Microscopic simulations of electrochemical double-layer capacitors
Electrochemical double-layer capacitors (EDLCs) are devices allowing the storage or
production of electricity. They function through the adsorption of ions from an electrolyte on …
production of electricity. They function through the adsorption of ions from an electrolyte on …
Structure and nanostructure in ionic liquids
Much of chemistry is concerned with the study of reactions and processes in solution, that is,
where liquids are used as solvents. 2, 3 The solvent is the (excess) liquid phase in which …
where liquids are used as solvents. 2, 3 The solvent is the (excess) liquid phase in which …
Ionic liquids at electrified interfaces
MV Fedorov, AA Kornyshev - Chemical reviews, 2014 - ACS Publications
Until recently,“room-temperature”(< 100− 150 C) liquidstate electrochemistry was mostly
electrochemistry of diluted electrolytes 1− 4 where dissolved salt ions were surrounded by a …
electrochemistry of diluted electrolytes 1− 4 where dissolved salt ions were surrounded by a …
Computational insights into materials and interfaces for capacitive energy storage
Supercapacitors such as electric double‐layer capacitors (EDLCs) and pseudocapacitors
are becoming increasingly important in the field of electrical energy storage. Theoretical …
are becoming increasingly important in the field of electrical energy storage. Theoretical …
Highly confined ions store charge more efficiently in supercapacitors
Liquids exhibit specific properties when they are adsorbed in nanoporous structures. This is
particularly true in the context of supercapacitors, for which an anomalous increase in …
particularly true in the context of supercapacitors, for which an anomalous increase in …
A review of molecular modelling of electric double layer capacitors
R Burt, G Birkett, XS Zhao - Physical Chemistry Chemical Physics, 2014 - pubs.rsc.org
Electric double-layer capacitors are a family of electrochemical energy storage devices that
offer a number of advantages, such as high power density and long cyclability. In recent …
offer a number of advantages, such as high power density and long cyclability. In recent …
Molecular simulation of electrode-solution interfaces
Many key industrial processes, from electricity production, conversion, and storage to
electrocatalysis or electrochemistry in general, rely on physical mechanisms occurring at the …
electrocatalysis or electrochemistry in general, rely on physical mechanisms occurring at the …
[HTML][HTML] Evaluation of the constant potential method in simulating electric double-layer capacitors
A major challenge in the molecular simulation of electric double layer capacitors (EDLCs) is
the choice of an appropriate model for the electrode. Typically, in such simulations the …
the choice of an appropriate model for the electrode. Typically, in such simulations the …
The electric double layer has a life of its own
Using molecular dynamics simulations with recently developed importance sampling
methods, we show that the differential capacitance of a model ionic liquid based double …
methods, we show that the differential capacitance of a model ionic liquid based double …
Confinement, desolvation, and electrosorption effects on the diffusion of ions in nanoporous carbon electrodes
Supercapacitors are electrochemical devices which store energy by ion adsorption on the
surface of a porous carbon. They are characterized by high power delivery. The use of …
surface of a porous carbon. They are characterized by high power delivery. The use of …