A nonlocal density functional theory of electric double layer: Symmetric electrolytes

Chandra N. Patra; Swapan K. Ghosh

doi:10.1063/1.467186

A nonlocal density functional theory of electric double layer: Symmetric electrolytes

The Journal of Chemical Physics ◽

10.1063/1.467186 ◽

1994 ◽

Vol 100 (7) ◽

pp. 5219-5229 ◽

Cited By ~ 46

Author(s):

Chandra N. Patra ◽

Swapan K. Ghosh

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Functional Theory

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Structure and capacitance of an electric double layer of an asymmetric valency dimer electrolyte: A comparison of the density functional theory with Monte Carlo simulations

Journal of Molecular Liquids ◽

10.1016/j.molliq.2016.08.051 ◽

2017 ◽

Vol 228 ◽

pp. 236-242 ◽

Cited By ~ 9

Author(s):

Douglas Henderson ◽

Whasington Silvestre-Alcantara ◽

Monika Kaja ◽

Stanisław Lamperski ◽

Jianzhong Wu ◽

...

Keyword(s):

Density Functional Theory ◽

Monte Carlo ◽

Monte Carlo Simulations ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Functional Theory ◽

The Density Functional Theory

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The electric double layer at a rutile TiO2water interface modelled using density functional theory based molecular dynamics simulation

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/26/24/244108 ◽

2014 ◽

Vol 26 (24) ◽

pp. 244108 ◽

Cited By ~ 39

Author(s):

J Cheng ◽

M Sprik

Keyword(s):

Molecular Dynamics ◽

Density Functional Theory ◽

Molecular Dynamics Simulation ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Dynamics Simulation ◽

Functional Theory

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Classical density functional theory and Monte Carlo simulation study of electric double layer in the vicinity of a cylindrical electrode

Journal of Statistical Mechanics Theory and Experiment ◽

10.1088/1742-5468/aa79af ◽

2017 ◽

Vol 2017 (7) ◽

pp. 073207 ◽

Cited By ~ 13

Author(s):

Shiqi Zhou ◽

Stanisław Lamperski ◽

Marta Sokołowska

Keyword(s):

Density Functional Theory ◽

Monte Carlo Simulation ◽

Monte Carlo ◽

Double Layer ◽

Simulation Study ◽

Electric Double Layer ◽

Density Functional ◽

Cylindrical Electrode ◽

Monte Carlo Simulation Study ◽

Functional Theory

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Comparison of the modified Poisson–Boltzmann theory with recent density functional theory and simulation results in the planar electric double layer

Physical Chemistry Chemical Physics ◽

10.1039/b316098j ◽

2004 ◽

Vol 6 (13) ◽

pp. 3467-3473 ◽

Cited By ~ 59

Author(s):

L. Bari Bhuiyan ◽

Christopher W. Outhwaite

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Functional Theory ◽

Poisson Boltzmann ◽

Simulation Results

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A nonlocal density‐functional theory of electric double layer: Charge‐asymmetric electrolytes

The Journal of Chemical Physics ◽

10.1063/1.467464 ◽

1994 ◽

Vol 101 (5) ◽

pp. 4143-4149 ◽

Cited By ~ 28

Author(s):

Chandra N. Patra ◽

Swapan K. Ghosh

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Layer Charge ◽

Functional Theory

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On the contact values of the density profiles in an electric double layer using density functional theory

Condensed Matter Physics ◽

10.5488/cmp.15.23801 ◽

2012 ◽

Vol 15 (2) ◽

pp. 23801 ◽

Cited By ~ 4

Author(s):

Bhuiyan ◽

Henderson ◽

Sokołowski

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Density Profiles ◽

Functional Theory

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Curvature dependence of the camel-bell curve transition on the capacitance curve of spherical electric double-layer in porous electrodes: Density Functional Theory

Electrochimica Acta ◽

10.1016/j.electacta.2019.05.038 ◽

2019 ◽

Vol 313 ◽

pp. 303-310 ◽

Cited By ~ 1

Author(s):

Ezat Keshavarzi ◽

Mahsa Abareghi ◽

Abbas Helmi

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Porous Electrodes ◽

Functional Theory ◽

Bell Curve ◽

Capacitance Curve ◽

Curvature Dependence

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Density-functional theory and Monte Carlo simulation study on the electric double layer around DNA in mixed-size counterion systems

The Journal of Chemical Physics ◽

10.1063/1.2137710 ◽

2005 ◽

Vol 123 (23) ◽

pp. 234904 ◽

Cited By ~ 27

Author(s):

Ke Wang ◽

Yang-Xin Yu ◽

Guang-Hua Gao ◽

Guang-Sheng Luo

Keyword(s):

Density Functional Theory ◽

Monte Carlo Simulation ◽

Monte Carlo ◽

Double Layer ◽

Simulation Study ◽

Electric Double Layer ◽

Density Functional ◽

Monte Carlo Simulation Study ◽

Functional Theory

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Properties of a planar electric double layer under extreme conditions investigated by classical density functional theory and Monte Carlo simulations

The Journal of Chemical Physics ◽

10.1063/1.4892415 ◽

2014 ◽

Vol 141 (6) ◽

pp. 064701 ◽

Cited By ~ 16

Author(s):

Shiqi Zhou ◽

Stanisław Lamperski ◽

Maria Zydorczak

Keyword(s):

Density Functional Theory ◽

Monte Carlo ◽

Monte Carlo Simulations ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Extreme Conditions ◽

Functional Theory

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The weighted correlation approach for density functional theory: a study on the structure of the electric double layer

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/23/17/175002 ◽

2011 ◽

Vol 23 (17) ◽

pp. 175002 ◽

Cited By ~ 22

Author(s):

Zhao Wang ◽

Longcheng Liu ◽

Ivars Neretnieks

Keyword(s):

Density Functional Theory ◽

Double Layer ◽

Electric Double Layer ◽

Density Functional ◽

Functional Theory ◽

Weighted Correlation

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