U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CeSb3Pd by Materials Project
Abstract
CePdSb3 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce3+ is bonded in a 9-coordinate geometry to nine Sb+1.67- atoms. There are a spread of Ce–Sb bond distances ranging from 3.44–3.62 Å. Pd2+ is bonded in a 5-coordinate geometry to five Sb+1.67- atoms. There are one shorter (2.63 Å) and four longer (2.86 Å) Pd–Sb bond lengths. There are three inequivalent Sb+1.67- sites. In the first Sb+1.67- site, Sb+1.67- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Pd2+ atoms. In the second Sb+1.67- site, Sb+1.67- is bonded in a distorted body-centered cubic geometry to four equivalent Ce3+ and four equivalent Sb+1.67- atoms. All Sb–Sb bond lengths are 2.94 Å. In the third Sb+1.67- site, Sb+1.67- is bonded in a 1-coordinate geometry to one Ce3+, one Pd2+, and four equivalent Sb+1.67- atoms.
- Publication Date:
- Other Number(s):
- mp-1078616
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Ce-Pd-Sb; CeSb3Pd; crystal structure
- OSTI Identifier:
- 1738579
- DOI:
- https://doi.org/10.17188/1738579
Citation Formats
Materials Data on CeSb3Pd by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1738579.
Materials Data on CeSb3Pd by Materials Project. United States. doi:https://doi.org/10.17188/1738579
2020.
"Materials Data on CeSb3Pd by Materials Project". United States. doi:https://doi.org/10.17188/1738579. https://www.osti.gov/servlets/purl/1738579. Pub date:Sat May 02 04:00:00 UTC 2020
@article{osti_1738579,
title = {Materials Data on CeSb3Pd by Materials Project},
abstractNote = {CePdSb3 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce3+ is bonded in a 9-coordinate geometry to nine Sb+1.67- atoms. There are a spread of Ce–Sb bond distances ranging from 3.44–3.62 Å. Pd2+ is bonded in a 5-coordinate geometry to five Sb+1.67- atoms. There are one shorter (2.63 Å) and four longer (2.86 Å) Pd–Sb bond lengths. There are three inequivalent Sb+1.67- sites. In the first Sb+1.67- site, Sb+1.67- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Pd2+ atoms. In the second Sb+1.67- site, Sb+1.67- is bonded in a distorted body-centered cubic geometry to four equivalent Ce3+ and four equivalent Sb+1.67- atoms. All Sb–Sb bond lengths are 2.94 Å. In the third Sb+1.67- site, Sb+1.67- is bonded in a 1-coordinate geometry to one Ce3+, one Pd2+, and four equivalent Sb+1.67- atoms.},
doi = {10.17188/1738579},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}