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Journal Article (15)
2020
Journal Article
Transformation of CO2 incorporated in adducts of N-heterocyclic carbene into dialkyl carbonates under ambient conditions: An experimental and mechanistic study. Chemical Engineering Journal, 127469 (2020)
Journal Article
8 (23), pp. 8741 - 8751 (2020)
Systematic Screening of Deep Eutectic Solvents as Sustainable Separation Media Exemplified by the CO2 Capture Process. ACS Sustainable Chemistry & Engineering
Journal Article
Evaluation of COSMO-RS for solid-liquid equilibria prediction of binary eutectic solvent systems. Green Energy & Environment (2020)
Journal Article
66 (2), e16821 (2020)
Extending the UNIFAC model for ionic liquid‐solute systems by combining experimental and computational databases. AIChE-Journal
Journal Article
59, pp. 2093 - 2103 (2020)
Toward Rational Functionalization of Ionic Liquids for Enhanced Extractive Desulfurization: Computer-Aided Solvent Design and Molecular Dynamics Simulation. Industrial & Engineering Chemistry Research
Journal Article
248, 117053 (2020)
Multilevel screening of ionic liquid absorbents for simultaneous removal of CO2 and H2S from natural gas. Separation and Purification Technology
Journal Article
339, pp. 113 - 119 (2020)
Ionic liquid [BMIm][HSO4] as dual catalyst-solvent for the esterification of hexanoic acid with n-butanol. Catalysis Today
Journal Article
59, pp. 2005 - 2012 (2020)
Comparative Economic Analysis of Physical, Chemical, and Hybrid Absorption Processes for Carbon Capture. Industrial & Engineering Chemistry Research
Journal Article
27, pp. 35 - 44 (2020)
Computer-aided solvent selection and design for efficient chemical processes. Current Opinion in Chemical Engineering 2019
Journal Article
65 (8), e16625 (2019)
Rational design of double salt ionic liquids as extraction solvents: Separation of thiophene/n‐octane as example. AIChE-Journal
Journal Article
58 (37), pp. 17514 - 17523 (2019)
Carbon Dioxide Solubility in Phosphonium-Based Deep Eutectic Solvents: An Experimental and Molecular Dynamics Study. Industrial and Engineering Chemistry Research
Journal Article
5 (6), pp. 1017 - 1026 (2019)
Big Data Creates New Opportunities for Materials Research: A Review on Methods and Applications of Machine Learning for Materials Design. Engineering
Journal Article
58 (15), pp. 5777 - 5786 (2019)
Optimal Solvent Design for Extractive Distillation Processes: A Multiobjective Optimization-Based Hierarchical Framework. Industrial and Engineering Chemistry Research 2018
Journal Article
64 (3), pp. 1013 - 1025 (2018)
Computer-aided design of ionic liquids as solvents for extractive desulfurization. AIChE-Journal
Journal Article
111, pp. 16 - 26 (2018)
Rigorous design of reaction-separation processes using disjunctive programming models. Computers and Chemical Engineering Conference Paper (1)
2018
Conference Paper
Integrated Process and Ionic Liquid Design by Combining Flowsheet Simulation with Quantum-Chemical Solvent Screening. In: 13th International Symposium on Process Systems Engineering (PSE 2018), pp. 2167 - 2172. 13th International Symposium on Process Systems Engineering (PSE 2018), San Diego, USA, July 01, 2018 - July 05, 2018. (2018)
Talk (3)
2019
Talk
Computer-aided methods for screening and design of ionic liquids for separation processes. 8th International Congress on Ionic Liquids (COIL-8), Beijing, China (2019)
Talk
Computer-aided screening of deep eutectic solvents for separation processes. ILSEPT - 4th International Conference on Ionic Liquids in Separation and Purification Technology, Melia Sitges, Sitges, Spain (2019)
2018
Talk
Integrated Process and Ionic Liquid Design by Combining Flowsheet Simulation with Quantum-Chemical Solvent Screening. PSE 2018 - 13th International Symposium on Process Systems Engineering, San Diego, USA (2018)
Poster (1)
2018
Poster
Systematic method for screening ionic liquids as extraction solvents exemplified by extractive desulfurization process. COSMO-RS Symposium, Cologne, Germany (2018)