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Title: Materials Data on Ce(As3Ru)4 by Materials Project

Abstract

CeRu4As12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Ce3+ is bonded to twelve equivalent As+1.67- atoms to form CeAs12 cuboctahedra that share faces with eight equivalent RuAs6 octahedra. All Ce–As bond lengths are 3.25 Å. Ru+4.25+ is bonded to six equivalent As+1.67- atoms to form RuAs6 octahedra that share corners with six equivalent RuAs6 octahedra and faces with two equivalent CeAs12 cuboctahedra. The corner-sharing octahedral tilt angles are 58°. All Ru–As bond lengths are 2.46 Å. As+1.67- is bonded in a 5-coordinate geometry to one Ce3+, two equivalent Ru+4.25+, and two equivalent As+1.67- atoms. There are one shorter (2.58 Å) and one longer (2.63 Å) As–As bond lengths.

Publication Date:
Other Number(s):
mp-1021508
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; Ce(As3Ru)4; As-Ce-Ru
OSTI Identifier:
1351411
DOI:
10.17188/1351411

Citation Formats

The Materials Project. Materials Data on Ce(As3Ru)4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1351411.
The Materials Project. Materials Data on Ce(As3Ru)4 by Materials Project. United States. doi:10.17188/1351411.
The Materials Project. 2020. "Materials Data on Ce(As3Ru)4 by Materials Project". United States. doi:10.17188/1351411. https://www.osti.gov/servlets/purl/1351411. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1351411,
title = {Materials Data on Ce(As3Ru)4 by Materials Project},
author = {The Materials Project},
abstractNote = {CeRu4As12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Ce3+ is bonded to twelve equivalent As+1.67- atoms to form CeAs12 cuboctahedra that share faces with eight equivalent RuAs6 octahedra. All Ce–As bond lengths are 3.25 Å. Ru+4.25+ is bonded to six equivalent As+1.67- atoms to form RuAs6 octahedra that share corners with six equivalent RuAs6 octahedra and faces with two equivalent CeAs12 cuboctahedra. The corner-sharing octahedral tilt angles are 58°. All Ru–As bond lengths are 2.46 Å. As+1.67- is bonded in a 5-coordinate geometry to one Ce3+, two equivalent Ru+4.25+, and two equivalent As+1.67- atoms. There are one shorter (2.58 Å) and one longer (2.63 Å) As–As bond lengths.},
doi = {10.17188/1351411},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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