We have performed extensive molecular dynamic simulations to analyze the influence of
cation and anion natures, and of water concentration, on the structure and dynamics of water …

The structural and dynamic properties of 1-butyl-3-methylimidazolium bromide ([C4mim]
Br)/water mixtures with different molar ratios have been investigated using classical …

Several structural features of aqueous solutions of the ionic liquid 1-ethyl-3-
methylimidazolium ethylsulfate were analyzed in the entire concentration range using …

This paper describes molecular dynamics (MD) simulations of three ionic liquid (IL)/water
mixtures at various water mole fractions: 1-butyl-3-methylimidazolium (BMIM+)/BF4−, 1-octyl …

Molecular dynamics simulations of mixtures of 1, 3-dialkyl imidazolium ionic liquids and
water have been performed in order to investigate the microscopic physical properties as a …

We present an extensive ab initio molecular dynamics study on mixtures of the room
temperature ionic liquid 1-ethyl-3-methylimidazolium acetate with water. To show the …

We have used molecular dynamics simulations to study the properties of three ionic liquid
(IL)–water systems: 1-butyl-3-methylimidazolium chloride ([bmim] Cl), 1-ethyl-3 …

We performed molecular dynamics (MD) simulations of ionic liquid (IL)–water mixtures to
investigate the effects of water addition. The IL cation 1-butyl-3-methylimidazolium ([C4mim]) …

In this work, extensive molecular dynamics simulations of mixtures of alcohols of several
chain lengths (methanol and ethanol) with the ionic liquids (ILs) composed of the cation 1 …

We study the properties of residual water molecules at different mole fractions in
dialkylimidazolium based ionic liquids (ILs), namely 1-ethyl-3-methylimidazolium …