Evaluating the hazardous impact of ionic liquids–challenges and opportunities

S Magina, A Barros-Timmons, SPM Ventura… - Journal of Hazardous …, 2021 - Elsevier
Ionic liquids (ILs), being related to the design of new environmentally friendly solvents, are
widely considered for applications within the “green chemistry” concept. Due to their unique …

Computer-aided molecular design of ionic liquids as advanced process media: a review from fundamentals to applications

Z Song, J Chen, J Cheng, G Chen, Z Qi - Chemical Reviews, 2023 - ACS Publications
The unique physicochemical properties, flexible structural tunability, and giant chemical
space of ionic liquids (ILs) provide them a great opportunity to match different target …

[HTML][HTML] Machine learning for the prediction of viscosity of ionic liquid–water mixtures

Y Chen, B Peng, GM Kontogeorgis, X Liang - Journal of Molecular Liquids, 2022 - Elsevier
In this work, a nonlinear model that integrates the group contribution (GC) method with a
well-known machine learning algorithm, ie, artificial neural network (ANN), is proposed to …

Viscosity prediction of ionic liquids using NLR and SVM approaches

AD Boualem, K Argoub, AM Benkouider… - Journal of Molecular …, 2022 - Elsevier
Using the molecular functional group, two alternative models for predicting the dynamic
viscosity of ionic liquids (ILs) as function of temperature are presented. The group …

Machine learning assisted structure-based models for predicting electrical conductivity of ionic liquids

R Nakhaei-Kohani, SA Madani, SP Mousavi… - Journal of Molecular …, 2022 - Elsevier
Ionic liquids (ILs) have attracted a great deal of attention as vital compounds that are widely
used in various industries, such as the chemical and petroleum industries. Therefore …

Developing machine learning models for ionic conductivity of imidazolium-based ionic liquids

P Dhakal, JK Shah - Fluid Phase Equilibria, 2021 - Elsevier
In this study, we developed two machine learning models:-support vector machine (SVM)
and artificial neural network (ANN)-to correlate ionic conductivity of pure ionic liquids based …

[HTML][HTML] Modelling study on phase equilibria behavior of ionic liquid-based aqueous biphasic systems

Y Chen, X Liang, JM Woodley… - Chemical Engineering …, 2022 - Elsevier
The ability to predict the phase equilibria behavior is of crucial relevance in the early design
stage of biphasic liquid-liquid systems. Ionic liquid-based aqueous biphasic systems (IL …

Predictive modeling of physicochemical properties and ionicity of ionic liquids for virtual screening of novel electrolytes

DM Makarov, YA Fadeeva, LE Shmukler - Journal of Molecular Liquids, 2023 - Elsevier
In this paper, we present three regression models developed for predicting electrical
conductivity, viscosity, and density of ionic liquids. Combining these machine learning …

A review of group contribution models to calculate thermodynamic properties of ionic liquids for process systems engineering

V Villazón-León, A Bonilla-Petriciolet… - … Research and Design, 2022 - Elsevier
Ionic liquids are compounds with interesting physical and chemical properties that can be
applied to a wide variety of processes. The knowledge of their thermodynamic properties is …

Nonlinear dynamics of ionic liquid enhanced soft composite membrane under electro-mechanical loading

Z Ni, Y Fan, Z Hang, J Yang, C Feng, J Yang - Composite Structures, 2023 - Elsevier
The incorporation of ionic liquids (ILs) into dielectric elastomer composites has attracted
significant interest due to their potential applications in soft actuators and optical devices …