Examination of the short-range structure of molten salts

ThF4, UF4, and related alkali actinide fluoride systems

Journal Article (2021)
Author(s)

J. A. Ocadiz flores (TU Delft - RST/Reactor Physics and Nuclear Materials)

Aimen E. Gheribi (Polytechnique Montreal)

J. Vlieland (TU Delft - RST/Technici Pool)

D.W. de Haas (TU Delft - RST/Technici Pool)

Kathy Dardenne (Karlsruhe Institut für Technologie)

Jörg Rothe (Karlsruhe Institut für Technologie)

R. J.M. Konings (European Commission Joint Research Centre, TU Delft - RST/Reactor Physics and Nuclear Materials)

A. L. Smith (TU Delft - RST/Reactor Physics and Nuclear Materials)

Research Group
RST/Reactor Physics and Nuclear Materials
Copyright
© 2021 J.A. Ocadiz flores, A. E. Gheribi, J. Vlieland, D.W. de Haas, K. Dardenne, J. Rothe, R. Konings, A.L. Smith
DOI related publication
https://doi.org/10.1039/d1cp00566a
More Info
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Publication Year
2021
Language
English
Copyright
© 2021 J.A. Ocadiz flores, A. E. Gheribi, J. Vlieland, D.W. de Haas, K. Dardenne, J. Rothe, R. Konings, A.L. Smith
Research Group
RST/Reactor Physics and Nuclear Materials
Issue number
18
Volume number
23
Pages (from-to)
11091-11103
Reuse Rights

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Abstract

The short-range structures of LiF-ThF4, NaF-AnF4, KF-AnF4, and Cs-AnF4 (An = Th, U), were probed using in situ high temperature Extended X-ray Absorption Fine Structure (EXAFS) spectroscopy. Signally, the EXAFS spectra of pure molten ThF4 and UF4 were measured for the first time. The data were interpreted with the aid of Molecular Dynamics (MD) and standard fitting of the EXAFS equation. As in related studies, a speciation distribution dominated by [AnFx]4-x (x = 7, 8, 9) coordination complexes was observed. The average coordination number was found to decrease with the increasing size of the alkali cation, and increase with AnF4 content. An average coordination number close to 6, which had not been detected before in melts of alkali actinide fluorides, was seen when CsF was used as solvent. This journal is