A Combined Quantum Chemical Statistical Mechanical Simulation of the Hydration of Li+, Na+, F-, and Cl-
Author:
Affiliation:
1. Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, S-221 00 Lund, Sweden
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp049303w
Reference51 articles.
1. Structure and dynamics of hydrated ions
2. Equation of State Calculations by Fast Computing Machines
3. A combined quantum mechanical and molecular mechanical potential for molecular dynamics simulations
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