U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on PrSi2Ru by Materials Project
Abstract
PrRuSi2 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Pr3+ is bonded in a 9-coordinate geometry to nine Si4- atoms. There are a spread of Pr–Si bond distances ranging from 3.03–3.31 Å. Ru5+ is bonded in a 5-coordinate geometry to five Si4- atoms. There are a spread of Ru–Si bond distances ranging from 2.38–2.45 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to three equivalent Pr3+, four equivalent Ru5+, and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.57 Å. In the second Si4- site, Si4- is bonded in a 1-coordinate geometry to six equivalent Pr3+, one Ru5+, and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.53 Å.
- Publication Date:
- Other Number(s):
- mp-31083
- 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; Pr-Ru-Si; PrSi2Ru; crystal structure
- OSTI Identifier:
- 1205410
- DOI:
- https://doi.org/10.17188/1205410
Citation Formats
Materials Data on PrSi2Ru by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1205410.
Materials Data on PrSi2Ru by Materials Project. United States. doi:https://doi.org/10.17188/1205410
2020.
"Materials Data on PrSi2Ru by Materials Project". United States. doi:https://doi.org/10.17188/1205410. https://www.osti.gov/servlets/purl/1205410. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1205410,
title = {Materials Data on PrSi2Ru by Materials Project},
abstractNote = {PrRuSi2 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Pr3+ is bonded in a 9-coordinate geometry to nine Si4- atoms. There are a spread of Pr–Si bond distances ranging from 3.03–3.31 Å. Ru5+ is bonded in a 5-coordinate geometry to five Si4- atoms. There are a spread of Ru–Si bond distances ranging from 2.38–2.45 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to three equivalent Pr3+, four equivalent Ru5+, and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.57 Å. In the second Si4- site, Si4- is bonded in a 1-coordinate geometry to six equivalent Pr3+, one Ru5+, and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.53 Å.},
doi = {10.17188/1205410},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}