U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsU2F9 by Materials Project
Abstract
CsU2F9 crystallizes in the monoclinic Cc space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Cs–F bond distances ranging from 2.99–3.13 Å. There are two inequivalent U4+ sites. In the first U4+ site, U4+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of U–F bond distances ranging from 2.23–2.45 Å. In the second U4+ site, U4+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of U–F bond distances ranging from 2.10–2.47 Å. There are nine inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and two U4+ atoms. In the second F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and two U4+ atoms. In the third F1- site, F1- is bonded in a distorted trigonal planar geometry to one Cs1+ and two U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Cs1+ and two U4+ atoms. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and twomore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1225971
- 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; CsU2F9; Cs-F-U
- OSTI Identifier:
- 1665691
- DOI:
- https://doi.org/10.17188/1665691
Citation Formats
The Materials Project. Materials Data on CsU2F9 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1665691.
The Materials Project. Materials Data on CsU2F9 by Materials Project. United States. doi:https://doi.org/10.17188/1665691
The Materials Project. 2020.
"Materials Data on CsU2F9 by Materials Project". United States. doi:https://doi.org/10.17188/1665691. https://www.osti.gov/servlets/purl/1665691. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1665691,
title = {Materials Data on CsU2F9 by Materials Project},
author = {The Materials Project},
abstractNote = {CsU2F9 crystallizes in the monoclinic Cc space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Cs–F bond distances ranging from 2.99–3.13 Å. There are two inequivalent U4+ sites. In the first U4+ site, U4+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of U–F bond distances ranging from 2.23–2.45 Å. In the second U4+ site, U4+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of U–F bond distances ranging from 2.10–2.47 Å. There are nine inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and two U4+ atoms. In the second F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and two U4+ atoms. In the third F1- site, F1- is bonded in a distorted trigonal planar geometry to one Cs1+ and two U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Cs1+ and two U4+ atoms. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to one Cs1+ and two U4+ atoms. In the sixth F1- site, F1- is bonded in a 1-coordinate geometry to one Cs1+ and two U4+ atoms. In the seventh F1- site, F1- is bonded in a bent 150 degrees geometry to two equivalent U4+ atoms. In the eighth F1- site, F1- is bonded in a bent 150 degrees geometry to two equivalent U4+ atoms. In the ninth F1- site, F1- is bonded in a single-bond geometry to one U4+ atom.},
doi = {10.17188/1665691},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 15 00:00:00 EDT 2020},
month = {Wed Jul 15 00:00:00 EDT 2020}
}