The Influence of Spectator Cations on Solvent Reorganization Energy Is a Short-Range Effect

Consistent description of ion-specificity in bulk and at interfaces by solvent implicit simulations and mean-field theory

(2020) Alexandre P. dos Santos et al.   JOURNAL OF CHEMICAL PHYSICS

Beyond the Hofmeister Series: Ion-Specific Effects on Proteins and Their Biological Functions

(2017) Halil I. Okur et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Local and Global Effects of Dissolved Sodium Chloride on the Structure of Water

(2017) Alex P. Gaiduk et al.   Journal of Physical Chemistry Letters

Relationship between structural order and water-like anomalies in metastable liquid silicon: Ab initio molecular dynamics

(2017) G. Zhao et al.   Scientific Reports

Tetrahedrality and hydrogen bonds in water

(2016) Eszter Székely et al.   JOURNAL OF CHEMICAL PHYSICS

Influence of the alkali metal cations on the activity of Pt(111) towards model electrocatalytic reactions in acidic sulfuric media

(2015) Jakub Tymoczko et al.   CATALYSIS TODAY

Recent Advances in the Theory and Molecular Simulation of Biological Electron Transfer Reactions

(2015) Jochen Blumberger   CHEMICAL REVIEWS

Specific Ion Effects on Particle Aggregation Induced by Monovalent Salts within the Hofmeister Series

(2015) Tamas Oncsik et al.   LANGMUIR

A scaled-ionic-charge simulation model that reproduces enhanced and suppressed water diffusion in aqueous salt solutions

(2014) Z. R. Kann et al.   JOURNAL OF CHEMICAL PHYSICS

How Much Weaker Are the Effects of Cations than Those of Anions? The Effects of K+ and Cs+ on the Molecular Organization of Liquid H2O

(2014) Takeshi Morita et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Kinetics of Reduction of Aqueous Hexaammineruthenium(III) Ion at Pt and Au Microelectrodes: Electrolyte, Temperature, and Pressure Effects

(2013) Vijendran Vijaikanth et al.   INORGANIC CHEMISTRY

Length scales and interfacial potentials in ion hydration

(2013) Yu Shi et al.   JOURNAL OF CHEMICAL PHYSICS

Mechanisms of Acceleration and Retardation of Water Dynamics by Ions

(2013) Guillaume Stirnemann et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Governing Role of Surface Hydration in Ion Specific Adsorption to Silica: An AFM-Based Account of the Hofmeister Universality and Its Reversal

(2013) Jonathan Morag et al.   LANGMUIR

Crystal lattice properties fully determine short-range interaction parameters for alkali and halide ions

(2012) Albert H. Mao et al.   JOURNAL OF CHEMICAL PHYSICS

Activation energy for a model ferrous-ferric half reaction from transition path sampling

(2012) Christof Drechsel-Grau et al.   JOURNAL OF CHEMICAL PHYSICS

The Influence of the Cation on the Oxygen Reduction and Evolution Activities of Oxide Surfaces in Alkaline Electrolyte

(2012) Jin Suntivich et al.   Electrocatalysis

Redox reactions of a RuIII-edta complex with thioamino acids. Kinetic and mechanistic studies

(2011) Debabrata Chatterjee et al.   DALTON TRANSACTIONS

Voltammetry at graphite electrodes: The oxidation of hexacyanoferrate (II) (ferrocyanide) does not exhibit pure outer-sphere electron transfer kinetics and is sensitive to pre-exposure of the electrode to organic solvents

(2011) Linhongjia Xiong et al.   JOURNAL OF ELECTROANALYTICAL CHEMISTRY

Accounting for electronic polarization in non-polarizable force fields

(2011) Igor Leontyev et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ion Specificity in α-Helical Folding Kinetics

(2010) Yann von Hansen et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Ion selectivity from local configurations of ligands in solutions and ion channels

(2009) D. Asthagiri et al.   CHEMICAL PHYSICS LETTERS

Effect of Ions on the Structure of Water: Structure Making and Breaking

(2009) Yizhak Marcus   CHEMICAL REVIEWS

Thermodynamically dominant hydration structures of aqueous ions

(2009) Safir Merchant et al.   JOURNAL OF CHEMICAL PHYSICS

Electronic continuum model for molecular dynamics simulations

(2009) I. V. Leontyev et al.   JOURNAL OF CHEMICAL PHYSICS

The role of non-covalent interactions in electrocatalytic fuel-cell reactions on platinum

(2009) D. Strmcnik et al.   Nature Chemistry

First Principles Study of Alkali−Tyrosine Complexes: Alkali Solvation and Redox Properties

(2008) Francesca Costanzo et al.   Journal of Chemical Theory and Computation

Hofmeister Effects in Colloidal Systems: Influence of the Surface Nature

(2008) Teresa López-León et al.   Journal of Physical Chemistry C