Publications PSE group
Journal Article (524)
2025
Journal Article
365, 124946 (2025)
Catalyst Dissolution in Pem Water Electrolysis: Influence of Time, Current Density and Iridium Ion Transport in Single-Pass and Recirculation Water Flow Modes. Applied Catalysis B: Environment and Energy
Journal Article
64, pp. 520 - 534 (2025)
Enhancing Reactive Microemulsion Processes: Dynamic Optimization and Cyclic Semibatch Operation for the Reductive Amination of Undecanal in a Mini-Plant. Industrial & Engineering Chemistry Research
Journal Article
10 (1), 5 (2025)
Recycling of Bulk Polyamide 6 by Dissolution- Precipitation in CaCl2-EtOH-H2O Mixtures. Recycling
Journal Article
18 (6), e202401877 (2025)
Xylose Acetals ‐ a New Class of Sustainable Solvents and Their Application in Enzymatic Polycondensation. ChemSusChem
Journal Article
354 (Part 8), 129462 (2025)
Systematic solvent selection enables the fractionation of wet microalgal biomass. Separation and Purification Technology
Journal Article
193, 108917 (2025)
Digital Twins in Process Engineering: An Overview on Computational and Numerical Methods. Computers and Chemical Engineering
Journal Article
356 (Part A), 129796 (2025)
Integrating machine learning model and computer-aided molecular design toward rational ionic liquid selection for separating fluorinated refrigerants. Separation and Purification Technology
Journal Article
301, 120675 (2025)
Process-driven solvent screening for efficient extractive distillation using interpolative rational functions. Chemical Engineering Science 2024
Journal Article
96, pp. 1718 - 1725 (2024)
Core‐Shell Catalyst Pellets for CO2Methanation in a Pilot‐Scale Fixed‐Bed Reactor. Chemie Ingenieur Technik
Journal Article
298, 120423 (2024)
Assessing the future impact of 12 direct air capture technologies. Chemical Engineering Science
Journal Article
495, 153524 (2024)
Machine learning-supported solvent design for lignin-first biorefineries and lignin upgrading. Chemical Engineering Journal
Journal Article
470, 143279 (2024)
Framework conditions for the transformation toward a sustainable carbon-based chemical industry – A critical review of existing and potential contributions from the social sciences. Journal of Cleaner Production
Journal Article
25 (2), pp. 778 - 791 (2024)
Protein-Rich Rafts in Hybrid Polymer/Lipid Giant Unilamellar Vesicles. Biomacromolecules
Journal Article
184, 108643 (2024)
Challenges in data-based reactor modeling: A critical analysis of purely data-driven and hybrid models for a CSTR case study. Computers & Chemical Engineering
Journal Article
96 (12), pp. 1620 - 1631 (2024)
Crystallization‐Based Separation of ε‐Caprolactam from a Depolymerization Reaction Mixture – Fundamentals and Potential Separation Strategies. Chemie Ingenieur Technik
Journal Article
27, 110254 (2024)
Assessment of frequency response techniques in diagnosing polymer electrolyte membrane fuel cells. iScience
Journal Article
44, pp. 123 - 150 (2024)
Optimal design of a sector-coupled renewable methanol production amid political goals and expected conflicts: Costs vs. land use. Sustainable Production and Consumption
Journal Article
307, 118325 (2024)
Identifying standard and simple designs of Power-to-Methanol processes: The costs of complexity reduction. Energy Conversion and Management
Journal Article
29 (10), 2324 (2024)
Rational Design of Enzymatic Electrodes: Impact of Carbon Nanomaterial Types on the Electrode Performance. Molecules
Journal Article
96, pp. 1683 - 1696 (2024)
CFD Analysis of the Flow in Schwarz‐D TPMS Structures for Engineering Applications. Chemie Ingenieur Technik
Journal Article
63, pp. 7902 - 7914 (2024)
Improving the Accuracy of Activity Coefficient Estimation in Specialty Chemistry Using Local Estimators. Industrial & Engineering Chemistry Research
Journal Article
2 (11), pp. 3320 - 3333 (2024)
Tuning acid extraction of magnesium and calcium from platinum group metal tailings for CO2conversion and storage. RSC Sustainability
Journal Article
70 (11), e18544 (2024)
Multiscale screening of metal‐organic frameworks for one‐step ethylene purification in pressure‐swing adsorption processes. AIChE Journal
Journal Article
63 (17), pp. 7556 - 7564 (2024)
Core–Shell Catalyst Pellets for Reaction Heat Release Control in Fixed-Bed Reactors. Industrial & Engineering Chemistry Research 2023
Journal Article
69 (10), e18185 (2023)
A scalable and integrated machine learning framework for molecular properties prediction. AIChE Journal
Journal Article
2, pp. 591 - 601 (2023)
Generalizing property prediction of ionic liquids from limited labeled data: a one-stop framework empowered by transfer learning. Digital Discovery
Journal Article
35 (6), 063321 (2023)
Direct numerical simulations of polypropylene gasification in supercritical water. Physics of Fluids
Journal Article
170, 064504 (2023)
Insights into the Path-Dependent Charge of Iridium Dissolution Products and Stability of Electrocatalytic Water Splitting. Journal of The Electrochemical Society
Journal Article
559, 232582 (2023)
Transient hydrogen crossover in dynamically operated PEM water electrolysis cells - A model-based analysis. Journal of Power Sources
Journal Article
452, 139476 (2023)
High-throughput computational solvent screening for lignocellulosic biomass processing. Chemical Engineering Journal
Journal Article
17 (6), pp. 1515 - 1527 (2023)
Superstructure optimization of a microalgal biorefinery design with life cycle assessment‐based and economic objectives. Biofuels, Bioproducts and Biorefining
Journal Article
281, 119202 (2023)
Multi-period optimization for the design and operation of a flexible power-to-methanol process. Chemical Engineering Science
Journal Article
474, 145333 (2023)
Chemical Recycling Processes of Nylon 6 to Caprolactam: Review and Techno-Economic Assessment. Chemical Engineering Journal
Journal Article
2 (3), 034501 (2023)
Electrochemical Performance of a Spatially Distributed ECPrOx Reactor. ECS Advances
Journal Article
469, 143713 (2023)
Optimal experimental design for the identification of a reaction kinetic model for the hydroaminomethylation of 1-decene in a thermomorphic multiphase system. Chemical Engineering Journal
Journal Article
127, pp. 9863 - 9873 (2023)
Gibbs–Helmholtz Graph Neural Network for the Prediction of Activity Coefficients of Polymer Solutions at Infinite Dilution. The Journal of Physical Chemistry A
Journal Article
2 (3), pp. 781 - 798 (2023)
Gibbs–Helmholtz graph neural network: capturing the temperature dependency of activity coefficients at infinite dilution. Digital Discovery
Journal Article
281, 119097 (2023)
Extending UNIFAC models for solid-liquid equilibria prediction and design of eutectic solvent systems. Chemical Engineering Science
Journal Article
69 (12), e18236 (2023)
Data‐driven integrated design of solvents and extractive distillation processes. AIChE Journal
Journal Article
219, 119511 (2023)
Optimal retrofit of a novel multi-component supercritical thermal fluid generation system via thermodynamic analysis. Applied Thermal Engineering
Journal Article
312, 123378 (2023)
Multi-level computational screening of anion-pillared metal-organic frameworks for propane and propene separation. Separation and Purification Technology
Journal Article
123, pp. 12170 - 12253 (2023)
Energy Applications of Ionic Liquids: Recent Developments and Future Prospects. Chemical Reviews
Journal Article
457, 140921 (2023)
Core–shell catalyst pellets for effective reaction heat management. Chemical Engineering Journal 2022
Journal Article
14 (15), e202200288 (2022)
Monolithic Al2O3 Xerogels with Hierarchical Meso‐/Macropore System as Catalyst Supports for Methanation of CO2. ChemCatChem
Journal Article
180, 108689 (2022)
Modeling and Simulation of Catalyst Deactivation and Regeneration Cycles for Propane Dehydrogenation - Comparison of Different Modeling Approaches. Chemical Engineering and Processing - Process Intensification
Journal Article
35, 100732 (2022)
Computer-aided molecular design of solvents for chemical separation processes. Current Opinion in Chemical Engineering
Journal Article
262, 118042 (2022)
Rational eutectic solvent design by linking regular solution theory with QSAR modelling. Chemical Engineering Science
Journal Article
10 (25), pp. 8216 - 8227 (2022)
Rational Screening of Deep Eutectic Solvents for the Direct Extraction of α-Tocopherol from Deodorized Distillates. ACS Sustainable Chemistry & Engineering
Journal Article
12, 1195 (2022)
Modeling, Degradation Study, Failures Diagnosis and Faulty Operating Management of Electrolyzers. Membranes
Journal Article
24, pp. 410 - 437 (2022)
Sustainability of green solvents – review and perspective. Green Chemistry