U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NaU2F9 by Materials Project
Abstract
NaU2F9 crystallizes in the monoclinic Cc space group. The structure is three-dimensional. Na1+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Na–F bond distances ranging from 2.34–2.44 Å. There are two inequivalent U4+ sites. In the first 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 2.26–2.43 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 2.25–2.41 Å. There are nine inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two U4+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms. In the third F1- site, F1- is bonded in a distorted trigonal planar geometry to one Na1+ and two U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms. In the fifth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ andmore »
- Publication Date:
- Other Number(s):
- mp-1220937
- 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-Na-U; NaU2F9; crystal structure
- OSTI Identifier:
- 1683934
- DOI:
- https://doi.org/10.17188/1683934
Citation Formats
Materials Data on NaU2F9 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1683934.
Materials Data on NaU2F9 by Materials Project. United States. doi:https://doi.org/10.17188/1683934
2020.
"Materials Data on NaU2F9 by Materials Project". United States. doi:https://doi.org/10.17188/1683934. https://www.osti.gov/servlets/purl/1683934. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1683934,
title = {Materials Data on NaU2F9 by Materials Project},
abstractNote = {NaU2F9 crystallizes in the monoclinic Cc space group. The structure is three-dimensional. Na1+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Na–F bond distances ranging from 2.34–2.44 Å. There are two inequivalent U4+ sites. In the first 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 2.26–2.43 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 2.25–2.41 Å. There are nine inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two U4+ atoms. In the second F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms. In the third F1- site, F1- is bonded in a distorted trigonal planar geometry to one Na1+ and two U4+ atoms. In the fourth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms. In the fifth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms. In the sixth F1- site, F1- is bonded in a bent 150 degrees geometry to two equivalent 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 3-coordinate geometry to one Na1+ and two U4+ atoms. In the ninth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Na1+ and two U4+ atoms.},
doi = {10.17188/1683934},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}