Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration, and structural properties

Michael Patra, Mikko Karttunen. Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration, and structural properties. Journal of Computational Chemistry, 25(5):678-689, 2004. [doi]

Abstract

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