标题
Constant potential simulations on a mesh
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 155, Issue 10, Pages 104104
出版商
AIP Publishing
发表日期
2021-09-08
DOI
10.1063/5.0063381
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- Computational Amperometry of Nanoscale Capacitors in Molecular Simulations
- (2021) Thomas Dufils et al. Journal of Physical Chemistry Letters
- Dielectric Properties of Nanoconfined Water: A Canonical Thermopotentiostat Approach
- (2021) F. Deißenbeck et al. PHYSICAL REVIEW LETTERS
- Ion Structure Transition Enhances Charging Dynamics in Subnanometer Pores
- (2020) Tangming Mo et al. ACS Nano
- Constant Potential, Electrochemically Active Boundary Conditions for Electrochemical Simulation
- (2019) Kaitlyn A. Dwelle et al. Journal of Physical Chemistry C
- Simulating Electrochemical Systems by Combining the Finite Field Method with a Constant Potential Electrode
- (2019) Thomas Dufils et al. PHYSICAL REVIEW LETTERS
- First-Principles Approach to Model Electrochemical Reactions: Understanding the Fundamental Mechanisms behind Mg Corrosion
- (2018) Sudarsan Surendralal et al. PHYSICAL REVIEW LETTERS
- Synergistic interfacial effects of ionic liquids as sizing agents and surface modified carbon fibers
- (2018) Daniel J. Eyckens et al. Journal of Materials Chemistry A
- Ramifications of Water-in-Salt Interfacial Structure at Charged Electrodes for Electrolyte Electrochemical Stability
- (2017) Jenel Vatamanu et al. Journal of Physical Chemistry Letters
- Relationship between pore size and reversible and irreversible immobilization of ionic liquid electrolytes in porous carbon under applied electric potential
- (2016) Shannon M. Mahurin et al. APPLIED PHYSICS LETTERS
- Concentration Fluctuations and Capacitive Response in Dense Ionic Solutions
- (2016) Betul Uralcan et al. Journal of Physical Chemistry Letters
- Water in Ionic Liquids at Electrified Interfaces: The Anatomy of Electrosorption
- (2014) Guang Feng et al. ACS Nano
- Communication: On the origin of the surface term in the Ewald formula
- (2014) V. Ballenegger JOURNAL OF CHEMICAL PHYSICS
- Evaluation of the constant potential method in simulating electric double-layer capacitors
- (2014) Zhenxing Wang et al. JOURNAL OF CHEMICAL PHYSICS
- Infinite Boundary Terms of Ewald Sums and Pairwise Interactions for Electrostatics in Bulk and at Interfaces
- (2014) Zhonghan Hu Journal of Chemical Theory and Computation
- The Electric Double Layer Has a Life of Its Own
- (2014) Céline Merlet et al. Journal of Physical Chemistry C
- Charge Fluctuations in Nanoscale Capacitors
- (2013) David T. Limmer et al. PHYSICAL REVIEW LETTERS
- Hydration of metal surfaces can be dynamically heterogeneous and hydrophobic
- (2013) David T. Limmer et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- How to Convert SPME to P3M: Influence Functions and Error Estimates
- (2012) V. Ballenegger et al. Journal of Chemical Theory and Computation
- A Computationally Efficient Treatment of Polarizable Electrochemical Cells Held at a Constant Potential
- (2012) Matt K. Petersen et al. Journal of Physical Chemistry C
- New Coarse-Grained Models of Imidazolium Ionic Liquids for Bulk and Interfacial Molecular Simulations
- (2012) Céline Merlet et al. Journal of Physical Chemistry C
- Simulating Supercapacitors: Can We Model Electrodes As Constant Charge Surfaces?
- (2012) Céline Merlet et al. Journal of Physical Chemistry Letters
- On the molecular origin of supercapacitance in nanoporous carbon electrodes
- (2012) Céline Merlet et al. NATURE MATERIALS
- Molecular Simulations of the Electric Double Layer Structure, Differential Capacitance, and Charging Kinetics forN-Methyl-N-propylpyrrolidinium Bis(fluorosulfonyl)imide at Graphite Electrodes
- (2011) Jenel Vatamanu et al. JOURNAL OF PHYSICAL CHEMISTRY B
- On the Ewald summation of Gaussian charges for the simulation of metallic surfaces
- (2010) Todd R. Gingrich et al. CHEMICAL PHYSICS LETTERS
- Molecular dynamics simulations of atomically flat and nanoporous electrodes with a molten salt electrolyte
- (2009) Jenel Vatamanu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Electrochemical charge transfer at a metallic electrode: A simulation study
- (2008) Stewart K. Reed et al. JOURNAL OF CHEMICAL PHYSICS
Become a Peeref-certified reviewer
The Peeref Institute provides free reviewer training that teaches the core competencies of the academic peer review process.
Get StartedAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started