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July 2014 |
Contraction and Coagulation of Spherical Polyelectrolyte Brushes in the Presence of Ag + , Mg 2+ , and Ca 2+ Cations
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September 2016 |
Spherical polyelectrolyte brushes in the presence of multivalent counterions: The effect of fluctuations and correlations as determined by molecular dynamics simulations
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March 2008 |
Molecular dynamics simulations of polyelectrolyte brushes under poor solvent conditions: Origins of bundle formation
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March 2014 |
Morphologies of Planar Polyelectrolyte Brushes in a Poor Solvent: Molecular Dynamics Simulations and Scaling Analysis
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November 2009 |
Solvation Structure and Ion Complexation of La 3+ in a 1 Molal Aqueous Solution of Lanthanum Chloride
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June 2011 |
Competitive calcium ion binding to end-tethered weak polyelectrolytes
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January 2018 |
Overscreening, Co-Ion-Dominated Electroosmosis, and Electric Field Strength Mediated Flow Reversal in Polyelectrolyte Brush Functionalized Nanochannels
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April 2021 |
Cation Bridging Studied by Specular Neutron Reflection
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April 2013 |
Reversible Adhesion with Polyelectrolyte Brushes Tailored via the Uptake and Release of Trivalent Lanthanum Ions
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April 2015 |
Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes
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March 1977 |
Steric Effects Control the Structure of the Solvated Lanthanum(III) Ion in Aqueous, Dimethyl Sulfoxide, and N , N ‘-Dimethylpropyleneurea Solution. An EXAFS and Large-Angle X-ray Scattering Study
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August 2000 |
Fast Parallel Algorithms for Short-Range Molecular Dynamics
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March 1995 |
Multivalent ions induce lateral structural inhomogeneities in polyelectrolyte brushes
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December 2017 |
Ion-Specific Effects of Divalent Ions on the Structure of Polyelectrolyte Brushes
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August 2019 |
Effect of pH and Molecular Length on the Structure and Dynamics of Short Poly(acrylic acid) in Dilute Solution: Detailed Molecular Dynamics Study
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April 2019 |
Potassium, Calcium, and Magnesium Bridging of AOT to Mica at Constant Ionic Strength
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April 2019 |
Molecular-dynamics study of a three-dimensional one-component model for distortive phase transitions
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February 1978 |
Multivalent counterions diminish the lubricity of polyelectrolyte brushes
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June 2018 |
Molecular Dynamics Analysis of Charge Transport in Ionic-Liquid Electrolytes Containing Added Salt with Mono, Di, and Trivalent Metal Cations
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April 2018 |
Morphologies of spherical bidisperse polyelectrolyte brushes in the presence of trivalent counterions
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November 2020 |
A unified formulation of the constant temperature molecular dynamics methods
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July 1984 |
Layer-by-Layer Assembly of Polyelectrolytes into Ionic Current Rectifying Solid-State Nanopores: Insights from Theory and Experiment
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June 2010 |
Structure of Polyelectrolyte Brushes in the Presence of Multivalent Counterions
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July 2016 |
Single Conical Nanopores Displaying pH-Tunable Rectifying Characteristics. Manipulating Ionic Transport With Zwitterionic Polymer Brushes
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February 2009 |
Structure of Polyelectrolyte Brushes on Polarizable Substrates
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April 2020 |
Hydration of the Yttrium(III) Ion in Aqueous Solution. An X-ray Diffraction and XAFS Structural Study
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December 1999 |
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
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January 1996 |
Stimuli-Responsive Colloidal Systems from Mixed Brush-Coated Nanoparticles
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August 2007 |
Molecular Dynamics Simulation of Ion Mobility. 2. Alkali Metal and Halide Ions Using the SPC/E Model for Water at 25 °C †
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January 1996 |
Simulating Monovalent and Divalent Ions in Aqueous Solution Using a Drude Polarizable Force Field
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January 2010 |
Hollow silica–polyelectrolyte composite nanoparticles for controlled drug delivery
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October 2018 |
Rational Design of Particle Mesh Ewald Compatible Lennard-Jones Parameters for +2 Metal Cations in Explicit Solvent
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May 2013 |
An Anionic Surfactant on an Anionic Substrate: Monovalent Cation Binding
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August 2017 |
Towards accurate solvation dynamics of divalent cations in water using the polarizable amoeba force field: From energetics to structure
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August 2006 |
Comparing Solvophobic and Multivalent Induced Collapse in Polyelectrolyte Brushes
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January 2017 |
Effect of counterion excluded volume on the conformational behavior of polyelectrolyte chains
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January 2018 |
Collapse of Spherical Polyelectrolyte Brushes in the Presence of Multivalent Counterions
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October 2006 |
Polymer-coated nanoparticles for enhanced oil recovery
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March 2014 |
Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool
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December 2009 |
Heterogeneous Morphology and Dynamics of Polyelectrolyte Brush Condensates in Trivalent Counterion Solution
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February 2017 |
Lateral Structure Formation in Polyelectrolyte Brushes Induced by Multivalent Ions
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January 2017 |
Densely Grafted Polyelectrolyte Brushes Trigger “Water-in-Salt”-like Scenarios and Ultraconfinement Effect
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June 2020 |
Scaling behavior of polyelectrolytes and polyampholytes: Simulation by an ensemble growth method
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September 1991 |
Effect of Counterion Size on the Structure of a Flexible Polyelectrolyte Chain in Low-Polar Solvents
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November 2018 |
Emerging applications of stimuli-responsive polymer materials
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January 2010 |
Polyelectrolyte brushes: theory, modelling, synthesis and applications
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January 2015 |
Structural parameters of close surroundings of Sr2+ and Ba2+ ions in aqueous solutions of their salts
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February 2011 |
Influence of Ion Solvation on the Properties of Electrolyte Solutions
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April 2018 |
Determination of Alkali and Halide Monovalent Ion Parameters for Use in Explicitly Solvated Biomolecular Simulations
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July 2008 |
Microstructure, dynamics and optical properties of metal-doped imidazolium-based ionic liquids
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November 2020 |
Parameterization of Highly Charged Metal Ions Using the 12-6-4 LJ-Type Nonbonded Model in Explicit Water
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August 2014 |
The missing term in effective pair potentials
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November 1987 |