An OHD-RIKES and simulation study comparing a benzylmethylimidazolium ionic liquid with an equimolar mixture of dimethylimidazolium and benzene

Probing the interplay between electrostatic and dispersion interactions in the solvation of nonpolar nonaromatic solute molecules in ionic liquids: An OKE spectroscopic study of CS2/[CnC1im][NTf2] mixtures (n = 1–4)

(2014) Lianjie Xue et al.   JOURNAL OF CHEMICAL PHYSICS

Local structure and intermolecular dynamics of an equimolar benzene and 1,3-dimethylimidazolium bis[(trifluoromethane)sulfonyl]amide mixture: Molecular dynamics simulations and OKE spectroscopic measurements

(2014) Ruth M. Lynden-Bell et al.   JOURNAL OF CHEMICAL PHYSICS

Distributed Multipoles from a Robust Basis-Space Implementation of the Iterated Stockholder Atoms Procedure

(2014) Alston J. Misquitta et al.   Journal of Chemical Theory and Computation

Effects of Aromaticity in Cations and Their Functional Groups on the Low-Frequency Spectra and Physical Properties of Ionic Liquids

(2014) Hideaki Shirota et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Competitive pi interactions and hydrogen bonding within imidazolium ionic liquids

(2014) Richard P. Matthews et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Comparison of Force Fields on the Basis of Various Model Approaches-How To Design the Best Model for the [CnMIM][NTf2] Family of Ionic Liquids

(2013) Thorsten Köddermann et al.   CHEMPHYSCHEM

Effect of Unsaturation on the Absorption of Ethane and Ethylene in Imidazolium-Based Ionic Liquids

(2013) Leila Moura et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Intermolecular/Interionic Vibrations of 1-Methyl-3-n-octylimidazolium Tetrafluoroborate Ionic Liquid and Benzene Mixtures

(2013) Hideaki Shirota   JOURNAL OF PHYSICAL CHEMISTRY B

Comparison of Low-Frequency Spectra between Aromatic and Nonaromatic Cation Based Ionic Liquids Using Femtosecond Raman-Induced Kerr Effect Spectroscopy

(2012) Hideaki Shirota   CHEMPHYSCHEM

Nanostructural Organization in Acetonitrile/Ionic Liquid Mixtures: Molecular Dynamics Simulations and Optical Kerr Effect Spectroscopy

(2012) Fehmi Bardak et al.   CHEMPHYSCHEM

CL&P: A generic and systematic force field for ionic liquids modeling

(2012) José N. Canongia Lopes et al.   THEORETICAL CHEMISTRY ACCOUNTS

Nanostructural organization in carbon disulfide/ionic liquid mixtures: Molecular dynamics simulations and optical Kerr effect spectroscopy

(2011) Peng Yang et al.   JOURNAL OF CHEMICAL PHYSICS

Microscopic Aspects in Dicationic Ionic Liquids through the Low-Frequency Spectra by Femtosecond Raman-Induced Kerr Effect Spectroscopy

(2011) Hideaki Shirota et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Ultrafast Dynamics in 1-Butyl-3-methylimidazolium-Based Ionic Liquids: A Femtosecond Raman-Induced Kerr Effect Spectroscopic Study

(2011) Hiroki Fukazawa et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Effect of cation symmetry on the low-frequency spectra of imidazolium ionic liquids: OKE and Raman spectroscopic measurements and DFT calculations

(2010) Dong Xiao et al.   CHEMICAL PHYSICS LETTERS

Comparison of interionic/intermolecular vibrational dynamics between ionic liquids and concentrated electrolyte solutions

(2010) Tomotsumi Fujisawa et al.   JOURNAL OF CHEMICAL PHYSICS

Dynamics in an Idealized Ionic Liquid Model

(2010) Durba Roy et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Room Temperature Ionic Liquid−Lithium Salt Mixtures: Optical Kerr Effect Dynamical Measurements

(2010) Bruno G. Nicolau et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Heavy Atom Substitution Effects in Non-Aromatic Ionic Liquids: Ultrafast Dynamics and Physical Properties

(2010) Hideaki Shirota et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Effect of Cation Symmetry and Alkyl Chain Length on the Structure and Intermolecular Dynamics of 1,3-Dialkylimidazolium Bis(trifluoromethanesulfonyl)amide Ionic Liquids

(2009) Dong Xiao et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Intermolecular Vibrational Motions of Solute Molecules Confined in Nonpolar Domains of Ionic Liquids

(2009) Dong Xiao et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Atom Substitution Effects of [XF6]−in Ionic Liquids. 1. Experimental Study

(2009) Hideaki Shirota et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Dynamics of Imidazolium Ionic Liquids from a Combined Dielectric Relaxation and Optical Kerr Effect Study: Evidence for Mesoscopic Aggregation

(2009) David A. Turton et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Redefining the atom: atomic charge densities produced by an iterative stockholder approach

(2008) Timothy C. Lillestolen et al.   CHEMICAL COMMUNICATIONS

Molecular Dynamics Study of the Temperature-Dependent Optical Kerr Effect Spectra and Intermolecular Dynamics of Room Temperature Ionic Liquid 1-Methoxyethylpyridinium Dicyanoamide

(2008) Zhonghan Hu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Nanostructural Organization and Anion Effects in the Optical Kerr Effect Spectra of Binary Ionic Liquid Mixtures

(2008) Dong Xiao et al.   JOURNAL OF PHYSICAL CHEMISTRY B