Coupling machine learning and group contribution method to predict density and viscosity of ionic liquid-inorganic solvent-water ternary mixtures

S Ma, Y Lei, Y Chen, X Liu, Y Chen - Chemical Engineering …, 2025 - Taylor & Francis
Accurate prediction of the physical properties of mixed systems is essential for efficient
industrial design and process optimization. This study explores the use of a hybrid approach …

Modeling Study on the Density and Viscosity of Ionic Liquid–Organic Solvent–Water Ternary Mixtures

Y Lei, S Ma, L Du, X Liu, X Wu, X Liang… - Industrial & …, 2024 - ACS Publications
The accurate prediction of physical properties is critical for the successful application of both
conventional and novel chemicals across various industries. This work focuses on predictive …

Combine Machine Learning Algorithms with Group Contribution Method to Model the Density and Viscosity of Ionic Liquid-Ionic Liquid-Water Ternary Mixtures

Y Lei, Y Shu, X Liu, X Wu, Y Chen - Available at SSRN 4966496 - papers.ssrn.com
The vast diversity of ionic liquids (ILs) necessitates accurate predictive models to facilitate
their applications in industry. This study integrates machine learning (ML) algorithms with …

Ionic liquid binary mixtures: Machine learning‐assisted modeling, solvent tailoring, process design, and optimization

Y Chen, S Ma, Y Lei, X Liang, X Liu… - AIChE …, 2024 - Wiley Online Library
This work conducts a comprehensive modeling study on the viscosity, density, heat capacity,
and surface tension of ionic liquid (IL)‐IL binary mixtures by combining the group …

Modeling Study on Heat Capacity, Viscosity, and Density of Ionic Liquid–Organic Solvent–Organic Solvent Ternary Mixtures via Machine Learning

Y Shu, L Du, Y Lei, S Hu, Y Kuang, H Fang, X Liu… - 2024 - udspace.udel.edu
Physicochemical properties of ionic liquids (ILs) are essential in solvent screening and
process design. However, due to their vast diversity, acquiring IL properties through …

Predicting viscosity of ionic liquids-water mixtures by bridging UNIFAC modeling with interpretable machine learning

M Huang, J Deng, G Jia - Journal of Molecular Liquids, 2023 - Elsevier
Predicting the viscosity of ionic liquids (ILs)-water mixtures precisely is considerable for
diversity applications in chemical industries. In this work, interpretable machine learning …

Machine learning-assisted modeling study on the density and heat capacity of ionic liquid-organic solvent binary systems

X Liu, J Gao, Y Chen, Y Fu, Y Lei - Journal of Molecular Liquids, 2023 - Elsevier
Abstract Properties of ionic liquids (ILs) play a crucial role in solvent design, process design,
and process simulation for their various industrial applications. However, ILs come in a wide …

Machine learning models for the density and heat capacity of ionic liquid-water binary mixtures

Y Fu, X Liu, J Gao, Y Lei, Y Chen, X Zhang - Chinese Journal of Chemical …, 2024 - Elsevier
Ionic liquids (ILs), because of the advantages of low volatility, good thermal stability, high
gas solubility and easy recovery, can be regarded as the green substitute for traditional …

[HTML][HTML] Hybrid data-driven and physics-based modeling for viscosity prediction of ionic liquids

J Fan, Z Dai, J Cao, L Mu, X Ji, X Lu - Green Energy & Environment, 2024 - Elsevier
Viscosity is one of the most important fundamental properties of fluids. However, accurate
acquisition of viscosity for ionic liquids (ILs) remains a critical challenge. In this study, an …

[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 …