[Fachzeitschriftenartikel]
Schulze, Jan Christoph; Caspari, Adrian; Offermanns, Christoph; Mhamdi, Adel; Mitsos, Alexander
Nonlinear Model Predictive Control of Ultra-High-Purity Air Separation Units using Transient Wave Propagation Model
In: Computers & chemical engineering, 145, 107163, 2020
[DOI: 10.1016/j.compchemeng.2020.107163]

[Fachzeitschriftenartikel]
Echtermeyer, Alexander Walter Wilhelm; Marks, Caroline; Mitsos, Alexander; Viell, Jörn
EXPRESS: Inline Raman Spectroscopy and Indirect Hard Modeling for Concentration Monitoring of Dissociated Acid Species
In: Applied spectroscopy, 75 (5), 506-519, 2020
[DOI: 10.1177/0003702820973275]

[Fachzeitschriftenartikel]
Bremen, Andreas Michael; Ploch, Tobias Michael; Mhamdi, Adel; Mitsos, Alexander
A Mechanistic Model of Direct Forsterite Carbonation
In: The chemical engineering journal, 404, 126480, 2020
[DOI: 10.1016/j.cej.2020.126480]

[Beitrag zu einem Tagungsband, Fachzeitschriftenartikel]
Doncevic, Danimir T.; Schweidtmann, Artur M.; Vaupel, Yannic; Schäfer, Pascal; Caspari, Adrian; Mitsos, Alexander
Deterministic Global Nonlinear Model Predictive Control with Neural Networks Embedded
In: IFAC-PapersOnLine, 53 (2), 5273-5278, 2020
[DOI: 10.1016/j.ifacol.2020.12.1207]

[Fachzeitschriftenartikel]
Nöth, Maximilian Wolfgang Stefan; Gau, Elisabeth; Jung, Falco Constantin; Davari, Mehdi D.; El-Awaad, Islam; Pich, Andrij; Schwaneberg, Ulrich
Biocatalytic microgels (μ-Gelzymes) : synthesis, concepts, and emerging applications
In: Green chemistry : GC, 22 (23), 8183-8209, 2020
[DOI: 10.1039/D0GC03229H]

[Fachzeitschriftenartikel]
Burre, Jannik; Bongartz, Dominik; Mitsos, Alexander
Corrigendum: "Production of Oxymethylene Dimethyl Ethers from Hydrogen and Carbon Dioxide : Part I: Modeling and Analysis for OME$_{1}$ & Part II: Modeling and Analysis for OME$_{3-5}$"
In: Industrial & engineering chemistry research, 59 (49), 21615-21616, 2020
[DOI: 10.1021/acs.iecr.0c05592]

[Fachzeitschriftenartikel, Fachzeitschriftenartikel]
Huster, Wolfgang Raphael; Huster, Wolfgang Raphael; Schweidtmann, Artur M.; Schweidtmann, Artur M.; Mitsos, Alexander; Mitsos, Alexander
Globally optimal working fluid mixture composition for geothermal power cycles
In: Energy : the international journal, 212, 118731, 2020
[DOI: 10.1016/j.energy.2020.118731]

[Fachzeitschriftenartikel]
Jung, Falco Constantin; Ksiazkiewicz, Agnieszka; Mhamdi, Adel; Pich, Andrij; Mitsos, Alexander
Model-Based Optimization of Microgel Synthesis in the μm Size Range
In: Industrial & engineering chemistry research, 59 (46), 20437-20446, 2020
[DOI: 10.1021/acs.iecr.0c04286]

[Buchbeitrag, Beitrag zu einem Tagungsband, Fachzeitschriftenartikel]
Weber, Jana M.; Schweidtmann, Artur M.; Nolasco, Edouardo; Lapkin, Alexei A.
Modelling Circular Structures in Reaction Networks : Petri Nets and Reaction Network Flux Analysis
In: Computer aided chemical engineering, 48, 1843-1848, 2020
[DOI: 10.1016/B978-0-12-823377-1.50308-6]

[Buchbeitrag, Beitrag zu einem Tagungsband, Fachzeitschriftenartikel]
Caspari, Adrian; Fahr, Steffen R.; Offermanns, Christian; Mhamdi, Adel; Biegler, Lorenz T.; Mitsos, Alexander
Optimal Start-Up of Air Separation Processes using Dynamic Optimization with Complementarity Constraints
In: Computer aided chemical engineering, 48, 1147-1152, 2020
[DOI: 10.1016/B978-0-12-823377-1.50192-0]

[Buchbeitrag, Fachzeitschriftenartikel]
Schäfer, Pascal; Caspari, Adrian; Schweidtmann, Artur M.; Vaupel, Yannic; Mhamdi, Adel; Mitsos, Alexander
The Potential of Hybrid Mechanistic/Data‐Driven Approaches for Reduced Dynamic Modeling : Application to Distillation Columns
In: Chemie - Ingenieur - Technik : CIT, 92 (12), 1910-1920, 2020
[DOI: 10.1002/cite.202000048]

[Fachzeitschriftenartikel]
Sun, Ruiyan; Asmelash, Chalachew Mebrahtu; Hofmann, Jan Philipp; Bongartz, Dominik; Burre, Jannik; Gierlich, Christian Henning; Hausoul, Peter J. C.; Mitsos, Alexander; Palkovits, Regina
Hydrogen-efficient non-oxidative transformation of methanol into dimethoxymethane over a tailored bifunctional Cu catalyst
In: Sustainable energy & fuels, 5 (1), 117-126, 2020
[DOI: 10.1039/D0SE01314E]

[Fachzeitschriftenartikel]
Schweidtmann, Artur M.; Rittig, Jan Gerald; König, Andrea; Grohe, Martin; Mitsos, Alexander; Dahmen, Manuel
Graph Neural Networks for Prediction of Fuel Ignition Quality
In: Energy & fuels, 34 (9), 11395-11407, 2020
[DOI: 10.1021/acs.energyfuels.0c01533]

[Abstract, Beitrag zu einem Tagungsband, Fachzeitschriftenartikel]
Hofstede, Jordy; Lindmeyer, Martin; Mitsos, Alexander; Viell, Jörn
A method for systematic identification of chemical and biotechnological processes for decentral, modular processing
In: Chemie - Ingenieur - Technik : CIT, 92 (9), P5.82, 2020
[DOI: 10.1002/cite.202055287]

[Fachzeitschriftenartikel]
Zhao, Xiao; Ploch, Tobias Michael; Noack, Stephan; Wiechert, Wolfgang; Mitsos, Alexander; von Lieres, Eric
Analysis of the local well‐posedness of optimization‐constrained differential equations by local optimality conditions
In: AIChE journal, 66 (10), e16548, 2020
[DOI: 10.1002/aic.16548]

[Fachzeitschriftenartikel]
Cumpston, Jeff; Herding, Robert; Lechtenberg, Fabian; Offermanns, Christoph; Thebelt, Alexander; Roh, Kosan
Design of 24/7 continuous hydrogen production system employing the solar-powered thermochemical S-I cycle
In: International journal of hydrogen energy, 45 (46), 24383-24396, 2020
[DOI: 10.1016/j.ijhydene.2020.05.185]

[Fachzeitschriftenartikel]
Schäfer, Pascal; Daun, Torben M.; Mitsos, Alexander
Do investments in flexibility enhance sustainability? : A simulative study considering the German electricity sector
In: AIChE journal, 66 (11), e17010, 2020
[DOI: 10.1002/aic.17010]

[Fachzeitschriftenartikel]
Schäfer, Pascal; Schweidtmann, Artur M.; Mitsos, Alexander
Nonlinear scheduling with time-variable electricity prices using sensitivity-based truncations of wavelet transforms
In: AIChE journal, 66 (10), e16986, 2020
[DOI: 10.1002/aic.16986]

[Fachzeitschriftenartikel]
Kappatou, Chrysoula Dimitra; Ehsani, Alireza; Niedenführ, Sebastian; Mhamdi, Adel; Schuppert, Andreas; Mitsos, Alexander
Quality-targeting dynamic optimization of monoclonal antibody production
In: Computers & chemical engineering, 142, 107004, 2020
[DOI: 10.1016/j.compchemeng.2020.107004]

[Buchbeitrag, Fachzeitschriftenartikel]
König, Andrea; Marquardt, Wolfgang; Mitsos, Alexander; Viell, Jörn; Dahmen, Manuel
Integrated design of renewable fuels and their production processes : recent advances and challenges
In: Current opinion in chemical engineering, 27, 45-50, 2019
[DOI: 10.1016/j.coche.2019.11.001]

[Fachzeitschriftenartikel]
dos Santos Schultz, Eduardo; Sheibat-Othman, Nida; Mitsos, Alexander; Mhamdi, Adel
Model-Based Optimization of Semibatch Emulsion Polymerization of Styrene
In: Industrial & engineering chemistry research, 59 (37), 16368-16379, 2020
[DOI: 10.1021/acs.iecr.0c02771]

[Fachzeitschriftenartikel]
Gjerga, Enio; Trairatphisan, Panuwat; Gabor, Attila; Koch, Hermann; Chevalier, Celine; Ceccarelli, Franceco; Dugourd, Aurelien; Mitsos, Alexander; Saez-Rodriguez, Julio
Converting networks to predictive logic models from perturbation signalling data with CellNOpt
In: Bioinformatics, 36 (16), 4523-4524, 2020
[DOI: 10.1093/bioinformatics/btaa561]

[Fachzeitschriftenartikel]
Ploch, Tobias Michael; von Lieres und Wilkau, Eric; Wiechert, Wolfgang; Mitsos, Alexander; Hannemann-Tamás, Ralf
Simulation of differential-algebraic equation systems with optimization criteria embedded in Modelica
In: Computers & chemical engineering, 140, 106920, 2020
[DOI: 10.1016/j.compchemeng.2020.106920]

[Fachzeitschriftenartikel]
Vaupel, Yannic; Hamacher, Nils C.; Caspari, Adrian; Mhamdi, Adel; Kevrekidis, Ioannis G.; Mitsos, Alexander
Accelerating nonlinear model predictive control through machine learning
In: Journal of process control, 92, 261-270, 2020
[DOI: 10.1016/j.jprocont.2020.06.012]

[Fachzeitschriftenartikel]
Huster, Wolfgang Raphael; Schweidtmann, Artur M.; Lüthje, Jannik Torben; Mitsos, Alexander
Deterministic global superstructure-based optimization of an organic Rankine cycle
In: Computers & chemical engineering, 141, 106996, 2020
[DOI: 10.1016/j.compchemeng.2020.106996]

[Fachzeitschriftenartikel]
Brée, Luisa Carola; Bulan, Andreas; Herding, Robert; Kuhlmann, Jonas Lukas; Mitsos, Alexander; Perrey, Karen; Roh, Kosan
Techno-Economic Comparison of Flexibility Options in Chlorine Production
In: Industrial & engineering chemistry Research, 59 (26), 12186-12196, 2020
[DOI: 10.1021/acs.iecr.0c01775]

[Fachzeitschriftenartikel]
Caspari, Adrian; Tsay, Calvin; Mhamdi, Adel; Baldea, Michael; Mitsos, Alexander
The integration of scheduling and control: Top-down vs. bottom-up
In: Journal of process control, 91, 50-62, 2020
[DOI: 10.1016/j.jprocont.2020.05.008]

[Fachzeitschriftenartikel]
Joy, Preet Joseph; Mhamdi, Adel; Mitsos, Alexander
Optimization-based observability analysis
In: Computers & chemical engineering, 140, 106932, 2020
[DOI: 10.1016/j.compchemeng.2020.106932]

[Fachzeitschriftenartikel]
Caspari, Adrian; Lüken, Lukas; Schäfer, Pascal; Vaupel, Yannic; Mhamdi, Adel; Biegler, Lorenz T.; Mitsos, Alexander
Dynamic Optimization with Complementarity Constraints : Smoothing for Direct Shooting
In: Computers & chemical engineering : CACE, 139, 106891, 2020
[DOI: 10.1016/j.compchemeng.2020.106891]

[Fachzeitschriftenartikel]
Roh, Kosan; Bardow, André; Bongartz, Dominik; Burre, Jannik; Chung, Wonsuk; Deutz, Sarah; Han, Dongho; Heßelmann, Matthias; Kohlhaas, Yannik; König, Andrea; Lee, Jeehwan S.; Meys, Raoul; Völker, Simon; Wessling, Matthias; Lee, Jay H.; Mitsos, Alexander
Early-stage evaluation of emerging CO$_{2}$ utilization technologies at low technology readiness levels
In: Green chemistry : GC, 22 (12), 3842-3859, 2020
[DOI: 10.1039/C9GC04440J]

[Fachzeitschriftenartikel]
Caspari, Adrian; Offermanns, Christoph; Ecker, Anna-Maria; Pottmann, Martin; Zapp, Gerhard; Mhamdi, Adel; Mitsos, Alexander
A wave propagation approach for reduced dynamic modeling of distillation columns: Optimization and control
In: Journal of process control, 91, 12-24, 2020
[DOI: 10.1016/j.jprocont.2020.05.004]

[Fachzeitschriftenartikel]
Neumann, Pascal; Cao, Liwei; Russo, Danilo; Vassiliadis, Vassilios S.; Lapkin, Alexei A.
A new formulation for symbolic regression to identify physico-chemical laws from experimental data
In: The chemical engineering journal, 387, 123412, 2019
[DOI: 10.1016/j.cej.2019.123412]

[Fachzeitschriftenartikel]
Brée, Luisa Carola; Wessling, Matthias; Mitsos, Alexander
Modular modeling of electrochemical reactors : Comparison of CO2-electolyzers
In: Computers & chemical engineering, 139, 106890 -, 2020
[DOI: 10.1016/j.compchemeng.2020.106890]

[Fachzeitschriftenartikel]
Rall, Deniz Patrick; Schweidtmann, Artur M.; Kruse, Maximilian; Evdochenko, Elizaveta; Mitsos, Alexander; Wessling, Matthias
Multi-scale membrane process optimization with high-fidelity ion transport models through machine learning
In: Journal of membrane science, 608, 118208, 2020
[DOI: 10.1016/j.memsci.2020.118208]

[Fachzeitschriftenartikel]
Brée, Luisa Carola; Mitsos, Alexander
Two-Tank MultiCompartment Redox Flow Battery
In: Journal of energy storage, 29, 101412, 2020
[DOI: 10.1016/j.est.2020.101412]

[Fachzeitschriftenartikel]
Viell, Jörn; Szekely, Noemi K.; Mangiapia, Gaetano; Hövelmann, Claas; Marks, Caroline; Frielinghaus, Henrich
In operando monitoring of wood transformation during pretreatment with ionic liquids
In: Cellulose, 27 (9), 4889-4907, 2020
[DOI: 10.1007/s10570-020-03119-4]

[Fachzeitschriftenartikel]
Bongartz, Dominik; Najman, Jaromil; Mitsos, Alexander
Deterministic global optimization of steam cycles using the IAPWS-IF97 model
In: Optimization and engineering, 21 (3), 1095-1131, 2020
[DOI: 10.1007/s11081-020-09502-1]

[Fachzeitschriftenartikel]
Roh, Kosan; Chung, Wonsuk; Lee, Hyejin; Park, Seungman; Lee, Jay H.
Impacts of deploying co-electrolysis of CO2 and H2O in the power generation sector: A case study for South Korea
In: Energy reports, 6, 761-770, 2020
[DOI: 10.1016/j.egyr.2020.03.034]

[Fachzeitschriftenartikel]
Kuhnke, Sascha David; Richter, Pascal; Kepp, Fynn; Cumpston, Jeff; Koster, Arie Marinus; Büsing, Christina Maria Katharina
Robust optimal aiming strategies in central receiver systems
In: Renewable energy, 152, 198-207, 2019
[DOI: 10.1016/j.renene.2019.11.118]

[Fachzeitschriftenartikel]
Wang, Ganzhou; Mitsos, Alexander; Marquardt, Wolfgang
Renewable Production of Ammonia and Nitric Acid
In: AIChE journal, 6 (6), e16947, 2020
[DOI: 10.1002/aic.16947]

[Fachzeitschriftenartikel]
Saß, Susanne; Faulwasser, Timm; Hollermann, Dinah Elena; Kappatou, Chrysoula Dimitra; Sauer, Dominique; Schütz, Thomas; Shu, David Yang; Bardow, André; Gröll, Lutz; Hagenmeyer, Veit; Müller, Dirk; Mitsos, Alexander
Model compendium, data, and optimization benchmarks for sector-coupled energy systems
In: Computers & chemical engineering, 135, 106760, 2020
[DOI: 10.1016/j.compchemeng.2020.106760]

[Fachzeitschriftenartikel]
dos Santos Schultz, Eduardo; Hannemann-Tamás, Ralf; Mitsos, Alexander
Polynomial approximation of inequality path constraints in dynamic optimization
In: Computers & chemical engineering, 135, 106732, 2020
[DOI: 10.1016/j.compchemeng.2020.106732]

[Fachzeitschriftenartikel]
Rall, Deniz Patrick; Schweidtmann, Artur M.; Aumeier, Benedikt Maximilian; Kamp, Johannes; Karwe, Jannik; Ostendorf, Katrin; Mitsos, Alexander; Wessling, Matthias
Simultaneous rational design of ion separation membranes and processes
In: Journal of membrane science, 600, 117860, 2020
[DOI: 10.1016/j.memsci.2020.117860]

[Fachzeitschriftenartikel]
Marks, Caroline; König, Andrea; Mitsos, Alexander; Viell, Jörn
Minimal viable sugar yield of biomass pretreatment
In: Biofuels, bioproducts and biorefining, 14 (2), 301-314, 2020
[DOI: 10.1002/bbb.2074]

[Fachzeitschriftenartikel]
König, Andrea; Neidhardt, Lisa; Viell, Jörn; Mitsos, Alexander; Dahmen, Manuel
Integrated design of processes and products: Optimal renewable fuels
In: Computers & chemical engineering, 134, 106712, 2020
[DOI: 10.1016/j.compchemeng.2019.106712]

[Fachzeitschriftenartikel]
Schäfer, Pascal; Schweidtmann, Artur M.; Lenz, Philipp H. A.; Markgraf, Hannah M. C.; Mitsos, Alexander
Wavelet-based grid-adaptation for nonlinear scheduling subject to time-variable electricity prices
In: Computers & chemical engineering, 132, 106598, 2019
[DOI: 10.1016/j.compchemeng.2019.106598]

[Fachzeitschriftenartikel]
dos Santos Schultz, Eduardo; Hannemann-Tamás, Ralf; Mitsos, Alexander
Guaranteed satisfaction of inequality state constraints in PDE-constrained optimization
In: Automatica : a journal of IFAC, the International Federation of Automatic Control, 111, 108653, 2019
[DOI: 10.1016/j.automatica.2019.108653]

[Fachzeitschriftenartikel]
Clayton, Adam D.; Schweidtmann, Artur M.; Clemens, Graeme; Manson, Jamie A.; Taylor, Connor J.; Niño, Carlos G.; Chamberlain, Thomas W.; Kapur, Nikil; Blacker, A. John; Lapkin, Alexei; Bourne, Richard A.
Automated Self-Optimisation of Multi-Step Reaction and Separation Processes Using Machine Learning
In: The chemical engineering journal, 384, 123340, 2019
[DOI: 10.1016/j.cej.2019.123340]

[Buchbeitrag, Fachzeitschriftenartikel]
Aigner, Maximilian; Echtermeyer, Alexander Walter Wilhelm; Kaminski, Sebastian; Viell, Jörn; Leonhard, Kai; Mitsos, Alexander; Jupke, Andreas
Ternary System CO2/2-MTHF/Water : Experimental Study and Thermodynamic Modeling
In: Journal of chemical & engineering data, 65 (3), 993-1004, 2019
[DOI: 10.1021/acs.jced.9b00315]

[Fachzeitschriftenartikel]
Walz, Olga; Djelassi, Hatim; Mitsos, Alexander
Optimal experimental design for optimal process design : A trilevel optimization formulation
In: AIChE journal, 66 (1), e16788, 2019
[DOI: 10.1002/aic.16788]