Ion-specific adsorption and electroosmosis in charged amorphous porous silica

Atomistic Description of Pressure-Driven Flow of Aqueous Salt Solutions through Charged Silica Nanopores

(2015) Neil R. Haria et al.   Journal of Physical Chemistry C

Atomistic Molecular Dynamics Simulations of Carbohydrate–Calcite Interactions in Concentrated Brine

(2015) Hsieh Chen et al.   LANGMUIR

The ion–lipid battle for hydration water and interfacial sites at soft-matter interfaces

(2014) Epameinondas Leontidis et al.   CURRENT OPINION IN COLLOID & INTERFACE SCIENCE

Molecular dynamics simulation of electrokinetic flow of an aqueous electrolyte solution in nanochannels

(2014) Hiroaki Yoshida et al.   JOURNAL OF CHEMICAL PHYSICS

Structure and transport of aqueous electrolytes: From simple halides to radionuclide ions

(2014) Remco Hartkamp et al.   JOURNAL OF CHEMICAL PHYSICS

Enhanced H2 Uptake of n-Alkanes Confined in Mesoporous Materials

(2014) S. Clauzier et al.   Journal of Physical Chemistry C

Structure and Dynamics of an Electrolyte Confined in Charged Nanopores

(2014) Pierre-Andre Cazade et al.   Journal of Physical Chemistry C

Adsorption and Dynamics in Hierarchical Metal–Organic Frameworks

(2014) François Villemot et al.   Journal of Physical Chemistry C

Structure of Water at Charged Interfaces: A Molecular Dynamics Study

(2014) Shalaka Dewan et al.   LANGMUIR

Adsorption, intrusion and freezing in porous silica: the view from the nanoscale

(2013) Benoit Coasne et al.   CHEMICAL SOCIETY REVIEWS

Selective Removal of Cs+, Sr2+, and Ni2+ by K2xMgxSn3–xS6 (x = 0.5–1) (KMS-2) Relevant to Nuclear Waste Remediation

(2013) Joshua L. Mertz et al.   CHEMISTRY OF MATERIALS

Force fields for divalent cations based on single-ion and ion-pair properties

(2013) Shavkat Mamatkulov et al.   JOURNAL OF CHEMICAL PHYSICS

Polarizability effects in molecular dynamics simulations of the graphene-water interface

(2013) Tuan A. Ho et al.   JOURNAL OF CHEMICAL PHYSICS

Nanoconfined Electrolyte Solutions in Porous Hydrophilic Silica Membranes

(2013) R. Renou et al.   Journal of Physical Chemistry C

Gas Uptake in Solvents Confined in Mesopores: Adsorption versus Enhanced Solubility

(2013) Linh Ngoc Ho et al.   Journal of Physical Chemistry Letters

Water self-diffusion at the surface of silica glasses: effect of hydrophilic to hydrophobic transition

(2013) B. Siboulet et al.   MOLECULAR PHYSICS

Electrokinetics: insights from simulation on the microscopic scale

(2013) Benjamin Rotenberg et al.   MOLECULAR PHYSICS

Calculation of local dielectric permittivity of confined liquids from spatial dipolar correlations

(2012) A. Ghoufi et al.   EPL

Solvated calcium ions in charged silica nanopores

(2012) Patrick A. Bonnaud et al.   JOURNAL OF CHEMICAL PHYSICS

A comparison of the value of viscosity for several water models using Poiseuille flow in a nano-channel

(2012) A. P. Markesteijn et al.   JOURNAL OF CHEMICAL PHYSICS

A study of the anisotropy of stress in a fluid confined in a nanochannel

(2012) Remco Hartkamp et al.   JOURNAL OF CHEMICAL PHYSICS

Transport coefficients of the TIP4P-2005 water model

(2012) Dmitri Rozmanov et al.   JOURNAL OF CHEMICAL PHYSICS

A close look into the excluded volume effects within a double layer

(2012) Derek Frydel et al.   JOURNAL OF CHEMICAL PHYSICS

Molecular Simulation of Aqueous Electrolyte Solubility. 3. Alkali-Halide Salts and Their Mixtures in Water and in Hydrochloric Acid

(2012) Filip Moučka et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Atomistic Model of Micelle-Templated Mesoporous Silicas: Structural, Morphological, and Adsorption Properties

(2012) Benoit Coasne et al.   LANGMUIR

Unraveling the Combined Effects of Dielectric and Viscosity Profiles on Surface Capacitance, Electro-Osmotic Mobility, and Electric Surface Conductivity

(2012) Douwe Jan Bonthuis et al.   LANGMUIR

Macroporous LTA-monoliths for in-flow removal of radioactive strontium from aqueous effluents: Application to the case of Fukushima

(2012) Alexander Sachse et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Ion exclusion and electrokinetic effects resulting from electro-osmotic flow of salt solutions in charged silica nanopores

(2012) Neil R. Haria et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Aqueous electrolytes confined within functionalized silica nanopores

(2011) Pablo E. Videla et al.   JOURNAL OF CHEMICAL PHYSICS

Structure and dynamics of water confined in silica nanopores

(2011) Anatoli A. Milischuk et al.   JOURNAL OF CHEMICAL PHYSICS

The water–amorphous silica interface: Analysis of the Stern layer and surface conduction

(2011) Hui Zhang et al.   JOURNAL OF CHEMICAL PHYSICS

Hydrophobic Transition in Porous Amorphous Silica

(2011) Bertrand Siboulet et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Loading-Controlled Stiffening in Nanoconfined Ionic Liquids

(2011) Benoit Coasne et al.   Journal of Physical Chemistry Letters

Interaction of Monovalent Ions with Hydrophobic and Hydrophilic Colloids: Charge Inversion and Ionic Specificity

(2011) Carles Calero et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Simulating water with rigid non-polarizable models: a general perspective

(2011) Carlos Vega et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Dielectric Profile of Interfacial Water and its Effect on Double-Layer Capacitance

(2011) Douwe Jan Bonthuis et al.   PHYSICAL REVIEW LETTERS

Double Layer in Ionic Liquids: Overscreening versus Crowding

(2011) Martin Z. Bazant et al.   PHYSICAL REVIEW LETTERS

Ion-Specific Effects under Confinement: The Role of Interfacial Water

(2010) Dimitrios Argyris et al.   ACS Nano

Electrolytes in a nanometer slab-confinement: Ion-specific structure and solvation forces

(2010) Immanuel Kalcher et al.   JOURNAL OF CHEMICAL PHYSICS

Effects of concentration on structure, dielectric, and dynamic properties of aqueous NaCl solutions using a polarizable model

(2010) J. Sala et al.   JOURNAL OF CHEMICAL PHYSICS

Ion-Specific Excluded-Volume Correlations and Solvation Forces

(2010) Immanuel Kalcher et al.   PHYSICAL REVIEW LETTERS

Nanofluidics, from bulk to interfaces

(2009) Lydéric Bocquet et al.   CHEMICAL SOCIETY REVIEWS

Probing polyamide membrane surface charge, zeta potential, wettability, and hydrophilicity with contact angle measurements

(2009) Gil Hurwitz et al.   JOURNAL OF MEMBRANE SCIENCE

Molecular Dynamics Simulations of the Dynamic and Energetic Properties of Alkali and Halide Ions Using Water-Model-Specific Ion Parameters

(2009) In Suk Joung et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Dynamic Behavior of Interfacial Water at the Silica Surface

(2009) Dimitrios Argyris et al.   Journal of Physical Chemistry C

Ionic Current Rectification through Silica Nanopores

(2009) Eduardo R. Cruz-Chu et al.   Journal of Physical Chemistry C

Hydration Structure on Crystalline Silica Substrates

(2009) Dimitrios Argyris et al.   LANGMUIR

Molecular dynamics simulation of water confined in a nanopore of amorphous silica

(2009) Qingyin Zhang et al.   MOLECULAR SIMULATION

Salt exclusion in charged porous media: a coarse-graining strategy in the case of montmorillonite clays

(2009) Marie Jardat et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular Dynamics of Ionic Transport and Electrokinetic Effects in Realistic Silica Channels

(2008) Christian D. Lorenz et al.   Journal of Physical Chemistry C

Molecular Structure and Dynamics in Thin Water Films at the Silica and Graphite Surfaces

(2008) Dimitrios Argyris et al.   Journal of Physical Chemistry C

Modeling Micelle-Templated Mesoporous Material SBA-15: Atomistic Model and Gas Adsorption Studies

(2008) Supriyo Bhattacharya et al.   LANGMUIR

Transport phenomena in nanofluidics

(2008) Reto B. Schoch et al.   REVIEWS OF MODERN PHYSICS

Aqueous Electrolytes near Hydrophobic Surfaces:  Dynamic Effects of Ion Specificity and Hydrodynamic Slip†

(2007) David M. Huang et al.   LANGMUIR