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Paper

Development and application of effective pairwise potentials for UO2n+, NpO2n+, PuO2n+, and AmO2n+ (n = 1, 2) ions with water

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a
Department of Chemical and Biomolecular Engineering, University of Notre Dame, 182 Fitzpatrick Hall, Notre Dame, USA
b
Los Alamos National Laboratory, Los Alamos, USA
c
Department of Chemical and Biomolecular Engineering and Department of Chemistry and Biochemistry, University of Notre Dame, 182 Fitzpatrick Hall, Notre Dame, USA
E-mail: wschneider@nd.edu;
Fax: +1 574 631 8366 ;
Tel: +1 574 631 8754
d
Department of Chemical and Biomolecular Engineering, University of Notre Dame, 182 Fitzpatrick Hall, Notre Dame, USA
E-mail: ed@nd.edu;
Fax: +1 574 631 8366 ;
Tel: +1 574 631 5687
Phys. Chem. Chem. Phys., 2013,15, 15954-15963

DOI: 10.1039/C3CP52444B
Received 13 Jun 2013, Accepted 08 Aug 2013
First published online 09 Aug 2013
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