U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on EuAl3(BO3)4 by Materials Project
Abstract
EuAl3(BO3)4 is Calcite-derived structured and crystallizes in the trigonal R32 space group. The structure is three-dimensional. Eu3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Eu–O bond lengths are 2.40 Å. Al3+ is bonded to six O2- atoms to form edge-sharing AlO6 octahedra. There are a spread of Al–O bond distances ranging from 1.86–1.96 Å. There are two inequivalent B3+ sites. In the first B3+ site, B3+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All B–O bond lengths are 1.39 Å. In the second B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.37 Å) and one longer (1.40 Å) B–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one B3+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one B3+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to one Eu3+, one Al3+, and one B3+ atom.
- Publication Date:
- Other Number(s):
- mp-1019731
- 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-B-Eu-O; EuAl3(BO3)4; crystal structure
- OSTI Identifier:
- 1350759
- DOI:
- https://doi.org/10.17188/1350759
Citation Formats
Materials Data on EuAl3(BO3)4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1350759.
Materials Data on EuAl3(BO3)4 by Materials Project. United States. doi:https://doi.org/10.17188/1350759
2020.
"Materials Data on EuAl3(BO3)4 by Materials Project". United States. doi:https://doi.org/10.17188/1350759. https://www.osti.gov/servlets/purl/1350759. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1350759,
title = {Materials Data on EuAl3(BO3)4 by Materials Project},
abstractNote = {EuAl3(BO3)4 is Calcite-derived structured and crystallizes in the trigonal R32 space group. The structure is three-dimensional. Eu3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Eu–O bond lengths are 2.40 Å. Al3+ is bonded to six O2- atoms to form edge-sharing AlO6 octahedra. There are a spread of Al–O bond distances ranging from 1.86–1.96 Å. There are two inequivalent B3+ sites. In the first B3+ site, B3+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All B–O bond lengths are 1.39 Å. In the second B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.37 Å) and one longer (1.40 Å) B–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one B3+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one B3+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to one Eu3+, one Al3+, and one B3+ atom.},
doi = {10.17188/1350759},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Jul 14 00:00:00 EDT 2020},
month = {Tue Jul 14 00:00:00 EDT 2020}
}