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Inner shell definition and absolute hydration free energy of K+(aq) on the basis of quasi-chemical theory and ab initio molecular dynamics

Corresponding authors
Sandia National Laboratories, Albuquerque, USA
Theoretical Division, Los Alamos National Laboratory, Los Alamos, USA
E-mail: lrp@lanl.gov
Phys. Chem. Chem. Phys., 2004,6, 1966-1969

DOI: 10.1039/B313756B
Received 30 Oct 2003, Accepted 08 Dec 2003
First published online 12 Jan 2004
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