114 citations · 390 across the 15 of their papers we have counts for
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Viscosity as a Smoking Gun for Complex Formation in Solution: Fe and Mg Chlorides as Examples
Amrita Goswami, Samuel Blazquez, Lucía Fernández-Sedano +4
Electrolyte solutions at high concentration are indispensable and yet poorly understood. In particular, the extent of speciation -- the formation of complexes composed of multiple…
Three phase equilibria of the methane hydrate in NaCl solutions: A simulation study
S. Blazquez, C. Vega, M. M. Conde
Molecular dynamics simulations have been performed to determine the three-phase coexistence temperature for a methane hydrate system in equilibrium with a NaCl solution and a metha…
Computation of Electrical Conductivities of Aqueous Electrolyte Solutions: Two Surfaces , One Property
S. Blazquez, J. L. F. Abascal, J. Lagerweij +5
In this work, we have computed electrical conductivities at ambient conditions of aqueous NaCl and KCl solutions by using the Einstein-Helfand equation. Common force fields (charge…
Melting points of water models: Current situation
Samuel Blazquez, Carlos Vega
By using the direct coexistence method, we have calculated the melting points of ice Ih at normal pressure for three recently proposed water models, namely, TIP3P-FB, TIP4P-FB, and…
The Madrid-2019 force field for electrolytes in water using TIP4P/2005 and scaled charges: extension to the ions F, Br, I, Rb, Cs
Samuel Blazquez, Maria M. Conde, Jose L. F. Abascal +1
In this work, an extension of the Madrid-2019 force field is presented. We have added the cations Rb + and Cs + and the anions F, Br and I. These ions were the remainin…