Electrostatic properties of liquid 1,3-dimethylimidazolium chloride: role of local polarization and effect of the bulk

Towards multiscale modeling of ionic liquids: From electronic structure to bulk properties

(2009) Florian Dommert et al.   JOURNAL OF MOLECULAR LIQUIDS

Modelling room temperature ionic liquids

(2008) B. L. Bhargava et al.   CHEMICAL COMMUNICATIONS

Application of Static Charge Transfer within an Ionic-Liquid Force Field and Its Effect on Structure and Dynamics

(2008) Tristan G. A. Youngs et al.   CHEMPHYSCHEM

Study of 1,3-dimethylimidazolium chloride with electronic structure methods and force field approaches

(2008) Christian Krekeler et al.   JOURNAL OF CHEMICAL PHYSICS

Lone pair versus bonding pair electrons: The mechanism of electronic polarization of water in the presence of positive ions

(2008) Christian Krekeler et al.   JOURNAL OF CHEMICAL PHYSICS

A comparative study of two classical force fields on statics and dynamics of [EMIM][BF4] investigated via molecular dynamics simulations

(2008) Florian Dommert et al.   JOURNAL OF CHEMICAL PHYSICS

Effect of Anions on Static Orientational Correlations, Hydrogen Bonds, and Dynamics in Ionic Liquids:  A Simulational Study

(2008) Baofu Qiao et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Understanding Ionic Liquids at the Molecular Level: Facts, Problems, and Controversies

(2007) Hermann Weingärtner   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION