U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Gd3Sc2Al3O12 by Materials Project
Abstract
Gd3Sc2Al3O12 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Gd3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.39 Å) and four longer (2.50 Å) Gd–O bond lengths. Sc3+ is bonded to six equivalent O2- atoms to form ScO6 octahedra that share corners with six equivalent AlO4 tetrahedra. All Sc–O bond lengths are 2.12 Å. Al3+ is bonded to four equivalent O2- atoms to form AlO4 tetrahedra that share corners with four equivalent ScO6 octahedra. The corner-sharing octahedral tilt angles are 53°. All Al–O bond lengths are 1.79 Å. O2- is bonded in a 4-coordinate geometry to two equivalent Gd3+, one Sc3+, and one Al3+ atom.
- Publication Date:
- Other Number(s):
- mp-1213017
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Al-Gd-O-Sc; Gd3Sc2Al3O12; crystal structure
- OSTI Identifier:
- 1699979
- DOI:
- https://doi.org/10.17188/1699979
Citation Formats
Materials Data on Gd3Sc2Al3O12 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1699979.
Materials Data on Gd3Sc2Al3O12 by Materials Project. United States. doi:https://doi.org/10.17188/1699979
2020.
"Materials Data on Gd3Sc2Al3O12 by Materials Project". United States. doi:https://doi.org/10.17188/1699979. https://www.osti.gov/servlets/purl/1699979. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1699979,
title = {Materials Data on Gd3Sc2Al3O12 by Materials Project},
abstractNote = {Gd3Sc2Al3O12 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Gd3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.39 Å) and four longer (2.50 Å) Gd–O bond lengths. Sc3+ is bonded to six equivalent O2- atoms to form ScO6 octahedra that share corners with six equivalent AlO4 tetrahedra. All Sc–O bond lengths are 2.12 Å. Al3+ is bonded to four equivalent O2- atoms to form AlO4 tetrahedra that share corners with four equivalent ScO6 octahedra. The corner-sharing octahedral tilt angles are 53°. All Al–O bond lengths are 1.79 Å. O2- is bonded in a 4-coordinate geometry to two equivalent Gd3+, one Sc3+, and one Al3+ atom.},
doi = {10.17188/1699979},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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