Zhou T*. Computational design of heterogeneous catalysts and gas separation materials for advanced chemical processing. Frontiers of Chemical Science and Engineering. Accepted on May 10, 2020 (Invited Review Article)  Yang A, Su Y, Teng L, Jin S, Zhou T, Shen W. Investigation of energy-efficient and sustainable reactive/pressure-swing distillation processes to recover tetrahydrofuran and ethanol from the industrial effluent. Separation and Purification Technology 2020, 117210.  Song Z, Hu X, Wu H, Mei M, Linke S, Zhou T, Qi Z, Sundmacher K. Systematic screening of deep eutectic solvents as sustainable separation media exemplified by the CO2 capture process. ACS Sustainable Chemistry & Engineering 2020, 8, 8741−8751.  Zhang X, Song Z, Gani R, Zhou T*. Comparative economic analysis of physical, chemical, and hybrid absorption processes for carbon capture. Industrial & Engineering Chemistry Research 2020, 59, 2005-2012.  Zhou T*, McBride K, Linke S, Song Z, Sundmacher K. Computer-aided solvent selection and design for efficient chemical processes. Current Opinion in Chemical Engineering 2020, 27, 35-44. (Invited paper for Special Issue on Chemical Product Design)  Song Z, Zhou T*, Qi Z, Sundmacher K. Extending the UNIFAC model for ionic liquid-solute systems by combining experimental and computational databases. AIChE Journal 2020, 66, e16821.  Zhang C, Song Z, Jin C, Nijhuis J, Zhou T, Noël T, Gröger H, Sundmacher K, van Hest J, Hessel V. Screening of functional solvent system for automatic aldehyde and ketone separation in aldol reaction: A combined COSMO-RS and experimental approach. Chemical Engineering Journal 2020, 385, 123399.  Song Z, Shi H, Zhang X, Zhou T*. Prediction of CO2 solubility in ionic liquids using machine learning methods. Chemical Engineering Science 2020, 223, 115752. (Cover Paper)  Song Z, Hu X, Zhou Y, Zhou T*, Qi Z, Sundmacher K. Rational design of double salt ionic liquids as extraction solvents: Separation of thiophene/n‐octane as example. AIChE Journal 2019, 65, e16625. (Top-tier Paper)  Zhou T*, Song Z, Sundmacher K. Big data creates new opportunities for materials research: A review on methods and applications of machine learning for materials design. Engineering 2019, 5, 1017-1026. (Cover Paper)  Zhou T*, Song Z, Zhang X, Gani R, Sundmacher K. Optimal solvent design for extractive distillation processes: A multiobjective optimization-based hierarchical framework. Industrial & Engineering Chemistry Research 2019, 58, 5777−5786. (Invited paper for Special Issue on Frameworks for Process Intensification and Modularization)  Zhang X, Zhou T, Zhang L, Fung KY, Ng KM. Food product design: A hybrid machine learning and mechanistic modeling approach. Industrial & Engineering Chemistry Research 2019, 58, 16743−16752.  Song Z, Li X, Chao H, Mo F, Zhou T, Cheng H, Chen L, Qi Z. Computer-aided ionic liquid design for alkane/cycloalkane extractive distillation process. Green Energy & Environment 2019, 4, 154−165.  Zhou T, Jhamb S, Liang X, Sundmacher K, Gani R. Prediction of acid dissociation constants of organic compounds using group contribution methods. Chemical Engineering Science 2018, 183, 95–105.  Song Z, Zhang C, Qi Z*, Zhou T*, Sundmacher K. Computer-aided design of ionic liquids as solvents for extractive desulfurization. AIChE Journal 2018, 64, 1013−1025.  Zhang X, Song Z, Zhou T*. Rigorous design of reaction-separation processes using disjunctive programming models. Computers & Chemical Engineering 2018, 111, 16−26.  Liu X, Zhou T, Zhang X, Zhang S, Liang X, Gani R, Kontogeorgis G. Application of COSMO-RS and UNIFAC for ionic liquids based gas separation. Chemical Engineering Science 2018, 192, 816−828.  Bechtel S, Song Z, Zhou T, Vidakovic-Koch T, Sundmacher K. Integrated process and ionic liquid design by combining flowsheet simulation with quantum-chemical solvent screening. Computer Aided Chemical Engineering 2018, 44, 2167–2172.  Zhou T*, Zhou Y, Sundmacher K. A hybrid stochastic-deterministic optimization approach for integrated solvent and process design. Chemical Engineering Science 2017, 159, 207−216. (Invited paper for Special Issue: iCAMD – Integrating Computer-Aided Molecular Design into Product and Process Design)  Song Z, Zhou T*, Qi Z*, Sundmacher K. Systematic method for screening ionic liquids as extraction solvents exemplified by an extractive desulfurization process. ACS Sustainable Chemistry & Engineering 2017, 5, 3382−3389.  Zhang J, Peng D, Song Z, Zhou T, Cheng H, Chen L, Qi Z. COSMO-descriptor based computer-aided ionic liquid design for separation processes. Part I: Modified group contribution methodology for predicting surface charge density profile of ionic liquids. Chemical Engineering Science 2017, 162, 355−363.  Zhang J, Qin L, Peng D, Zhou T, Cheng H, Chen L, Qi Z. COSMO-descriptor based computer-aided ionic liquid design for separation processes. Part II: Task-specific design for extraction processes. Chemical Engineering Science 2017, 162, 364−374.  Zhou T, Wang J, McBride K, Sundmacher K. Optimal design of solvents for extractive reaction processes. AIChE Journal 2016, 62, 3238−3249. (Invited paper for AIChE Journal Founders Tribute: Roger W. Sargent)  Zhou T, Lyu Z, Qi Z, Sundmacher K. Robust design of optimal solvents for chemical reactions−A combined experimental and computational strategy. Chemical Engineering Science 2015, 137, 613−625.  Song Z, Zhou T, Zhang J, Cheng H, Chen L, Qi Z. Screening of ionic liquids for solvent-sensitive extraction − with deep desulfurization as an example. Chemical Engineering Science 2015, 129, 69−77.  Zhou T, McBride K, Zhang X, Qi Z, Sundmacher K. Integrated solvent and process design exemplified for a Diels-Alder reaction. AIChE Journal 2015, 61, 147−158.  Zhou T, Qi Z, Sundmacher K. Model-based method for the screening of solvents for chemical reactions. Chemical Engineering Science 2014, 115, 177−185. (Invited paper for Special Issue: InPROMPT – Integrated Chemical Processes with Liquid Multiphase Systems)  Lyu Z, Zhou T, Chen L, Ye Y, Sundmacher K, Qi Z. Simulation based ionic liquid screening for benzene-cyclohexane extractive separation. Chemical Engineering Science 2014, 113, 45−53.  Zhou T, Chen L, Ye Y, Chen L, Qi Z, Freund H, Sundmacher K. An overview of mutual solubility of ionic liquids and water predicted by COSMO-RS. Industrial & Engineering Chemistry Research 2012, 51, 6256−6264.  Zhou T, Wang Z, Ye Y, Chen L, Xu J, Qi Z. Deep separation of benzene from cyclohexane by liquid extraction using ionic liquids as the solvent. Industrial & Engineering Chemistry Research 2012, 51, 5559−5564.  Zhou T, Wang Z, Chen L, Ye Y, Qi Z, Freund H, Sundmacher K. Evaluation of the ionic liquids 1-alkyl-3-methylimidazolium hexafluorophosphate as a solvent for the extraction of benzene from cyclohexane: (Liquid + liquid) equilibria. Journal of Chemical Thermodynamics 2012, 48, 145−149.  Chen L, Zhou T, Chen L, Ye Y, Qi Z, Freund H, Sundmacher K. Selective oxidation of cyclohexanol to cyclohexanone in the ionic liquid 1-octyl-3-methylimidazolium chloride. Chemical Communications 2011, 47, 9354−9356.