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physics.chem-ph2024★ 351 cited
A force field of Li , Na , K, Mg, Ca, Cl, and SO in aqueous solution based on the TIP4P/2005 water model and scaled charges for the ions
I. M. Zeron, J. L. F. Abascal, C. Vega
In this work, a force field for several ions in water is proposed. In particular, we consider the cations Li , Na , K, Mg, Ca and the anions Cl, and S…
physics.chem-ph2024★ 30 cited
In Silico Seawater
I. M. Zeron, M. A. Gonzalez, E. Errani +2
Many important processes affecting the Earth's climate are determined by the physical properties of seawater. Desalination of seawater is a significant source of drinking wate.Sinc…