Ab initio molecular dynamics studies of hydroxide coordination of alkaline earth metals and uranyl
Author:
Affiliation:
1. Department of Chemistry
2. Faraday Building
3. Lancaster University
4. Lancaster
5. UK
6. National Nuclear Laboratory Limited
7. Warrington
Abstract
Proton dynamics of alkaline earth and uranyl hydroxide solutions are simulated, revealing substantial dependence on ion charge density.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP00142E
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