[Journal Article]
Germscheid, Sonja H. M.; Röben, Fritz Thomas Carl; Sun, Han; Bardow, André; Mitsos, Alexander; Dahmen, Manuel
Demand response scheduling of copper production under short-term electricity price uncertainty
In: Computers & chemical engineering, 178, 108394, 2023
[DOI: 10.1016/j.compchemeng.2023.108394]

[Journal Article]
Mucci, Simone; Mitsos, Alexander; Bongartz, Dominik
Cost-optimal Power-to-Methanol : Flexible operation or intermediate storage?
In: Journal of energy storage, 72 (Part E), 108614, 2023
[DOI: 10.1016/j.est.2023.108614]

[Journal Article]
Nilges, Benedikt; Burghardt, Célia; Roh, Kosan; Reinert, Christiane; von der Aßen, Niklas Vincenz
Comparative life cycle assessment of industrial demand-side management via operational optimization
In: Computers & chemical engineering : CACE, 177, 108323, 2023
[DOI: 10.1016/j.compchemeng.2023.108323]

[Journal Article]
El Wajeh, Mohammad; Mhamdi, Adel; Mitsos, Alexander
Dynamic Modeling and Plantwide Control of a Production Process for Biodiesel and Glycerol
In: Industrial & engineering chemistry research : I & EC research, 62 (27), 10559-10576, 2023
[DOI: 10.1021/acs.iecr.3c00934]

[Contribution to a book, Journal Article]
Saur, Katharina; Kiefel, Robert; Niehoff, Paul-Joachim; Hofstede, Jordy; Ernst, Philipp; Brockkötter, Johannes Markus Josef; Gätgens, Jochem; Viell, Jörn; Noack, Stephan; Wierckx, Nick; Büchs, Jochen; Jupke, Andreas
Holistic Approach to Process Design and Scale-Up for Itaconic Acid Production from Crude Substrates
In: Bioengineering : open access journal, 10 (6), 723, 2023
[DOI: 10.3390/bioengineering10060723]

[Contribution to a book, Journal Article]
Mitsos, Alexander; Zingler, Aron
Unsicherheit in Stromnetzen : Robuste Optimierung für eine robuste Stromversorgung
In: RWTH-Themen : Forschungsmagazin, 2023 (1), 20-23, 2023
[DOI: 10.18154/RWTH-2023-05855]

[Journal Article]
Cramer, Eike Casjen Friedrich; Witthaut, Dirk; Mitsos, Alexander; Dahmen, Manuel
Multivariate probabilistic forecasting of intraday electricity prices using normalizing flows
In: Applied energy, 346, 121370, 2023
[DOI: 10.1016/j.apenergy.2023.121370]

[Journal Article]
Chen, Ke; Liu, Mingzhao; Gu, Jianghang; Mhamdi, Adel; Gross, Sven; Heng, Yi
Efficient direct numerical simulation of gas absorption in falling films using a combined high-throughput/high-performance approach
In: Chemical engineering science, 273, 118603, 2023
[DOI: 10.1016/j.ces.2023.118603]

[Journal Article]
Saß, Susanne; Tsoukalas, Angelos; Bell, Ian H.; Bongartz, Dominik; Najman, Jaromil; Mitsos, Alexander
Towards global parameter estimation exploiting reduced data sets
In: Optimization methods & software, 1-13, 2023
[DOI: 10.1080/10556788.2023.2205645]

[Journal Article]
Mucci, Simone; Mitsos, Alexander; Bongartz, Dominik
Power-to-X processes based on PEM water electrolyzers: A review of process integration and flexible operation
In: Computers & chemical engineering : CACE, 175, 108260, 2023
[DOI: 10.1016/j.compchemeng.2023.108260]

[Journal Article]
Schweidtmann, Artur M.; Rittig, Jan Gerald; Weber, Jana M.; Grohe, Martin; Dahmen, Manuel; Leonhard, Kai; Mitsos, Alexander
Physical pooling functions in graph neural networks for molecular property prediction
In: Computers & chemical engineering, 172, 108202, 2023
[DOI: 10.1016/j.compchemeng.2023.108202]

[Journal Article]
Rittig, Jan Gerald; Ben Hicham, Karim; Schweidtmann, Artur M.; Dahmen, Manuel; Mitsos, Alexander
Graph neural networks for temperature-dependent activity coefficient prediction of solutes in ionic liquids
In: Computers & chemical engineering, 171, 108153, 2023
[DOI: 10.1016/j.compchemeng.2023.108153]

[Journal Article]
Roth, Daniel Matthias; Haas, Moritz; Echtermeyer, Alexander Walter Wilhelm; Kaminski, Sebastian; Viell, Jörn; Jupke, Andreas
The Effect of Sulfate Electrolytes on the Liquid-Liquid Equilibrium of 2-MTHF/Water/5-HMF: Experimental Study and Thermodynamic Modeling
In: Journal of chemical & engineering data, 68 (6), 1397-1410, 2023
[DOI: 10.1021/acs.jced.2c00698]

[Contribution to a book, Journal Article]
Palmtag, Andreas; Schröder, Christian Pascal; Zhai, Song; Jupke, Andreas
Extraction Technologies at ACHEMA 2022
In: Chemie - Ingenieur - Technik : CIT, 95 (6), 874-876, 2023
[DOI: 10.1002/cite.202300016]

[Journal Article]
Fleitmann, Lorenz Heinrich Johannes; Ackermann, Philipp; Schilling, Johannes; Kleinekorte, Johanna; Rittig, Jan Gerald; vom Lehn, Florian Alexander; Schweidtmann, Artur M.; Pitsch, Heinz; Leonhard, Kai; Mitsos, Alexander; Bardow, André; Dahmen, Manuel
Molecular design of fuels for maximum spark-ignition engine efficiency by combining predictive thermodynamics and machine learning
In: Energy & fuels, 37 (3), 2213-2229, 2023
[DOI: 10.1021/acs.energyfuels.2c03296]

[Journal Article]
Seidenberg, J. Raphael; Khan, Ahmad A.; Lapkin, Alexei A.
Boosting autonomous process design and intensification with formalized domain knowledge
In: Computers & chemical engineering, 169, 108097, 2022
[DOI: 10.1016/j.compchemeng.2022.108097]

[Journal Article]
Begall, Moritz Johannes; Schweidtmann, Artur M.; Mhamdi, Adel; Mitsos, Alexander
Geometry optimization of a continuous millireactor via CFD and Bayesian optimization
In: Computers & chemical engineering, 171, 108140, 2023
[DOI: 10.1016/j.compchemeng.2023.108140]

[Journal Article]
Rittig, Jan Gerald; Ritzert, Martin; Schweidtmann, Artur M.; Winkler, Stefanie; Weber, Jana M.; Morsch, Philipp; Heufer, Karl Alexander; Grohe, Martin; Mitsos, Alexander; Dahmen, Manuel
Graph machine learning for design of high-octane fuels
In: AIChE journal, 69 (4), e17971, 2022
[DOI: 10.1002/aic.17971]

[Journal Article]
Nevolianis, Thomas; Wolter, Nadja Anna; Kaven, Luise Friederike; Krep, Lukas; Huang, Can; Mhamdi, Adel; Mitsos, Alexander; Pich, Andrij; Leonhard, Kai
Kinetic modeling of a poly(n-vinylcaprolactam-co-glycidyl methacrylate) microgel synthesis: a hybrid in silico and experimental approach
In: Industrial & engineering chemistry research : I & EC research, 62 (2), 893-902, 2023
[DOI: 10.1021/acs.iecr.2c03291]

[Contribution to a book, Journal Article]
Leenders, Ludger; Hagedorn, Dörthe Franzisca; Djelassi, Hatim; Bardow, André; Mitsos, Alexander
Bilevel optimization for joint scheduling of production and energy systems
In: Optimization and engineering, 24 (1), 499-537, 2022
[DOI: 10.1007/s11081-021-09694-0]

[Journal Article]
Burre, Jannik; Bongartz, Dominik; Mitsos, Alexander
Comparison of MINLP formulations for global superstructure optimization
In: Optimization and engineering, 24 (2), 801-830, 2022
[DOI: 10.1007/s11081-021-09707-y]

[Journal Article]
Houfani, Aicha Asma; Anders, Nico; Loogen, Judith; Heyman, Benedikt; Azzouz, Zahra; Bettache, Azzeddine; Büchs, Jochen; Benallaoua, Said
Lignocellulosic biomass degradation enzymes and characterization of cellulase and xylanase from Bosea sp. FBZP-16
In: Biomass Conversion and Biorefinery, 13, 12085-12103, 2021
[DOI: 10.1007/s13399-021-02044-1]

[Abstract, Contribution to a conference proceedings, Journal Article]
Mucci, Simone; Bongartz, Dominik; Mitsos, Alexander
Optimal Design and Scheduling of a Power-to-Methanol Process with Battery and Intermediate Hydrogen Storage
In: Chemie - Ingenieur - Technik : CIT, 94 (9), P6.11, 2022
[DOI: 10.1002/cite.202255211]

[Contribution to a book, Contribution to a conference proceedings, Journal Article]
Balhorn, Lukas Schulze; Gao, Qinghe; Goldstein, Dominik; Schweidtmann, Artur M.
Flowsheet Recognition using Deep Convolutional Neural Networks
In: Computer Aided Chemical Engineering, 49, 1567-1572, 2022
[DOI: 10.1016/B978-0-323-85159-6.50261-X]

[Journal Article]
Bremen, Andreas Michael; Ebeling, Katharina Maria; Schulte, Victor; Pavšek, Jan; Mitsos, Alexander
Dynamic modeling of aqueous electrolyte systems in Modelica
In: Computers & chemical engineering, 166, 107968, 2022
[DOI: 10.1016/j.compchemeng.2022.107968]

[Journal Article]
Cramer, Eike Casjen Friedrich; Paeleke, Leonard; Mitsos, Alexander; Dahmen, Manuel
Normalizing flow-based day-ahead wind power scenario generation for profitable and reliable delivery commitments by wind farm operators
In: Computers & chemical engineering, 166, 107923, 2022
[DOI: 10.1016/j.compchemeng.2022.107923]

[Journal Article]
El Wajeh, Mohammad; Jung, Falco Constantin; Bongartz, Dominik; Kappatou, Chrysoula Dimitra; Ghaffari Laleh, Narmin; Mitsos, Alexander; Kather, Jakob Nikolas
Can the Kuznetsov Model Replicate and Predict Cancer Growth in Humans?
In: Bulletin of mathematical biology, 84 (11), 130, 2022
[DOI: 10.1007/s11538-022-01075-7]

[Journal Article]
Cramer, Eike Casjen Friedrich; Mitsos, Alexander; Tempone, Raúl; Dahmen, Manuel
Principal component density estimation for scenario generation using normalizing flows
In: Data-centric engineering, 3, e7, 2022
[DOI: 10.1017/dce.2022.7]

[Contribution to a conference proceedings, Journal Article]
Roh, K.; Brée, Luisa Carola; Schäfer, Pascal; Strohmeier, D.; Mitsos, Alexander
Flexible operation of modular electrochemical CO2 reduction processes
In: IFAC-PapersOnLine, 55 (7), 298-303, 2022
[DOI: 10.1016/j.ifacol.2022.07.460]

[Journal Article]
Fahr, Steffen R.; Peña-Benavides, Samantha Ayde; Thiel, Lukas; Sengoba, Carl; Karacasulu, Kaan; Ihling, Nina; Sosa-Hernández, Juan Eduardo; Gilleskie, Gary; Woodley, John M.; Parra-Saldivar, Roberto; Mansouri, Seyed Soheil; Roh, Kosan
Mobile On Demand COVID-19 Vaccine Production Units for Developing Countries
In: Industrial & engineering chemistry research : I & EC research, 61 (35), 13191-13204, 2022
[DOI: 10.1021/acs.iecr.2c01217]

[Journal Article]
Bremen, Andreas Michael; Strunge, Till; Ostovari, Hesam; Spütz, Hendrik; Mhamdi, Adel; Renforth, Phil; van der Spek, Mijndert; Bardow, André; Mitsos, Alexander
Direct Olivine Carbonation: Optimal Process Design for a Low-Emission and Cost-Efficient Cement Production
In: Industrial & engineering chemistry research : I & EC research, 61 (35), 13177-13190, 2022
[DOI: 10.1021/acs.iecr.2c00984]

[Journal Article]
Germscheid, Sonja H. M.; Mitsos, Alexander; Dahmen, Manuel
Demand response potential of industrial processes considering uncertain short-term electricity prices
In: AIChE journal, 68 (6), e17828, 2022
[DOI: 10.1002/aic.17828]

[Journal Article]
dos Santos Schultz, Eduardo; Olofsson, Simon; Mhamdi, Adel; Mitsos, Alexander
Satisfaction of path chance constraints in dynamic optimization problems
In: Computers & chemical engineering, 164, 107899, 2022
[DOI: 10.1016/j.compchemeng.2022.107899]

[Journal Article]
Jungen, Daniel; Djelassi, Hatim; Mitsos, Alexander
Adaptive discretization-based algorithms for semi-infinite programs with unbounded variables
In: Mathematical methods of operations research : ZOR, 96 (1), 83-112, 2022
[DOI: 10.1007/s00186-022-00792-y]

[Journal Article]
Harhues, Tobias; Portheine, Lukas; Plath, Cathleen Anastasia Nadine; Viell, Jörn; Keller, Robert Gregor; Büchs, Jochen; Wessling, Matthias
Direct Electrosynthesis of 2-Butanone from Fermentation Supernatant
In: ACS sustainable chemistry & engineering, 10 (19), 6483-6492, 2022
[DOI: 10.1021/acssuschemeng.2c01971]

[Journal Article]
Schulze, Jan Christoph; Mitsos, Alexander
Data-Driven Nonlinear Model Reduction Using Koopman Theory : Integrated Control Form and NMPC Case Study
In: IEEE control systems letters, 6, 2978-2983, 2022
[DOI: 10.1109/LCSYS.2022.3181443]

[Journal Article]
Biselli, Andreas; Echtermeyer, Alexander Walter Wilhelm; Reifsteck, Rafael Antonio; Materla, Peter; Mitsos, Alexander; Viell, Jörn; Jupke, Andreas
Investigation of the elution behavior of dissociating itaconic acid on a hydrophobic polymeric adsorbent using in-line Raman spectroscopy
In: Journal of chromatography / A, 1675, 463140, 2022
[DOI: 10.1016/j.chroma.2022.463140]

[Journal Article]
Karacasulu, Kaan; Echtermeyer, Alexander Walter Wilhelm; Kabatnik, Christoph; Scheffczyk, Jan David; Bardow, André; Viell, Jörn; Mitsos, Alexander
Optimally designed solvent system for lignocellulosic biomass conversion supported by property predictions
In: Sustainable energy & fuels, 6 (11), 2734-2744, 2022
[DOI: 10.1039/D2SE00187J]

[Journal Article]
Deb, Tanmoy Kanti; Lebaz, Noureddine; Ozdemir, Mahir Sinan; Govoreanu, Ruxandra; Mhamdi, Adel; Sin, Gürkan; Sheibat-Othman, Nida
Monitoring and Modeling of Creaming in Oil-in-Water Emulsions
In: Industrial & engineering chemistry research : I & EC, 61 (13), 4638-4647, 2022
[DOI: 10.1021/acs.iecr.1c04722]

[Journal Article]
Burre, Jannik; Kabatnik, Christoph; Al-Khatib, Mohamed; Bongartz, Dominik; Jupke, Andreas; Mitsos, Alexander
Global flowsheet optimization for reductive dimethoxymethane production using data-driven thermodynamic models
In: Computers & chemical engineering, 162, 107806, 2022
[DOI: 10.1016/j.compchemeng.2022.107806]

[Journal Article]
Fahr, Steffen R.; Mitsos, Alexander; Bongartz, Dominik
Simultaneous deterministic global flowsheet optimization and heat integration: Comparison of formulations
In: Computers & chemical engineering, 162, 107790, 2022
[DOI: 10.1016/j.compchemeng.2022.107790]

[Journal Article]
Völker, Simon; Deutz, Sarah; Burre, Jannik; Bongartz, Dominik; Omari, Ahmad; Lehrheuer, Bastian; Mitsos, Alexander; Pischinger, Stefan; Bardow, André; von der Aßen, Niklas Vincenz
Blend for all or pure for few? Well-to-wheel life cycle assessment of blending electricity-based OME$_{3-5}$ with fossil diesel
In: Sustainable energy & fuels, 6 (8), 1959-1973, 2022
[DOI: 10.1039/D1SE01758F]

[Journal Article]
Schulze, Jan Christoph; Doncevic, Danimir T.; Mitsos, Alexander
Identification of MIMO Wiener-type Koopman Models for Data-Driven Model Reduction using Deep Learning
In: Computers & chemical engineering, 161, 107781, 2022
[DOI: 10.1016/j.compchemeng.2022.107781]

[Contribution to a book, Journal Article]
Merkelbach, Kilian; Schweidtmann, Artur M.; Müller, Younes; Schwoebel, Patrick; Mhamdi, Adel; Mitsos, Alexander; Schuppert, Andreas; Mrziglod, Thomas; Schneckener, Sebastian
HybridML : Open source platform for hybrid modeling
In: Computers & chemical engineering, 160, 107736, 2022
[DOI: 10.1016/j.compchemeng.2022.107736]

[Journal Article]
Langiu, Marco; Dahmen, Manuel; Mitsos, Alexander
Simultaneous optimization of design and operation of an air-cooled geothermal ORC under consideration of multiple operating points
In: Computers & chemical engineering, 161, 107745, 2022
[DOI: 10.1016/j.compchemeng.2022.107745]

[Journal Article]
Varelmann, Tim; Lipow, Adrian Walter; Baldea, Michael; Mitsos, Alexander
Advanced feasibility cuts in decoupled cooperative optimization of power flow
In: Computers & chemical engineering, 157, 107635, 2021
[DOI: 10.1016/j.compchemeng.2021.107635]

[Journal Article]
Kappatou, Chrysoula Dimitra; Bongartz, Dominik; Najman, Jaromil; Saß, Susanne; Mitsos, Alexander
Global dynamic optimization with Hammerstein-Wiener models embedded
In: Journal of global optimization, 84 (2), 321-347, 2022
[DOI: 10.1007/s10898-022-01145-z]

[Journal Article]
Marks, Caroline; Viell, Jörn
Solvents and ions for pretreatment in lignocellulosic biorefineries
In: Process biochemistry, 113, 241-257, 2022
[DOI: 10.1016/j.procbio.2022.01.001]

[Journal Article]
Ploch, Tobias Michael; Deussen, Jens; Naumann, Uwe; Mitsos, Alexander; Hannemann-Tamás, Ralf
Direct single shooting for dynamic optimization of differential-algebraic equation systems with optimization criteria embedded
In: Computers & chemical engineering, 159, 107643, 2022
[DOI: 10.1016/j.compchemeng.2021.107643]

[Journal Article]
Cramer, Eike Casjen Friedrich; Gorjao, Leonardo Rydin; Mitsos, Alexander; Schafer, Benjamin; Witthaut, Dirk; Dahmen, Manuel
Validation Methods for Energy Time Series Scenarios from Deep Generative Models
In: IEEE access, 10, 8194-8207, 2022
[DOI: 10.1109/ACCESS.2022.3141875]