sharing octahedral tilt angles are 48°. All Al–O bond lengths are 1.79 Å. O2- is bonded in a 4-coordinate geometry to two equivalent Gd3+ and two Al3+ atoms.},
doi = {10.17188/1190183},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

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