U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CeSi3Ru by Materials Project
Abstract
CeRuSi3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to five equivalent Ru and twelve Si atoms. There are four shorter (3.37 Å) and one longer (3.40 Å) Ce–Ru bond lengths. There are a spread of Ce–Si bond distances ranging from 3.05–3.41 Å. Ru is bonded in a 5-coordinate geometry to five equivalent Ce and five Si atoms. There are one shorter (2.34 Å) and four longer (2.36 Å) Ru–Si bond lengths. There are two inequivalent Si sites. In the first Si site, Si is bonded in a distorted bent 120 degrees geometry to four equivalent Ce, two equivalent Ru, and two equivalent Si atoms. Both Si–Si bond lengths are 2.61 Å. In the second Si site, Si is bonded in a 1-coordinate geometry to four equivalent Ce, one Ru, and four equivalent Si atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-13120
- 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; CeSi3Ru; Ce-Ru-Si
- OSTI Identifier:
- 1189395
- DOI:
- https://doi.org/10.17188/1189395
Citation Formats
The Materials Project. Materials Data on CeSi3Ru by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1189395.
The Materials Project. Materials Data on CeSi3Ru by Materials Project. United States. doi:https://doi.org/10.17188/1189395
The Materials Project. 2020.
"Materials Data on CeSi3Ru by Materials Project". United States. doi:https://doi.org/10.17188/1189395. https://www.osti.gov/servlets/purl/1189395. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1189395,
title = {Materials Data on CeSi3Ru by Materials Project},
author = {The Materials Project},
abstractNote = {CeRuSi3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to five equivalent Ru and twelve Si atoms. There are four shorter (3.37 Å) and one longer (3.40 Å) Ce–Ru bond lengths. There are a spread of Ce–Si bond distances ranging from 3.05–3.41 Å. Ru is bonded in a 5-coordinate geometry to five equivalent Ce and five Si atoms. There are one shorter (2.34 Å) and four longer (2.36 Å) Ru–Si bond lengths. There are two inequivalent Si sites. In the first Si site, Si is bonded in a distorted bent 120 degrees geometry to four equivalent Ce, two equivalent Ru, and two equivalent Si atoms. Both Si–Si bond lengths are 2.61 Å. In the second Si site, Si is bonded in a 1-coordinate geometry to four equivalent Ce, one Ru, and four equivalent Si atoms.},
doi = {10.17188/1189395},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 16 00:00:00 EDT 2020},
month = {Thu Jul 16 00:00:00 EDT 2020}
}