Molecular dynamics simulations of pyrrolidinium and imidazolium ionic liquids at graphene interfaces

Molecular dynamics simulation of the structure and interfacial free energy barriers of mixtures of ionic liquids and divalent salts near a graphene wall

(2017) Víctor Gómez-González et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Computational Insights into Materials and Interfaces for Capacitive Energy Storage

(2017) Cheng Zhan et al.   Advanced Science

A comparative AFM study of the interfacial nanostructure in imidazolium or pyrrolidinium ionic liquid electrolytes for zinc electrochemical systems

(2016) Srđan Begić et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular origin of high free energy barriers for alkali metal ion transfer through ionic liquid–graphene electrode interfaces

(2016) Vladislav Ivaništšev et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular Response of 1-Butyl-3-Methylimidazolium Dicyanamide Ionic Liquid at the Graphene Electrode Interface Investigated by Sum Frequency Generation Spectroscopy and Molecular Dynamics Simulations

(2015) Siyun Xu et al.   Journal of Physical Chemistry C

Thickness-dependent structural arrangement in nano-confined imidazolium-based ionic liquid films

(2015) Michael Rouha et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ionic Liquids at Electrified Interfaces

(2014) Maxim V. Fedorov et al.   CHEMICAL REVIEWS

Influence of Zn2+ and Water on the Transport Properties of a Pyrrolidinium Dicyanamide Ionic Liquid

(2014) T. J. Simons et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The Electric Double Layer Has a Life of Its Own

(2014) Céline Merlet et al.   Journal of Physical Chemistry C

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

(2014) Trinidad Méndez-Morales et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interactions and structure of ionic liquids on graphene and carbon nanotubes surfaces

(2014) Alfonso S. Pensado et al.   RSC Advances

Zn Electrochemistry in 1-Ethyl-3-Methylimidazolium andN-Butyl-N-Methylpyrrolidinium Dicyanamides: Promising New Rechargeable Zn Battery Electrolytes

(2014) Tristan J. Simons et al.   ChemElectroChem

Thermophysical Properties of the Pure Ionic Liquid 1-Butyl-1-methylpyrrolidinium Dicyanamide and Its Binary Mixtures with Alcohols

(2013) Emilio J. González et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Facet Recognition and Molecular Ordering of Ionic Liquids on Metal Surfaces

(2013) Kshitij C. Jha et al.   Journal of Physical Chemistry C

Electrochemical, Transport, and Spectroscopic Properties of 1-Ethyl-3-methylimidazolium Ionic Liquid Electrolytes Containing Zinc Dicyanamide

(2013) T. J. Simons et al.   Journal of Physical Chemistry C

Adsorbed and near surface structure of ionic liquids at a solid interface

(2013) Juan José Segura et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effect of dissolved LiCl on the ionic liquid–Au(111) electrical double layer structure

(2012) Robert Hayes et al.   CHEMICAL COMMUNICATIONS

High current density, efficient cycling of Zn2+ in 1-ethyl-3-methylimidazolium dicyanamide ionic liquid: The effect of Zn2+ salt and water concentration

(2012) T.J. Simons et al.   ELECTROCHEMISTRY COMMUNICATIONS

Experimental densities, dynamic viscosities and surface tensions of the ionic liquids series 1-ethyl-3-methylimidazolium acetate and dicyanamide and their binary and ternary mixtures with water and ethanol at T=(298.15 to 343.15K)

(2012) E. Quijada-Maldonado et al.   JOURNAL OF CHEMICAL THERMODYNAMICS

Simulating Supercapacitors: Can We Model Electrodes As Constant Charge Surfaces?

(2012) Céline Merlet et al.   Journal of Physical Chemistry Letters

Sum frequency generation study on the orientation of room-temperature ionic liquid at the graphene–ionic liquid interface

(2011) Steven Baldelli et al.   CHEMICAL PHYSICS LETTERS

The interface ionic liquid(s)/electrode(s): In situSTM and AFM measurements

(2011) Frank Endres et al.   FARADAY DISCUSSIONS

Temperature Dependence of the Surface Tension and Density at 0.1 MPa for 1-Ethyl- and 1-Butyl-3-methylimidazolium Dicyanamide

(2011) Jaroslav Klomfar et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

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

Electrical Double-Layer Capacitance in Room Temperature Ionic Liquids: Ion-Size and Specific Adsorption Effects

(2010) Y. Lauw et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular Insights into the Potential and Temperature Dependences of the Differential Capacitance of a Room-Temperature Ionic Liquid at Graphite Electrodes

(2010) Jenel Vatamanu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

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

(2010) Maolin Sha et al.   LANGMUIR

Influence of temperature on the structure and dynamics of the [BMIM][PF6] ionic liquid/graphite interface

(2010) Sergey A. Kislenko et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Amphiphilicity determines nanostructure in protic ionic liquids

(2010) Robert Hayes et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effect of Water on the Viscosities and Densities of 1-Butyl-3-methylimidazolium Dicyanamide and 1-Butyl-3-methylimidazolium Tricyanomethane at Atmospheric Pressure†

(2009) Pedro J. Carvalho et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

PACKMOL: A package for building initial configurations for molecular dynamics simulations

(2009) L. Martínez et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Drastic Phase Transition in Ionic Liquid [Dmim][Cl] Confined Between Graphite Walls: New Phase Formation

(2009) Maolin Sha 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

Measurement of the quantum capacitance of graphene

(2009) Jilin Xia et al.   Nature Nanotechnology

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

Molecular dynamics simulations of atomically flat and nanoporous electrodes with a molten salt electrolyte

(2009) Jenel Vatamanu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Surface Structure at the Ionic Liquid−Electrified Metal Interface

(2008) Steven Baldelli   ACCOUNTS OF CHEMICAL RESEARCH

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

A Multiscale Coarse-Graining Study of the Liquid/Vacuum Interface of Room-Temperature Ionic Liquids with Alkyl Substituents of Different Lengths

(2008) Wei Jiang et al.   Journal of Physical Chemistry C

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

(2008) M. Mezger et al.   SCIENCE

Dicyanamide anion based ionic liquids for electrodeposition of metals

(2007) Ming-Jay Deng et al.   ELECTROCHEMISTRY COMMUNICATIONS