scholarly journals An electric double layer structure and differential capacitance at the electrode interface of tributylmethylammonium bis(trifluoromethanesulfonyl)amide studied using a molecular dynamics simulation

2020 ◽  
Vol 22 (9) ◽  
pp. 5198-5210 ◽  
Author(s):  
Seiji Katakura ◽  
Naoya Nishi ◽  
Kazuya Kobayashi ◽  
Ken-ichi Amano ◽  
Tetsuo Sakka
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulation ◽  
Quaternary Ammonium ◽  
Electric Double Layer ◽  
Layer Structure ◽  
Differential Capacitance ◽  
Dynamics Simulation ◽  
Double Layer Structure ◽  
Electrode Interface

A molecular dynamics simulation at the electrode interface of a quaternary ammonium ionic liquid, tributylmethylammonium bis(trifluoromethanesulfonyl)amide ([N1444+][TFSA−]), has been performed.

Evaluation of Static Differential Capacitance at the [C4mim+][TFSA−]/Electrode Interface Using Molecular Dynamics Simulation Combined with Electrochemical Surface Plasmon Resonance Measurements

2021 ◽  
Author(s):  
Shiwei Zhang ◽  
Naoya Nishi ◽  
Seiji Katakura ◽  
Tetsuo Sakka
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Surface Plasmon Resonance ◽  
Quantitative Analysis ◽  
Molecular Dynamics Simulation ◽  
Surface Plasmon ◽  
Md Simulations ◽  
Differential Capacitance ◽  
Dynamics Simulation ◽  
Electrode Interface

Molecular dynamic (MD) simulations have been performed for 1-butyl-3-methylimidazolium bis(trifluoromethanesulfonyl)amide ([C4mim+][TFSA−]), an ionic liquid (IL), on a charged graphene electrode to achieve the quantitative analysis of the static differential capacitance...

Effects of repulsive interaction on the electric double layer of an imidazolium-based ionic liquid by molecular dynamics simulation

2015 ◽  
Vol 17 (4) ◽  
pp. 2628-2633 ◽  
Author(s):  
Wenyang Jin ◽  
Xiaohong Liu ◽  
Yining Han ◽  
Shu Li ◽  
Tianying Yan
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulation ◽  
Double Layer ◽  
Electric Double Layer ◽  
Graphite Electrode ◽  
Dynamics Simulation ◽  
Repulsive Interaction

Effects of repulsion between BMIM+/PF6− and the graphite electrode on electric double layer was studied by molecular dynamics simulation.

scholarly journals Surface Structure of Quaternary Ammonium Based Ionic Liquid Studied Using Molecular Dynamics Simulation

2015 ◽  
Vol 64 (3) ◽  
pp. 219-224 ◽  
Author(s):  
Seiji KATAKURA ◽  
Naoya NISHI ◽  
Kazuya KOBAYASHI ◽  
Ken-ichi AMANO ◽  
Tetsuo SAKKA
Keyword(s):  
Molecular Dynamics ◽  
Ionic Liquid ◽  
Molecular Dynamics Simulation ◽  
Surface Structure ◽  
Quaternary Ammonium ◽  
Dynamics Simulation
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