Experimental and Theoretical X-ray Absorption Near Edge Structure Study of UO<sub><i>x</i></sub> Systems at the U L<sub>3</sub> Edge
Uranium forms a large number of oxides and its electronic state in them is of great fundamental interest. We employ X-ray absorption spectroscopy at the U L<sub>3</sub> edge to differentiate between mixed oxide phases in uranium compounds. By combining experimental XANES spectra with theoretical modeling using the FEFF code, we analyze five uranium oxides: UO<sub>2</sub>, U<sub>4</sub>O<sub>9</sub>, U<sub>3</sub>O<sub>8</sub>, UO<sub>3</sub>, and U<sub>3</sub>O<sub>7</sub>. Our study reveals how variations in spectral features correspond to changes in oxidation states, local structure, and electronic information. These findings demonstrate a study that consolidates and systematically compares the entire series UO<sub><i>x</i></sub>, providing analysis of changes in electronic structure as a function of oxidation state and local structure which is important for nuclear materials research.
Authors
- Tatiana Poliakova (ORCID: https://orcid.org/0000-0001-7435-8732)
- Petr Igorevich Matveev (ORCID: https://orcid.org/0000-0002-0560-3906)
- Daniil Andreevich Novichkov (ORCID: https://orcid.org/0000-0002-8246-5244)
- Stepan Nikolaevich Kalmykov (ORCID: https://orcid.org/0000-0002-2396-4561)
- A. A. Smirnova (ORCID: https://orcid.org/0000-0002-2056-7878)
- А. А. Аверин (ORCID: https://orcid.org/0000-0003-2895-8539)
- Iurii M. Nevolin (ORCID: https://orcid.org/0000-0001-7008-4586)
Institutions
- Lomonosov Moscow State University (RU)
- Frumkin Institute of Physical Chemistry and Electrochemistry Russian Academy of Sciences (RU)
Publication Details
- Journal
- The Journal of Physical Chemistry A
- Published
- 2024-12-04
- DOI
- https://doi.org/10.1021/acs.jpca.4c05814
- Citations
- 4
- Primary Topic
- Nuclear Materials and Properties
- Type
- article
- Field-Weighted Citation Impact
- 0.47
Funders
- Russian Science Foundation