218 citations · 2.9k across the 44 of their papers we have counts for
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Computer simulations of ionic liquids at electrochemical interfaces
Céline Merlet, Benjamin Rotenberg, Paul Madden +1
Ionic liquids are widely used as electrolytes in electrochemical devices. In this context, many experimental and theoretical approaches have been recently developed for characteriz…
Influence of solvation on the structural and capacitive properties of electrical double layer capacitors
Céline Merlet, Mathieu Salanne, Benjamin Rotenberg +1
We use molecular dynamics simulations to explore the impact of a non-ionic solvent on the structural and capacitive properties of supercapacitors based on an ionic liquid electroly…
Charge fluctuations in nano-scale capacitors
David T. Limmer, Céline Merlet, Mathieu Salanne +4
The fluctuations of the charge on an electrode contain information on the microscopic correlations within the adjacent fluid and their effect on the electronic properties of the in…
From molten salts to room temperature ionic liquids: Simulation studies on chloroaluminate systems
Mathieu Salanne, Leonardo J. A. Siqueira, Ari P. Seitsonen +2
An interaction potential including chloride anion polarization effects, constructed from first-principles calculations, is used to examine the structure and transport properties of…
Structure and dynamics in yttrium-based molten rare earth alkali fluorides
Maximilien Levesque, Vincent Sarou-Kanian, Mathieu Salanne +5
The transport properties of molten LiF-YF3 mixtures have been studied by pulsed field gradient nuclear magnetic resonance spectroscopy, potentiometric experiments, and molecular dy…