Publikationen Forschungsgruppe PSE
Zeitschriftenartikel (19)
1.
Zeitschriftenartikel
69 (10), e18185 (2023)
A scalable and integrated machine learning framework for molecular properties prediction. AIChE Journal 2.
Zeitschriftenartikel
2, S. 591 - 601 (2023)
Generalizing property prediction of ionic liquids from limited labeled data: a one-stop framework empowered by transfer learning. Digital Discovery 3.
Zeitschriftenartikel
35 (6), 063321 (2023)
Direct numerical simulations of polypropylene gasification in supercritical water. Physics of Fluids 4.
Zeitschriftenartikel
170, 064504 (2023)
Insights into the Path-Dependent Charge of Iridium Dissolution Products and Stability of Electrocatalytic Water Splitting. Journal of The Electrochemical Society 5.
Zeitschriftenartikel
559, 232582 (2023)
Transient hydrogen crossover in dynamically operated PEM water electrolysis cells - A model-based analysis. Journal of Power Sources 6.
Zeitschriftenartikel
452, 139476 (2023)
High-throughput computational solvent screening for lignocellulosic biomass processing. Chemical Engineering Journal 7.
Zeitschriftenartikel
17 (6), S. 1515 - 1527 (2023)
Superstructure optimization of a microalgal biorefinery design with life cycle assessment‐based and economic objectives. Biofuels, Bioproducts and Biorefining 8.
Zeitschriftenartikel
281, 119202 (2023)
Multi-period optimization for the design and operation of a flexible power-to-methanol process. Chemical Engineering Science 9.
Zeitschriftenartikel
474, 145333 (2023)
Chemical Recycling Processes of Nylon 6 to Caprolactam: Review and Techno-Economic Assessment. Chemical Engineering Journal 10.
Zeitschriftenartikel
2 (3), 034501 (2023)
Electrochemical Performance of a Spatially Distributed ECPrOx Reactor. ECS Advances 11.
Zeitschriftenartikel
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 12.
Zeitschriftenartikel
127, S. 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 13.
Zeitschriftenartikel
2 (3), S. 781 - 798 (2023)
Gibbs–Helmholtz graph neural network: capturing the temperature dependency of activity coefficients at infinite dilution. Digital Discovery 14.
Zeitschriftenartikel
281, 119097 (2023)
Extending UNIFAC models for solid-liquid equilibria prediction and design of eutectic solvent systems. Chemical Engineering Science 15.
Zeitschriftenartikel
69 (12), e18236 (2023)
Data‐driven integrated design of solvents and extractive distillation processes. AIChE Journal 16.
Zeitschriftenartikel
219, 119511 (2023)
Optimal retrofit of a novel multi-component supercritical thermal fluid generation system via thermodynamic analysis. Applied Thermal Engineering 17.
Zeitschriftenartikel
312, 123378 (2023)
Multi-level computational screening of anion-pillared metal-organic frameworks for propane and propene separation. Separation and Purification Technology 18.
Zeitschriftenartikel
123, S. 12170 - 12253 (2023)
Energy Applications of Ionic Liquids: Recent Developments and Future Prospects. Chemical Reviews 19.
Zeitschriftenartikel
457, 140921 (2023)
Core–shell catalyst pellets for effective reaction heat management. Chemical Engineering Journal Konferenzbeitrag (5)
20.
Konferenzbeitrag
Techno-Economic Process Analysis of the Chemical Recycling of Nylon 6 Using Phosphoric Acid. In: 33rd European Symposium on Computer Aided Process Engineering, S. 2393 - 2398 (Hg. Kokossis, A.; Georgiadis, M. C.; Pistikopoulos, E.). 33rd European Symposium on Computer Aided Process Engineering, Athen, Greece, 18. Juni 2023 - 21. Juni 2023. Elsevier, Amsterdam/Netherlands (2023)
21.
Konferenzbeitrag
Hybrid modeling of the catalytic CO2 methanation using process data and process knowledge. In: 33rd European Symposium on Computer Aided Process Engineering, S. 1489 - 1494 (Hg. Kokossis, A.; Georgiadis, M. C.; Pistikopoulos, E.). 33rd European Symposium on Computer Aided Process Engineering, Athen, Greece, 18. Juni 2023 - 21. Juni 2023. Elsevier, Amsterdam/Netherlands (2023)
22.
Konferenzbeitrag
52, S. 2037 - 2042. 33rd European Symposium on Computer Aided Process Engineering, Athen, Greece, 18. Juni 2023 - 21. Juni 2023. Elsevier, Amsterdam/Netherlands (2023)
Solvent pre-selection for extractive distillation using Gibbs-Helmholtz Graph Neural Networks. In: 33rd European Symposium on Computer Aided Process Engineering, Bd. 23.
Konferenzbeitrag
Molecular Property Targeting for Optimal Solvent Design in Extractive Distillation Processes. In: 33rd European Symposium on Computer Aided Process Engineering: Computer Aided Chemical Engineering, S. 1247 - 1252 (Hg. Kokossis, A.; Georgiadis, M. C.; Pistikopoulos, E.). 33rd European Symposium on Computer Aided Process Engineering, Athen, Greece, 18. Juni 2023 - 21. Juni 2023. Elsevier, Amsterdam/Netherlands (2023)
24.
Konferenzbeitrag
Optimal Design of Anion-pillared Metal-organic Frameworks for Gas Separation. In: 33rd European Symposium on Computer Aided Process Engineering, S. 991 - 996 (Hg. Kokossis, A.; Georgiadis, M. C.; Pistikopoulos, E.). 33rd European Symposium on Computer Aided Process Engineering, Athen, Greece, 18. Juni 2023 - 21. Juni 2023. Elsevier (2023)
Vortrag (17)
25.
Vortrag
Bottom-up assembly of A prokaryotic synthetic cell. N.I.C.E. INTERNATIONAL RENDEZ-VOUS, Nice, France (2023)
26.
Vortrag
Application of a multirate method to model the degradation of the Iridium Anode Catalyst Layer in a Proton Exchange Membrane Water Electrolyzer. 93rd Annual Meeting of the International Association of Applied Mathematics and Mechanics, Dresden, Germany (2023)
27.
Vortrag
Application of a multirate method to model the degradation of the Iridium anode catalyst layer in a proton exchange membrane water electrolyzer. CSE 2023 - Workshop on Computational Science and Engineering, Gross Schwansee, Germany (2023)
28.
Vortrag
Comparative study of hydrogen and natural gas networks: Simulation and network design optimization. WCCE11 - 11th WORLD CONGRESS OF CHEMICAL ENGINEERING, Buenos Aires, Argentina (2023)
29.
Vortrag
Self-Learning Adaptive Robust Control of a Precipitation Process. ECCE 14 & ECAB 7: 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology, Berlin, Germany (2023)
30.
Vortrag
Tailored solvent design for lignin dissolution using graph neural networks. ECCE 14 & ECAB 7: 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology, Berlin, Germany (2023)
31.
Vortrag
Techno-Economic Process Analysis of the Chemical Recycling of Nylon 6 Using Phosphoric Acid. ESCAPE-33, Athens, Greece (2023)
32.
Vortrag
Bottom-up assembly of A prokaryotic synthetic cell. SynCell 2023, Minneapolis, USA (2023)
33.
Vortrag
Learning reduced-order models for dynamic CO2 methanation using operator inference. ESCAPE34 - PSE24, Florence, Italy (angenommen)
34.
Vortrag
Hybrid modeling of the catalytic CO2 methanation using process data and mechanistic knowledge. ReactEng23: Annual Meeting on Reaction Engineering 2023, Frankfurt am Main (2023)
35.
Vortrag
An introductory course of machine learning for chemical engineering students: a prototype. WCCE11 - 11th WORLD CONGRESS OF CHEMICAL ENGINEERING, Buenos Aires, Argentina (2023)
36.
Vortrag
Predicting activity coefficients at infinite dilution of polymer solutions using Graph Neural Networks. WCCE11 - 11th WORLD CONGRESS OF CHEMICAL ENGINEERING, Buenos Aires, Argentina (2023)
37.
Vortrag
Solvent pre-selection for extractive distillation using Gibbs-Helmholtz Graph Neural Networks. ESCAPE-33, Athens, Greece (2023)
38.
Vortrag
Integrated computer-aided molecular, material and process design for efficient chemical production systems. 30th Annual Roger Sargent Centre Lecture, London, UK (2023)
39.
Vortrag
Identifying simple process designs of methanol production from renewables by multi-objective optimization using the FluxMax approach. WCCE11 - 11th WORLD CONGRESS OF CHEMICAL ENGINEERING, Buenos Aires, Argentina (2023)
40.
Vortrag
Data-driven integrated design of solvents and extractive distillation processes. 2023 AIChE Annual Meeting, Orlando, USA (2023)
41.
Vortrag
Optimal design of anion-pillared metal-organic frameworks for gas separation. ESCAPE-33, Athens, Greece (2023)
Poster (13)
42.
Poster
Influences on Iridium Catalyst Dissolution in Single-Cell PEM Water Electrolysis. EFCF 2023 (European Fuel Cell Forum), Lucerne, Switzerland (2023)
43.
Poster
Depolymerization of polyamide 6 using ionic liquids with focus on process intensification. 14th International Workshop on Polymer Reaction Engineering (PRE), Potsdam, Germany (2023)
44.
Poster
Depolymerization of polyamide 6 using ionic liquids with focus on process intensification. 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology, Berlin, Germany (2023)
45.
Poster
Towards selective CO2 mineralization to calcite or magnesite applying the pH swing process. 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology, Berlin, Germany (2023)
46.
Poster
Optimal Design of Experiments for the determination of the Kinetics of the homogeneous rhodium-catalyzed Hydroaminomethylation. Annual Meeting on Reaction Engineering 2023, Frankfurt am Main, Germany (2023)
47.
Poster
Hybrid modeling of the catalytic CO2 methanation using process data and mechanistic knowledge. ESCAPE-33, Athens, Greece (2023)
48.
Poster
Multi-objective life cycle optimization for sustainable biorefinery design. The 11th Int. Conf. Life Cycle Management, Lille, France (2023)
49.
Poster
Process-driven solvent screening for efficient extractive distillation: smart of interpolative rational functions. 2023 AIChE Annual Meeting, Orlando, USA (2023)
50.
Poster
Efficient recovery of monomers in chemical recycling of polyamides by smart crystallization processes. 2nd Smart Process Systems Symposium, Magdeburg, Germany (2023)