Coordination and Hydrolysis of Plutonium Ions in Aqueous Solution Using Car–Parrinello Molecular Dynamics Free Energy Simulations
Author:
Affiliation:
1. Environmental and Molecular Science Laboratory, Pacific Northwest National Laboratory, Richland, Washington 99352, United States
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp4096248
Reference99 articles.
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2. bClark, D. L.; Hecker, S. S.; Jarvinen, G. D.; Neu, M. P.The Chemistry of the Actinide and Transactinide Elements,3rd ed.Springer:Dordrecht, The Netherlands, 2006; Vol.2.10, p815.
3. cRunde, W. H.www.fas.org/sgp/othergov/doe/lanl/pubs/00818040.pdf.
4. Solution coordination chemistry of actinides: Thermodynamics, structure and reaction mechanisms
5. Actinide Carbonte Complexes and Their Importance in Actinide Environmental Chemistry
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