Monte Carlo, density functional theory, and Poisson–Boltzmann theory study of the structure of an electrolyte near an electrode
about
Ionic asymmetry and solvent excluded volume effects on spherical electric double layers: a density functional approachTesting the applicability of Nernst-Planck theory in ion channels: comparisons with Brownian dynamics simulations.A review of molecular modelling of electric double layer capacitors.Transferable ionic parameters for first-principles Poisson-Boltzmann solvation calculations: Neutral solutes in aqueous monovalent salt solutions.The non-dominance of counterions in charge-asymmetric electrolytes: non-monotonic precedence of electrostatic screening and local inversion of the electric field by multivalent coions.Generalization of the Gouy-Chapman-Stern model of an electric double layer for a morphologically complex electrode: deterministic and stochastic morphologies.Overcharging and charge reversal in the electrical double layer around the point of zero charge.A contact-corrected density functional theory for electrolytes at an interface.Influence of atomistic physics on electro-osmotic flow: an analysis based on density functional theory.Revisiting density functionals for the primitive model of electric double layers.Time-dependent density functional theory for the charging kinetics of electric double layer containing room-temperature ionic liquids.Poisson-Nernst-Planck-Fermi theory for modeling biological ion channels.Where there is a valley, there is a peak: study of ion size and image effects on nanoelectroosmotic pumping.Density-functional theory and Monte Carlo simulation study on the electric double layer around DNA in mixed-size counterion systems.Influence of monovalent ion size on colloidal forces probed by Monte Carlo simulations.Monte Carlo simulation of electrical double-layer formation from mixtures of electrolytes inside nanopores.An algorithm for three-dimensional Monte-Carlo simulation of charge distribution at biofunctionalized surfaces.Relaxation of the electrical double layer after an electron transfer approached by Brownian dynamics simulation.Structures and adsorption of binary hard-core Yukawa mixtures in a slitlike pore: grand canonical Monte Carlo simulation and density-functional study.Density functional study on the structures and thermodynamic properties of small ions around polyanionic DNA.Density-functional theory of spherical electric double layers and zeta potentials of colloidal particles in restricted-primitive-model electrolyte solutions.Testing one component plasma models on colloidal overcharging phenomena.The electrical double layer for a fully asymmetric electrolyte around a spherical colloid: an integral equation study.A systematic comparison of different approaches of density functional theory for the study of electrical double layers.Molecular solvent model of cylindrical electric double layers: a systematic study by Monte Carlo simulations and density functional theory.Monte Carlo simulation of the electric double layer: dielectric boundaries and the effects of induced chargeMonte Carlo and Density Functional Theory Study of the Electrical Double Layer: The Dependence of the Charge/Voltage Relation on the Diameter of the IonsA classical density functional theory for interfacial layering of ionic liquids
P2860
Q33691000-E092448C-B61C-4CA5-98FD-49B3817BBDEBQ33952222-96A6CEC3-D56A-4ABC-8E3A-524E6933BD8EQ38192899-3370A87E-7F82-4F15-8521-6E408F41C7BBQ38846707-869B9637-56F4-4DC8-9483-2841C876F55DQ39584061-6000FFD9-CD86-492D-9F2C-D30B835F01C9Q43913492-CAC8A7BF-AEB9-42E7-81F9-3D041F86EDB6Q45209504-4EF81C08-C7FC-4ED2-8995-CF503C3AFD58Q46169557-7047453A-F004-4C64-8F86-31773A9BC836Q46330257-B2E3DA5B-36E1-47DE-B329-6DFEAC313F3FQ46334267-D0A7E5B0-216D-4865-9338-C27DBC44520BQ46483672-1FCCBBBE-6B0F-466A-BC09-52C329A45B0CQ46800319-6B825F1D-BE63-4F4E-8B31-B457E9E47347Q47234625-43C56EF9-36A3-4162-8BE8-A68898A19A0BQ47354831-891CB78B-AA1B-4636-A73F-EE25A166A648Q47369639-2C2BA63E-FCED-4C63-A339-B29368E3B491Q47937940-D1F5EAFE-4914-4BB2-B137-99684D11A65EQ48155000-1F37567C-B4D6-41C0-B728-54A170CD0779Q48532945-302D5788-D767-4BCE-A58B-2EEF75305463Q51293804-0D03BA7E-6DCD-4DDB-88BC-C4AFF476C5A0Q51628715-31132C77-D98B-4456-849D-F207A821714EQ51642893-87F8FECE-E162-48BD-8773-3B2FA6EB0AF1Q51931057-80A9E906-EA99-4713-9983-A0EF02954121Q51967578-8011C3FE-E7A2-4B2D-A0BA-6A4A89404D88Q53227396-E30BCF61-04C9-476D-8A9A-3E12BA5A9DA5Q53892134-1A91AB61-DD2A-4CE4-A136-761C1201EC1BQ57722015-6793EEA4-ADB6-4D31-8AD7-65CC7AAA3099Q57722034-A2B3922D-108F-4F22-A120-E15969E14FF9Q58445534-BDA9D865-05FC-4714-8F37-FC2083EBD96C
P2860
Monte Carlo, density functional theory, and Poisson–Boltzmann theory study of the structure of an electrolyte near an electrode
description
im April 2002 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована у квітні 2002
@uk
name
Monte Carlo, density functiona ...... electrolyte near an electrode
@en
Monte Carlo, density functiona ...... electrolyte near an electrode
@nl
type
label
Monte Carlo, density functiona ...... electrolyte near an electrode
@en
Monte Carlo, density functiona ...... electrolyte near an electrode
@nl
prefLabel
Monte Carlo, density functiona ...... electrolyte near an electrode
@en
Monte Carlo, density functiona ...... electrolyte near an electrode
@nl
P2093
P2860
P356
P1476
Monte Carlo, density functiona ...... electrolyte near an electrode
@en
P2093
Dezsö Boda
Douglas Henderson
Stefan Sokołowski
W. Ronald Fawcett
P2860
P304
P356
10.1063/1.1464826
P407
P577
2002-04-22T00:00:00Z