U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on UF6 by Materials Project
Abstract
UF6 is beta Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four uranium hexafluoride molecules. U6+ is bonded in an octahedral geometry to six F1- atoms. There are five shorter (2.02 Å) and one longer (2.03 Å) U–F bond lengths. There are four inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one U6+ atom.
- Publication Date:
- Other Number(s):
- mp-2275
- 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; F-U; UF6; crystal structure
- OSTI Identifier:
- 1198946
- DOI:
- https://doi.org/10.17188/1198946
Citation Formats
Materials Data on UF6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1198946.
Materials Data on UF6 by Materials Project. United States. doi:https://doi.org/10.17188/1198946
2020.
"Materials Data on UF6 by Materials Project". United States. doi:https://doi.org/10.17188/1198946. https://www.osti.gov/servlets/purl/1198946. Pub date:Mon Jul 20 04:00:00 UTC 2020
@article{osti_1198946,
title = {Materials Data on UF6 by Materials Project},
abstractNote = {UF6 is beta Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four uranium hexafluoride molecules. U6+ is bonded in an octahedral geometry to six F1- atoms. There are five shorter (2.02 Å) and one longer (2.03 Å) U–F bond lengths. There are four inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one U6+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one U6+ atom.},
doi = {10.17188/1198946},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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