Generalized Gradient Approximation Made Simple
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October 1996 |
Surface Propensities of Atmospherically Relevant Ions in Salt Solutions Revealed by Phase-Sensitive Sum Frequency Vibrational Spectroscopy
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July 2011 |
Effect of Field Direction on Electrowetting in a Nanopore
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March 2007 |
Rectification of Ionic Current in a Nanofluidic Diode
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March 2007 |
Structure in aqueous solutions of nonpolar solutes from the standpoint of scaled-particle theory
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January 1973 |
In Situ Nanopore Fabrication and Single-Molecule Sensing with Microscale Liquid Contacts
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April 2017 |
On the Nature of ions at the Liquid Water Surface
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May 2006 |
Intrusion and extrusion of water in hydrophobic mesopores
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March 2004 |
Electron Spectroscopy of Aqueous Solution Interfaces Reveals Surface Enhancement of Halides
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January 2005 |
Modulation of hydrophobic interactions by proximally immobilized ions
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January 2015 |
Specific ion effects in aqueous eletrolyte solutions confined within graphene sheets at the nanometric scale
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January 2012 |
A hydrophobic gate in an ion channel: the closed state of the nicotinic acetylcholine receptor
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June 2006 |
Architecture of Qbox: A scalable first-principles molecular dynamics code
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January 2008 |
Hydration Behavior under Confinement by Nanoscale Surfaces with Patterned Hydrophobicity and Hydrophilicity
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December 2006 |
Hydration properties of mechanosensitive channel pores define the energetics of gating
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October 2010 |
Continuous assembly of supramolecular polyamine–phosphate networks on surfaces: preparation and permeability properties of nanofilms
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January 2019 |
Comparison of bipolar and unipolar ionic diodes
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June 2010 |
Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes
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March 1977 |
Nanopore Fabrication by Controlled Dielectric Breakdown
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March 2014 |
Computational Study of Ion Binding to the Liquid Interface of Water †
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October 2002 |
Fast Parallel Algorithms for Short-Range Molecular Dynamics
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March 1995 |
Fluctuations of Water near Extended Hydrophobic and Hydrophilic Surfaces
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February 2010 |
Voltage-Gated Hydrophobic Nanopores
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August 2011 |
Vibrational Spectroscopy of Aqueous Sodium Halide Solutions and Air−Liquid Interfaces: Observation of Increased Interfacial Depth
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February 2004 |
Ion-Specific Anomalous Electrokinetic Effects in Hydrophobic Nanochannels
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April 2007 |
Study of Penetration of Water into Hydrophobized Porous Silicas
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March 1997 |
Transport phenomena in nanofluidics
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July 2008 |
Salt Solutions in Carbon Nanotubes: The Role of Cation−π Interactions
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March 2016 |
Towards an assessment of the accuracy of density functional theory for first principles simulations of water. II
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September 2004 |
Molecular Structure of Salt Solutions: A New View of the Interface with Implications for Heterogeneous Atmospheric Chemistry
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November 2001 |
Perfluoroalkanes: Conformational Analysis and Liquid-State Properties from ab Initio and Monte Carlo Calculations
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April 2001 |
Nanofluidic Ionic Diodes. Comparison of Analytical and Numerical Solutions
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July 2008 |
Intrusion and extrusion of water in hydrophobic nanopores
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November 2017 |
A unified formulation of the constant temperature molecular dynamics methods
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July 1984 |
Anisotropic structure and dynamics of water under static electric fields
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February 2019 |
The molecular structure of the interface between water and a hydrophobic substrate is liquid-vapor like
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November 2014 |
Concentration-Polarization-Induced Precipitation and Ionic Current Oscillations with Tunable Frequency
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January 2018 |
Water Dynamics and Dewetting Transitions in the Small Mechanosensitive Channel MscS
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May 2004 |
Ions at the Air/Water Interface
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June 2002 |
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
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January 1996 |
Electric-field-induced wetting and dewetting in single hydrophobic nanopores
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October 2011 |
Hydrophobic Gating in Ion Channels
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January 2015 |
Water Confinement in Hydrophobic Nanopores. Pressure-Induced Wetting and Drying
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August 2010 |
Charge Inversion and Calcium Gating in Mixtures of Ions in Nanopores
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January 2020 |
Propensity of soft ions for the air/water interface
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August 2004 |
Voltage Gating of a Biomimetic Nanopore: Electrowetting of a Hydrophobic Barrier
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February 2017 |
Molecular dynamics with coupling to an external bath
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October 1984 |
Liquid-vapor oscillations of water in hydrophobic nanopores
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May 2003 |
Mechanism of ion adsorption to aqueous interfaces: Graphene/water vs. air/water
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August 2017 |
Interfaces and the driving force of hydrophobic assembly
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September 2005 |
Solvent fluctuations in hydrophobic cavity–ligand binding kinetics
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January 2013 |
Probing the Interfacial Structure of Aqueous Electrolytes with Femtosecond Second Harmonic Generation Spectroscopy
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July 2006 |
Introducing Chemical Transport Selectivity into Gold Nanotubule Membranes
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July 1998 |
Presence of electrolyte promotes wetting and hydrophobic gating in nanopores with residual surface charges
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January 2015 |
Towards an assessment of the accuracy of density functional theory for first principles simulations of water
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January 2004 |
Surface topography dependence of biomolecular hydrophobic hydration
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April 1998 |
Canonical dynamics: Equilibrium phase-space distributions
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March 1985 |
Deconstructing Classical Water Models at Interfaces and in Bulk
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August 2011 |
Giant Osmotic Pressure in the Forced Wetting of Hydrophobic Nanopores
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July 2015 |
Access resistance of a small circular pore
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October 1975 |
Electric-field-controlled water and ion permeation of a hydrophobic nanopore
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June 2005 |
Voltage-dependent ordering of water molecules at an electrode–electrolyte interface
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March 1994 |
Optimization algorithm for the generation of ONCV pseudopotentials
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November 2015 |
Ions at Hydrophobic Aqueous Interfaces: Molecular Dynamics with Effective Polarization
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July 2012 |
The Hydrophobic Effect Contributes to the Closed State of a Simplified Ion Channel through a Conserved Hydrophobic Patch at the Pore-Helix Crossing
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November 2015 |
Molecular Mechanism of Ion Binding to the Liquid/Vapor Interface of Water
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January 2002 |
Biosensing with Nanofluidic Diodes
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June 2009 |
Sitting at the Edge: How Biomolecules use Hydrophobicity to Tune Their Interactions and Function
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February 2012 |
Ion spatial distributions at the liquid–vapor interface of aqueous potassium fluoride solutions
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January 2008 |
Engineered voltage-responsive nanopores
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January 2010 |
Structure and dynamics of aqueous solutions from PBE-based first-principles molecular dynamics simulations
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October 2016 |