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Title: Materials Data on Sr4Ru6ClO18 by Materials Project

Abstract

Sr4Ru6ClO18 crystallizes in the cubic I23 space group. The structure is three-dimensional. Sr2+ is bonded in a 10-coordinate geometry to nine O2- and one Cl1- atom. There are a spread of Sr–O bond distances ranging from 2.55–3.03 Å. The Sr–Cl bond length is 3.03 Å. Ru+4.83+ is bonded to six O2- atoms to form a mixture of edge and corner-sharing RuO6 octahedra. The corner-sharing octahedral tilt angles are 56°. There are a spread of Ru–O bond distances ranging from 1.93–2.00 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a water-like geometry to two equivalent Sr2+ and two equivalent Ru+4.83+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Sr2+ and two equivalent Ru+4.83+ atoms. Cl1- is bonded in a tetrahedral geometry to four equivalent Sr2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1193929
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; Sr4Ru6ClO18; Cl-O-Ru-Sr
OSTI Identifier:
1672650
DOI:
https://doi.org/10.17188/1672650

Citation Formats

The Materials Project. Materials Data on Sr4Ru6ClO18 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1672650.
The Materials Project. Materials Data on Sr4Ru6ClO18 by Materials Project. United States. doi:https://doi.org/10.17188/1672650
The Materials Project. 2020. "Materials Data on Sr4Ru6ClO18 by Materials Project". United States. doi:https://doi.org/10.17188/1672650. https://www.osti.gov/servlets/purl/1672650. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1672650,
title = {Materials Data on Sr4Ru6ClO18 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr4Ru6ClO18 crystallizes in the cubic I23 space group. The structure is three-dimensional. Sr2+ is bonded in a 10-coordinate geometry to nine O2- and one Cl1- atom. There are a spread of Sr–O bond distances ranging from 2.55–3.03 Å. The Sr–Cl bond length is 3.03 Å. Ru+4.83+ is bonded to six O2- atoms to form a mixture of edge and corner-sharing RuO6 octahedra. The corner-sharing octahedral tilt angles are 56°. There are a spread of Ru–O bond distances ranging from 1.93–2.00 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a water-like geometry to two equivalent Sr2+ and two equivalent Ru+4.83+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Sr2+ and two equivalent Ru+4.83+ atoms. Cl1- is bonded in a tetrahedral geometry to four equivalent Sr2+ atoms.},
doi = {10.17188/1672650},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}