The diffusion behavior and capacitance of tetraethylammonium/tetrafluoroborate ions in acetonitrile with different molar concentrations: a molecular dynamics study-Reference-Cited by-同舟云学术

The diffusion behavior and capacitance of tetraethylammonium/tetrafluoroborate ions in acetonitrile with different molar concentrations: a molecular dynamics study

Published:2017 Issue:87 Volume:7 Page:55044-55050
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Yang Po-Yu¹²³⁴,Ju Shin-Pon¹²³⁴⁵^ORCID,Hsieh Hua-Sheng¹²³⁴,Lin Jenn-Sen⁶⁷⁸⁴

Affiliation:

1. Department of Mechanical and Electro-Mechanical Engineering

2. National Sun Yat-sen University

3. Kaohsiung 804

4. Taiwan

5. Department of Medicinal and Applied Chemistry

6. Department of Mechanical Engineering

7. National United University

8. Miaoli 360

Abstract

A molecular dynamics (MD) simulation with the optimized potentials for liquid simulations-all atom (OPLS-AA) force field was carried out to investigate the dynamic behaviors of organic electrolyte molecules between a graphite cathode and anode.

Funder

Ministry of Science and Technology, Taiwan

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2017/RA/C7RA09465E

Reference34 articles.

1. Capacitive Energy Storage in Nanostructured Carbon–Electrolyte Systems

2. Simulating Electric Double Layer Capacitance of Mesoporous Electrodes with Cylindrical Pores

3. Graphene Oxide Supercapacitors: A Computer Simulation Study

4. Molecular Dynamic Simulations of Ionic Liquids at Graphite Surface

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