DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Sr3SmRhO6 by Materials Project

Abstract

Sr3SmRhO6 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are a spread of Sr–O bond distances ranging from 2.56–2.78 Å. Sm3+ is bonded to six equivalent O2- atoms to form distorted SmO6 pentagonal pyramids that share faces with two equivalent RhO6 octahedra. All Sm–O bond lengths are 2.35 Å. Rh3+ is bonded to six equivalent O2- atoms to form RhO6 octahedra that share faces with two equivalent SmO6 pentagonal pyramids. All Rh–O bond lengths are 2.12 Å. O2- is bonded to four equivalent Sr2+, one Sm3+, and one Rh3+ atom to form a mixture of distorted corner, edge, and face-sharing OSr4SmRh octahedra. The corner-sharing octahedra tilt angles range from 0–65°.

Authors:
Publication Date:
Other Number(s):
mp-17829
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; Sr3SmRhO6; O-Rh-Sm-Sr
OSTI Identifier:
1192717
DOI:
https://doi.org/10.17188/1192717

Citation Formats

The Materials Project. Materials Data on Sr3SmRhO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192717.
The Materials Project. Materials Data on Sr3SmRhO6 by Materials Project. United States. doi:https://doi.org/10.17188/1192717
The Materials Project. 2020. "Materials Data on Sr3SmRhO6 by Materials Project". United States. doi:https://doi.org/10.17188/1192717. https://www.osti.gov/servlets/purl/1192717. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1192717,
title = {Materials Data on Sr3SmRhO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr3SmRhO6 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. There are a spread of Sr–O bond distances ranging from 2.56–2.78 Å. Sm3+ is bonded to six equivalent O2- atoms to form distorted SmO6 pentagonal pyramids that share faces with two equivalent RhO6 octahedra. All Sm–O bond lengths are 2.35 Å. Rh3+ is bonded to six equivalent O2- atoms to form RhO6 octahedra that share faces with two equivalent SmO6 pentagonal pyramids. All Rh–O bond lengths are 2.12 Å. O2- is bonded to four equivalent Sr2+, one Sm3+, and one Rh3+ atom to form a mixture of distorted corner, edge, and face-sharing OSr4SmRh octahedra. The corner-sharing octahedra tilt angles range from 0–65°.},
doi = {10.17188/1192717},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}