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Title: Materials Data on RbSbMoO6 by Materials Project

Abstract

RbMoSbO6 crystallizes in the orthorhombic Ima2 space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.94–3.48 Å. Mo6+ is bonded to six O2- atoms to form distorted MoO6 octahedra that share corners with two equivalent MoO6 octahedra and corners with four equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 35–45°. There are a spread of Mo–O bond distances ranging from 1.78–2.26 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with two equivalent SbO6 octahedra and corners with four equivalent MoO6 octahedra. The corner-sharing octahedra tilt angles range from 35–48°. There is two shorter (1.98 Å) and four longer (2.01 Å) Sb–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to one Rb1+ and two equivalent Mo6+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+ and two equivalent Sb5+ atoms. In the third O2- site, O2- is bonded in a bent 150 degrees geometry to one Rb1+, one Mo6+, and one Sb5+ atom. Inmore » the fourth O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+, one Mo6+, and one Sb5+ atom.« less

Publication Date:
Other Number(s):
mp-1219606
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; RbSbMoO6; Mo-O-Rb-Sb
OSTI Identifier:
1737961
DOI:
https://doi.org/10.17188/1737961

Citation Formats

The Materials Project. Materials Data on RbSbMoO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1737961.
The Materials Project. Materials Data on RbSbMoO6 by Materials Project. United States. doi:https://doi.org/10.17188/1737961
The Materials Project. 2020. "Materials Data on RbSbMoO6 by Materials Project". United States. doi:https://doi.org/10.17188/1737961. https://www.osti.gov/servlets/purl/1737961. Pub date:Sat May 09 00:00:00 EDT 2020
@article{osti_1737961,
title = {Materials Data on RbSbMoO6 by Materials Project},
author = {The Materials Project},
abstractNote = {RbMoSbO6 crystallizes in the orthorhombic Ima2 space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.94–3.48 Å. Mo6+ is bonded to six O2- atoms to form distorted MoO6 octahedra that share corners with two equivalent MoO6 octahedra and corners with four equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 35–45°. There are a spread of Mo–O bond distances ranging from 1.78–2.26 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with two equivalent SbO6 octahedra and corners with four equivalent MoO6 octahedra. The corner-sharing octahedra tilt angles range from 35–48°. There is two shorter (1.98 Å) and four longer (2.01 Å) Sb–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to one Rb1+ and two equivalent Mo6+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+ and two equivalent Sb5+ atoms. In the third O2- site, O2- is bonded in a bent 150 degrees geometry to one Rb1+, one Mo6+, and one Sb5+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+, one Mo6+, and one Sb5+ atom.},
doi = {10.17188/1737961},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}