U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on UF4 by Materials Project
Abstract
UF4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. 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 2.23–2.33 Å. In the second 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 2.25–2.38 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded in a bent 150 degrees geometry to two U4+ atoms. In the second F1- site, F1- is bonded in a distorted linear geometry to two U4+ atoms. In the third F1- site, F1- is bonded in a linear geometry to two equivalent U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted linear geometry to two equivalent U4+ atoms. In the fifth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two U4+ atoms. In the sixth F1- site, F1- is bonded in a distorted linear geometry to two U4+ atoms. In the seventh F1- site, F1- is bonded in a distorted bent 150 degreesmore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-287
- 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; UF4; F-U
- OSTI Identifier:
- 1202769
- DOI:
- https://doi.org/10.17188/1202769
Citation Formats
The Materials Project. Materials Data on UF4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1202769.
The Materials Project. Materials Data on UF4 by Materials Project. United States. doi:https://doi.org/10.17188/1202769
The Materials Project. 2020.
"Materials Data on UF4 by Materials Project". United States. doi:https://doi.org/10.17188/1202769. https://www.osti.gov/servlets/purl/1202769. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1202769,
title = {Materials Data on UF4 by Materials Project},
author = {The Materials Project},
abstractNote = {UF4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. 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 2.23–2.33 Å. In the second 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 2.25–2.38 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded in a bent 150 degrees geometry to two U4+ atoms. In the second F1- site, F1- is bonded in a distorted linear geometry to two U4+ atoms. In the third F1- site, F1- is bonded in a linear geometry to two equivalent U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted linear geometry to two equivalent U4+ atoms. In the fifth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two U4+ atoms. In the sixth F1- site, F1- is bonded in a distorted linear geometry to two U4+ atoms. In the seventh F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two equivalent U4+ atoms.},
doi = {10.17188/1202769},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}