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 …
The carbon-water interface: modeling challenges and opportunities for the water-energy nexus
Providing clean water and sufficient affordable energy to all without compromising the
environment is a key priority in the scientific community. Many recent studies have focused …
environment is a key priority in the scientific community. Many recent studies have focused …
Self-operating transpiration-driven electrokinetic power generator with an artificial hydrological cycle
Autonomous energy scavenging from the ambient environment, or self-energy management,
has attracted increasing attention because it could solve the energy problem of abundant …
has attracted increasing attention because it could solve the energy problem of abundant …
Molecular dynamics simulations of the electric double layer capacitance of graphene electrodes in mono-valent aqueous electrolytes
Electrical double layer (EDL) capacitors based on recently emergent graphene materials
have shown several folds performance improvement compared to conventional porous …
have shown several folds performance improvement compared to conventional porous …
Blue energy and desalination with nanoporous carbon electrodes: Capacitance from molecular simulations to continuous models
Capacitive mixing (CapMix) and capacitive deionization (CDI) are currently developed as
alternatives to membrane-based processes to harvest blue energy—from salinity gradients …
alternatives to membrane-based processes to harvest blue energy—from salinity gradients …
Temperature dependence of ion diffusion coefficients in NaCl electrolyte confined within graphene nanochannels
The behavior of ion diffusion in nano-confined spaces and its temperature dependence
provide important fundamental information about electric double-layer capacitors (EDLCs) …
provide important fundamental information about electric double-layer capacitors (EDLCs) …
Facile and sustainable synthesis of slit-like microporous N-doped carbon with unexpected electrosorption performance
Carbon materials with high surface area (> 1000 m 2 g− 1) and porosity have been long
pursued in capacitive deionization, but most of them normally suffer from relatively low …
pursued in capacitive deionization, but most of them normally suffer from relatively low …
Molecular origin of electric double-layer capacitance at multilayer graphene edges
Multilayer graphenes have been widely used as active materials for electric double-layer
capacitors (EDLCs), where their numerous edges are demonstrated to play a crucial role in …
capacitors (EDLCs), where their numerous edges are demonstrated to play a crucial role in …
Molecular dynamics simulation of the graphene–water interface: comparing water models
In this work, different water models (ie SPC/E, TIP3P, TIP4P/2005, TIP5P, SPC/Fw,
TIP4P/2005f and SWM4_DP) are implemented to simulate water on neutral, negatively …
TIP4P/2005f and SWM4_DP) are implemented to simulate water on neutral, negatively …
Kinetic-dominated charging mechanism within representative aqueous electrolyte-based electric double-layer capacitors
The chemical nature of electrolytes has been demonstrated to play a pivotal role in the
charge storage of electric double-layer capacitors (EDLCs), whereas primary mechanisms …
charge storage of electric double-layer capacitors (EDLCs), whereas primary mechanisms …