U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ba2LuSbO6 by Materials Project
Abstract
Lu(BaO3)2Sb is alpha Rhenium trioxide-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional and consists of two antimony molecules, two lutetium molecules, and one BaO3 framework. In the BaO3 framework, Ba2+ is bonded to six O2- atoms to form corner-sharing BaO6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are four shorter (2.35 Å) and two longer (2.36 Å) Ba–O bond lengths. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the second O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the fourth O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. Both O–Ba bond lengths are 2.35 Å.
- Publication Date:
- Other Number(s):
- mp-647903
- 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; Ba-Lu-O-Sb; Ba2LuSbO6; crystal structure
- OSTI Identifier:
- 1280785
- DOI:
- https://doi.org/10.17188/1280785
Citation Formats
Materials Data on Ba2LuSbO6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1280785.
Materials Data on Ba2LuSbO6 by Materials Project. United States. doi:https://doi.org/10.17188/1280785
2020.
"Materials Data on Ba2LuSbO6 by Materials Project". United States. doi:https://doi.org/10.17188/1280785. https://www.osti.gov/servlets/purl/1280785. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1280785,
title = {Materials Data on Ba2LuSbO6 by Materials Project},
abstractNote = {Lu(BaO3)2Sb is alpha Rhenium trioxide-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional and consists of two antimony molecules, two lutetium molecules, and one BaO3 framework. In the BaO3 framework, Ba2+ is bonded to six O2- atoms to form corner-sharing BaO6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are four shorter (2.35 Å) and two longer (2.36 Å) Ba–O bond lengths. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the second O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. In the fourth O2- site, O2- is bonded in a linear geometry to two equivalent Ba2+ atoms. Both O–Ba bond lengths are 2.35 Å.},
doi = {10.17188/1280785},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}