Ionic liquids (ILs) are a special category of molten salts solely composed of ions with varied
molecular symmetry and charge delocalization. The versatility in combining varied cation …

We present the results of an extensive study on a novel approach of modeling ionic liquids
(ILs) and their mixtures with molecular compounds, incorporating perturbed-chain statistical …

We present NeuralIL, a model for the potential energy of an ionic liquid that accurately
reproduces first-principles results with orders-of-magnitude savings in computational cost …

For designing better energy storage devices, the interfacial interaction between ILs and
nanostructure is a prerequisite. In the present study, the interaction of ionic liquids such as …

The structure of solutions of lithium nitrate in a protic ionic liquid with a common anion,
ethylammonium nitrate, at room temperature is investigated by means of molecular …

Because of their outstanding versatility, room-temperature ionic liquids (RTILs) are utilized in
an ever increasing number of novel and fascinating applications, making them the Holy Grail …

Trying to contribute to an overall picture of solvation in ionic liquids, we report a review of the
main recent results in the field of molecular dynamics simulations of structural and dynamic …

In this work, the effect of molecular cosolvents (water, ethanol, and methanol) on the
structure of mixtures of these compounds with a protic ionic liquid (ethylammonium nitrate) is …

Thermodynamic properties of complex systems play an essential role in developing
chemical engineering processes. It remains a challenge to predict the thermodynamic …

Silkworm pupa protein (SPP) that obtained by traditional method usually had a high fat
content, which would impose restrictions on the further use of SPP. Herein, various …