Journal of Molecular Liquids · 2021 · 40 citations · 51 references
Natural SciencesChemical EngineeringChemistryComputational ChemistryPhysical ChemistrySurface ScienceIon ExchangeMolecular DynamicsReaction DynamicsSolvation ModelingWater ChemistryWater TransportBulk Water EffectsCarbonate Rock WettabilityIon-water InteractionsMineral-water InteractionsMolecular Simulation AlgorithmsWater-solute InteractionsWettability Alteration Modeling
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Molecular dynamics with coupling to an external bath
Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 31K citations · Full text
Natural Sciences, Chemistry, Physics +17