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posted on 2024-08-19, 04:05 authored by Maria Duenas-Herrera, Douwe Bonthuis, Philip Loche, Roland Netz, Laura Scalfi

It contains details on the solvation free energy and activity coefficients calculations, as well as the detailed screenings of Lennard-Jones parameters, and radial distribution functions.

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force field halide and alkali ions electrolyte simulations

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CC BY-NC 4.0

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