Browsing Exact and Earth Sciences by Author "Uematsu, Yuki"
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Consistent description of ion-specificity in bulk and at interfaces by solvent implicit simulations and mean-field theory
Santos, Alexandre Pereira dos; Uematsu, Yuki; Rathert, Alexander; Loche, Philip; Netz, Roland R. (2020) [Journal article]Solvent-implicit Monte Carlo (MC) simulations and mean-field theory are used to predict activity coefficients and excess interfacial tensions for NaF, NaCl, NaI, KF, KCl, and KI solutions in good agreement with experimental ...