Molecular dynamics simulations of the structure of the graphene–ionic liquid/alkali salt mixtures interface

Solvation of Lithium Salts in Protic Ionic Liquids: A Molecular Dynamics Study

(2014) Trinidad Méndez-Morales et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Protic ionic liquids as electrolytes for lithium-ion batteries

(2013) S. Menne et al.   ELECTROCHEMISTRY COMMUNICATIONS

MD Simulations of the Formation of Stable Clusters in Mixtures of Alkaline Salts and Imidazolium-Based Ionic Liquids

(2013) Trinidad Méndez-Morales et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Monolayer to Bilayer Structural Transition in Confined Pyrrolidinium-Based Ionic Liquids

(2013) Alexander M. Smith et al.   Journal of Physical Chemistry Letters

Ionic liquids behave as dilute electrolyte solutions

(2013) M. A. Gebbie et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Orientational Ordering of Ionic Liquids near a Charged Mica Surface

(2012) Rajdeep Singh Payal et al.   CHEMPHYSCHEM

Curvature Effect on the Capacitance of Electric Double Layers at Ionic Liquid/Onion-Like Carbon Interfaces

(2012) Guang Feng et al.   Journal of Chemical Theory and Computation

Molecular Dynamics Simulation Study of the Interfacial Structure and Differential Capacitance of Alkylimidazolium Bis(trifluoromethanesulfonyl)imide [Cnmim][TFSI] Ionic Liquids at Graphite Electrodes

(2012) Jenel Vatamanu et al.   Journal of Physical Chemistry C

Nanopatterning of Electrode Surfaces as a Potential Route to Improve the Energy Density of Electric Double-Layer Capacitors: Insight from Molecular Simulations

(2012) Lidan Xing et al.   Journal of Physical Chemistry Letters

Interfacial Structure of Room-Temperature Ionic Liquids at the Solid–Liquid Interface as Probed by Sum Frequency Generation Spectroscopy

(2012) Steven Baldelli   Journal of Physical Chemistry Letters

On the molecular origin of supercapacitance in nanoporous carbon electrodes

(2012) Céline Merlet et al.   NATURE MATERIALS

Probing the neutral graphene–ionic liquid interface: insights from molecular dynamics simulations

(2012) Maxim V. Fedorov et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

New insights into the interface between a single-crystalline metal electrode and an extremely pure ionic liquid: slow interfacial processes and the influence of temperature on interfacial dynamics

(2012) Marcel Drüschler et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Self-assembly in the electrical double layer of ionic liquids

(2011) Susan Perkin et al.   CHEMICAL COMMUNICATIONS

Imidazolium Ionic Liquid Interfaces with Vapor and Graphite: Interfacial Tension and Capacitance from Coarse-Grained Molecular Simulations

(2011) Céline Merlet et al.   Journal of Physical Chemistry C

On the Influence of Surface Topography on the Electric Double Layer Structure and Differential Capacitance of Graphite/Ionic Liquid Interfaces

(2011) Jenel Vatamanu et al.   Journal of Physical Chemistry Letters

Liquid/Solid Interface of Ultrathin Ionic Liquid Films: [C1C1Im][Tf2N] and [C8C1Im][Tf2N] on Au(111)

(2011) T. Cremer et al.   LANGMUIR

Oscillation of Capacitance inside Nanopores

(2011) De-en Jiang et al.   NANO LETTERS

An in situ STM/AFM and impedance spectroscopy study of the extremely pure 1-butyl-1-methylpyrrolidinium tris(pentafluoroethyl)trifluorophosphate/Au(111) interface: potential dependent solvation layers and the herringbone reconstruction

(2011) Rob Atkin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Electrode screening by ionic liquids

(2011) R. M. Lynden-Bell et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Double Layer in Ionic Liquids: Overscreening versus Crowding

(2011) Martin Z. Bazant et al.   PHYSICAL REVIEW LETTERS

The anatomy of the double layer and capacitance in ionic liquids with anisotropic ions: Electrostriction vs. lattice saturation

(2010) N. Georgi et al.   JOURNAL OF ELECTROANALYTICAL CHEMISTRY

Double-Layer Formation of [Bmim][PF6] Ionic Liquid Triggered by Surface Negative Charge

(2010) Maolin Sha et al.   LANGMUIR

Do solvation layers of ionic liquids influence electrochemical reactions?

(2010) Frank Endres et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Double layer in room temperature ionic liquids: influence of temperature and ionic size on the differential capacitance and electrocapillary curves

(2010) Renata Costa et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Differential capacitance of the double layer at the electrode/ionic liquids interface

(2010) Vera Lockett et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Double layer in ionic liquids: The nature of the camel shape of capacitance

(2009) M.V. Fedorov et al.   ELECTROCHEMISTRY COMMUNICATIONS

Layering of [BMIM][sup +]-based ionic liquids at a charged sapphire interface

(2009) Markus Mezger et al.   JOURNAL OF CHEMICAL PHYSICS

Development of OPLS-AA Force Field Parameters for 68 Unique Ionic Liquids

(2009) Somisetti V. Sambasivarao et al.   Journal of Chemical Theory and Computation

Influence of Temperature and Molecular Structure on Ionic Liquid Solvation Layers

(2009) Deborah Wakeham et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Electrical Double Layer Structure in Ionic Liquids: An Understanding of the Unusual Capacitance−Potential Curve at a Nonmetallic Electrode

(2009) Md. Mominul Islam et al.   Journal of Physical Chemistry C

Molecular Dynamic Simulations of Ionic Liquids at Graphite Surface

(2009) Shu Wang et al.   Journal of Physical Chemistry C

Microstructure and Capacitance of the Electrical Double Layers at the Interface of Ionic Liquids and Planar Electrodes

(2009) G. Feng et al.   Journal of Physical Chemistry C

AFM and STM Studies on the Surface Interaction of [BMP]TFSA and [EMIm]TFSA Ionic Liquids with Au(111)

(2009) Rob Atkin et al.   Journal of Physical Chemistry C

Ionic liquids as electrolytes for Li-ion batteries—An overview of electrochemical studies

(2009) Andrzej Lewandowski et al.   JOURNAL OF POWER SOURCES

A molecular dynamics simulation study of LiFePO4/electrolyte interfaces: structure and Li+ transport in carbonate and ionic liquid electrolytes

(2009) Grant D. Smith et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular dynamics simulation of the electrochemical interface between a graphite surface and the ionic liquid [BMIM][PF6]

(2009) Sergey A. Kislenko et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Surface Structure at the Ionic Liquid−Electrified Metal Interface

(2008) Steven Baldelli   ACCOUNTS OF CHEMICAL RESEARCH

Towards understanding the structure and capacitance of electrical double layer in ionic liquids

(2008) Maxim V. Fedorov et al.   ELECTROCHIMICA ACTA

Ordering layers of [bmim][PF6] ionic liquid on graphite surfaces: Molecular dynamics simulation

(2008) Sha Maolin et al.   JOURNAL OF CHEMICAL PHYSICS

Ionic Liquid Near a Charged Wall: Structure and Capacitance of Electrical Double Layer

(2008) Maxim V. Fedorov et al.   JOURNAL OF PHYSICAL CHEMISTRY B

On the application of ionic liquids for rechargeable Li batteries: High voltage systems

(2008) V. Borgel et al.   JOURNAL OF POWER SOURCES

Molecular Layering of Fluorinated Ionic Liquids at a Charged Sapphire (0001) Surface

(2008) M. Mezger et al.   SCIENCE

P-LINCS:  A Parallel Linear Constraint Solver for Molecular Simulation

(2007) Berk Hess   Journal of Chemical Theory and Computation