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Title: 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.

Authors:
Publication Date:
Other Number(s):
mp-647903
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Ba2LuSbO6; Ba-Lu-O-Sb
OSTI Identifier:
1280785
DOI:
https://doi.org/10.17188/1280785

Citation Formats

The Materials Project. Materials Data on Ba2LuSbO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280785.
The Materials Project. Materials Data on Ba2LuSbO6 by Materials Project. United States. doi:https://doi.org/10.17188/1280785
The Materials Project. 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 00:00:00 EDT 2020
@article{osti_1280785,
title = {Materials Data on Ba2LuSbO6 by Materials Project},
author = {The 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}
}