[Journal Article]
Linkhorst, John; Lölsberg, Jonas; Thill, Sebastian; Lohaus, Johannes; Lüken, Arne Can; Naegele, Gerhard; Wessling, Matthias
Templating the morphology of soft microgel assemblies using a nanolithographic 3D-printed membrane
In: Scientific reports, 11, 812, 2021
[DOI: 10.1038/s41598-020-80324-y]

[Journal Article]
Vaupel, Yannic; Schulze, Jan Christoph; Mhamdi, Adel; Mitsos, Alexander
Nonlinear model predictive control of organic Rankine cycles for automotive waste heat recovery : Is it worth the effort?
In: Journal of process control, 99, 19-27, 2021
[DOI: 10.1016/j.jprocont.2021.01.003]

[Book, Dissertation / PhD Thesis]
Caspari, Adrian
Optimal flexible operation of dynamic processes
In: Aachener Verfahrenstechnik Series, Process Systems Engineering 14, 2021
[DOI: 10.18154/RWTH-2021-01325]

[Contribution to a book, Contribution to a conference proceedings]
Schulze, Jan Christoph; Caspari, Adrian; Schäfer, Pascal; Ecker, Anna M.; Pottmann, Martin; Mhamdi, Adel; Mitsos, Alexander
Nonlinear Model Predictive Control of Air Separation Processes based on Model Reduction
In: 2020 Virtual AIChE Annual Meeting proceedings, 2021

[Journal Article]
Doeker, Moritz Paul Ferdinand; Hüttche, Vincent; Jupke, Andreas
Reactive extraction for the recovery of primary amines from aqueous streams
In: Separation and purification technology, 260C, 118229 -, 2021
[DOI: 10.1016/j.seppur.2020.118229]

[Journal Article]
Felton, Kobi C.; Rittig, Jan Gerald; Lapkin, Alexei A.
Summit: Benchmarking Machine Learning Methods for Reaction Optimisation
In: Chemistry methods, 1 (2), 116-122, 2021
[DOI: 10.1002/cmtd.202000051]

[Contribution to a book, Journal Article]
Hemmerich, Johannes; Tenhaef, Niklas; Wiechert, Wolfgang; Noack, Stephan
pyFOOMB: Python framework for object oriented modeling of bioprocesses
In: Engineering in life sciences, 21 (3/4), 242-257, 2021
[DOI: 10.1002/elsc.202000088]

[Journal Article]
Faust, Johannes Michael Magnus; Hamzehlou, Shaghayegh; Leiza, Jose R.; Asua, José M.; Mhamdi, Adel; Mitsos, Alexander
Closed-loop in-silico control of a two-stage emulsion polymerization to obtain desired particle morphologies
In: The chemical engineering journal, 414, 128808, 2021
[DOI: 10.1016/j.cej.2021.128808]

[Journal Article]
Pistikopoulos, E. N.; Barbosa-Povoa, Ana; Lee, Jay H.; Misener, Ruth; Mitsos, Alexander; Reklaitis, G. V.; Venkatasubramanian, V.; You, Fengqi; Gani, Rafiqul
Process systems engineering : The generation next?
In: Computers & chemical engineering : CACE, 147, 107252, 2021
[DOI: 10.1016/j.compchemeng.2021.107252]

[Journal Article]
Najman, Jaromil; Bongartz, Dominik; Mitsos, Alexander
Linearization of McCormick relaxations and hybridization with the auxiliary variable method
In: Journal of global optimization, 80 (4), 731-756, 2021
[DOI: 10.1007/s10898-020-00977-x]

[Journal Article]
Djelassi, Hatim; Mitsos, Alexander
Global Solution of Semi-infinite Programs with Existence Constraints
In: Journal of optimization theory and applications, 188 (3), 863-881, 2021
[DOI: 10.1007/s10957-021-01813-2]

[Journal Article]
Habicher, Tobias; Klein, Tobias; Becker, Jacqueline; Daub, Andreas; Büchs, Jochen
Screening for optimal protease producing Bacillus licheniformis strains with polymer-based controlled-release fed-batch microtiter plates
In: Microbial cell factories, 20 (1), 51, 2021
[DOI: 10.1186/s12934-021-01541-2]

[Dissertation / PhD Thesis]
Jung, Falco Constantin
Model-based synthesis of functional microgels
, 2021
[DOI: 10.18154/RWTH-2021-02166]

[Journal Article]
Emonds, Stephan Christian; Kamp, Johannes; Borowec, Julian; Roth, Hannah; Wessling, Matthias
Polyelectrolyte Complex Tubular Membranes via a Salt Dilution Induced Phase Inversion Process
In: Advanced engineering materials, 23 (5), 2001401, 2021
[DOI: 10.1002/adem.202001401]

[Journal Article]
Vaupel, Yannic; Huster, Wolfgang Raphael; Mhamdi, Adel; Mitsos, Alexander
Optimal operating policies for organic Rankine cycles for waste heat recovery under transient conditions
In: Energy : the international journal, 224, 120126, 2021
[DOI: 10.1016/j.energy.2021.120126]

[Book, Dissertation / PhD Thesis]
Masilamani, Kannan
Framework for coupled simulation of electrodialysis processes
In: Simulation techniques in Siegen - STS 4, 2021
[DOI: 10.18154/RWTH-2021-02437]

[Book, Dissertation / PhD Thesis]
König, Andrea
Design of optimal alternative fuels and their production processes
In: Aachener Verfahrenstechnik series - AVT.SVT - Process systems engineering 17, 2021
[DOI: 10.18154/RWTH-2021-02840]

[Journal Article]
Mohseni, Mojtaba; Demeestere, Kristof; Du Laing, Gijs; Yüce, Süleyman; Keller, Robert Gregor; Wessling, Matthias
CNT Microtubes with Entrapped Fe$_{3}$O$_{4}$ Nanoparticles Remove Micropollutants through a Heterogeneous Electro‐Fenton Process at Neutral pH
In: Advanced sustainable systems, 5 (4), 2100001, 2021
[DOI: 10.1002/adsu.202100001]

[Journal Article]
Caspari, Adrian; Djelassi, Hatim; Mhamdi, Adel; Biegler, Lorenz T.; Mitsos, Alexander
Semi-infinite programming yields optimal disturbance model for offset-free nonlinear model predictive control
In: Journal of process control, 101, 35-51, 2021
[DOI: 10.1016/j.jprocont.2021.03.005]

[Journal Article]
Mann, Marcel; Hüser, Aline; Schick, Benjamin; Dinger, Robert; Miebach, Katharina; Büchs, Jochen
Online monitoring of gas transfer rates during CO and CO/H2 gas fermentation in quasi‐continuously ventilated shake flasks
In: Biotechnology & bioengineering, 118 (5), 2092-2104, 2021
[DOI: 10.1002/bit.27722]

[Journal Article]
Wünsch, Robin; Mayer, Carina; Plattner, Julia; Eugster, Fabienne; Wülser, Richard; Gebhardt, Jens; Hübner, Uwe; Canonica, Silvio; Wintgens, Thomas Josef; von Gunten, Urs
Micropollutants as internal probe compounds to assess UV fluence and hydroxyl radical exposure in UV/H$_{2}$O$_{2}$ treatment
In: Water research, 195, 116940, 2021
[DOI: 10.1016/j.watres.2021.116940]

[Poster]
Krep, Lukas; Huang, Can; Kopp, Wassja Alexander; Leonhard, Kai
Exploring the Reaction Network of 1, 3-Dioxolane-Hydroperoxide Radical Low-Temperature Oxidation with a Novel Molecular Dynamics Acceleration Technique
In: 10th European Combustion Meeting online 2021-04-14 - 2021-04-15, 2021

[Poster]
Kopp, Wassja Alexander; Schmalz, Felix; Krep, Lukas; Dietze, Patrik; Leonhard, Kai
Analysis of recrossing in molecular dynamics simulations from energy fluctuations
In: 10th European Combustion Meeting online 2021-04-14 - 2021-04-15, 2021

[Poster]
Roy, Indu Sekhar; Huang, Can; Leonhard, Kai
Reaction Kinetics for low-temperature oxidation of 1,3-dioxolane
In: 10th European Combustion Meeting online 2021-04-14 - 2021-04-15, 2021

[Multimedia]
Faust, Johannes Michael Magnus; Schulze, Jan Christoph; Caspari, Adrian; Hannemann-Tamás, Ralf; Saß, Susanne; Mhamdi, Adel; Mitsos, Alexander
DyOS: A Software Package for Dynamic Optimization using Direct Shooting
In: [AVT-Research Video] [9], 2021
[DOI: 10.18154/RWTH-2021-04237]

[Dissertation / PhD Thesis]
Mann, Marcel
Online monitoring devices for lab scale synthesis gas fermentation using the model acetogen Clostridium Ijungdahlii
, 2021

[Contribution to a book, Contribution to a conference proceedings]
Kleinekorte, Johanna; Beckert, Verena; Fleitmann, Lorenz Heinrich Johannes; Kröger, Leif Christian; Leonhard, Kai; Bardow, André
Predictive Life Cycle Assessment with Limited Training Data : Artificial Neural Networks Vs. Gaussian Process Regression
In: 2020 Virtual AIChE Annual Meeting proceedings, 2021

[Journal Article]
Schweidtmann, Artur M.; Weber, Jana M.; Wende, Christian; Netze, Linus; Mitsos, Alexander
Obey validity limits of data-driven models through topological data analysis and one-class classification
In: Optimization and engineering, 22 Seiten, 2021
[DOI: 10.1007/s11081-021-09608-0]

[Journal Article]
Wessling, Matthias
Letter to the Editor: In memory of Kees Smolders
In: Journal of membrane science, 628, 119237, 2021
[DOI: 10.1016/j.memsci.2021.119237]

[Journal Article]
Bachmann, Rolf; Klinger, Marcel; Jupke, Andreas
Molcular Weight Distribution in Di Metal Cyanide Catalyzed Polymerization 1: Fundamental Distribution for Length Dependent Propagation Constant and Segments
In: Macromolecular theory and simulations, 30 (5), 2100012, 2021
[DOI: 10.1002/mats.202100012]

[Book, Dissertation / PhD Thesis]
Janssen, Franca Alisa Laura
Modeling and prediction of microgel synthesis : conversion, growth and structure
In: Aachener Verfahrenstechnik series - AVT.SVT - Process systems engineering 15 (2021), 2021

[Book, Dissertation / PhD Thesis]
Al-Mahri, Badr Abdulla Salem Bin Ashoor
Mechanistic modeling and experimental analysis of direct contact membrane distillation for seawater desalination
In: Berichte aus der Verfahrenstechnik, 2021
[DOI: 10.18154/RWTH-2021-05019]

[Journal Article]
Luo, Tao; Zhong, Yanjun; Xu, Dehua; Wang, Xinlong; Wessling, Matthias
Combining Manning's theory and the ionic conductivity experimental approach to characterize selectivity of cation exchange membranes
In: Journal of membrane science, 629, 119263, 2021
[DOI: 10.1016/j.memsci.2021.119263]

[Journal Article]
Linz, Georg Franz; Rauer, Sebastian Bernhard; Kuhn, Yasmin; Wennemaring, Simon; Siedler, Laura; Singh, Smriti; Wessling, Matthias
3D-Printed Bioreactor with Integrated Impedance Spectroscopy for Cell Barrier Monitoring
In: Advanced materials technologies, 6 (6), 2100009, 2021
[DOI: 10.1002/admt.202100009]

[Book, Dissertation / PhD Thesis]
Percin, Korcan
Slurry-based electrodes for vanadium redox flow battery
In: Aachener Verfahrenstechnik series - AVT.CVT - chemical process engineering 15 (2021), 2021
[DOI: 10.18154/RWTH-2021-05314]

[Dataset]
Hirschwald, Lukas Tobias; Herrmann, Stefan; Felder, Daniel; Kalde, Anna Maria; Stockmeier, Felix; Wypysek, Denis Mathias; Alders, Michael Theo; Tepper, Maik; Rubner, Jens; Brand, Peter; Kraus, Thomas; Wessling, Matthias; Linkhorst, John
Dataset to "Discrepancy of particle passage in 101 mask batches during the first year of the Covid-19 pandemic in Germany"
, 2021
[DOI: 10.18154/RWTH-2021-05390]

[Journal Article]
Langiu, Marco; Shu, David Yang; Baader, Florian Joseph; Hering, Dominik; Bau, Uwe; Xhonneux, André; Müller, Dirk; Bardow, André; Mitsos, Alexander; Dahmen, Manuel
COMANDO: A Next-Generation Open-Source Framework for Energy Systems Optimization
In: Computers & chemical engineering, 152, 107366, 2021
[DOI: 10.1016/j.compchemeng.2021.107366]

[Book, Dissertation / PhD Thesis]
Schweidtmann, Artur M.
Global optimization of processes through machine learning
In: Aachener Verfahrenstechnik Series AVT.SVT - Process Systems Engineering 18, 2021
[DOI: 10.18154/RWTH-2021-05536]

[Journal Article]
Fleitmann, Lorenz Heinrich Johannes; Kleinekorte, Johanna; Leonhard, Kai; Bardow, André
COSMO-susCAMPD : Sustainable Solvents from Combining Computer-Aided Molecular and Process Design with Predictive Life Cycle Assessment
In: Chemical engineering science, 116863, 2021
[DOI: 10.1016/j.ces.2021.116863]

[Journal Article]
Wei, Xin; Pu, Minghua; Jin, Yiman; Wessling, Matthias
Efficient Electrocatalytic N 2 Reduction on Three-Phase Interface Coupled in a Three-Compartment Flow Reactor for the Ambient NH 3 Synthesis
In: ACS applied materials & interfaces, 13 (18), 21411-21425, 2021
[DOI: 10.1021/acsami.1c03698]

[Journal Article]
Höller, Martin; Lunze, Anne; Wever, Christian; Deutschle, Alexander L.; Stücker, Alexander; Frase, Niklas; Pestsova, Elena; Spiess, Antje C.; Westhoff, Peter; Pude, Ralf
Meadow hay, Sida hermaphrodita (L.) Rusby and Silphium perfoliatum L. as potential non-wood raw materials for the pulp and paper industry
In: Industrial crops and products, 167, 113548, 2021
[DOI: 10.1016/j.indcrop.2021.113548]

[Journal Article]
Wypysek, Denis Mathias; Rall, Deniz Patrick; Neef, Tobias; Jarauta, Alex; Secanell, Marc; Wessling, Matthias
How does porosity heterogeneity affect the transport properties of multibore filtration membranes?
In: Journal of membrane science, 636, 119520, 2021
[DOI: 10.1016/j.memsci.2021.119520]

[Journal Article]
Schweidtmann, Artur M.; Bongartz, Dominik; Grothe, Daniel; Kerkenhoff, Tim; Lin, Xiaopeng; Najman, Jaromil; Mitsos, Alexander
Deterministic global optimization with Gaussian processes embedded
In: Mathematical programming computation : MPC, 13 (3), 553-581, 2021
[DOI: 10.1007/s12532-021-00204-y]

[Book, Dissertation / PhD Thesis]
Keller, Robert Gregor
Fenton’s chemistry in biorefineries
In: Aachener Verfahrenstechnik Series 14 (2021), 2021
[DOI: 10.18154/RWTH-2021-06495]

[Journal Article]
Gausmann, Marcel; Kocks, Christian Uwe; Pastoors, Johannes Tilmann; Büchs, Jochen; Wierckx, Nick; Jupke, Andreas
Electrochemical pH-T-Swing Separation of Itaconic Acid for Zero Salt Waste Downstream Processing
In: ACS sustainable chemistry & engineering, 9 (28), 9336-9347, 2021
[DOI: 10.1021/acssuschemeng.1c02194]

[Journal Article]
König, Andrea; Siska, Maximilian; Schweidtmann, Artur M.; Rittig, Jan Gerald; Viell, Jörn; Mitsos, Alexander; Dahmen, Manuel
Designing production-optimal alternative fuels for conventional, flexible-fuel, and ultra-high efficiency engines
In: Chemical engineering science = Génie chimique, 237, 116562, 2021
[DOI: 10.1016/j.ces.2021.116562]

[Contribution to a book, Contribution to a conference proceedings]
Bongartz, Dominik; Burre, Jannik; Ziegler, Anita Lisa; Mitsos, Alexander
Power-to-OME1 via Direct Oxidation of Methanol : Process Design and Global Flowsheet Optimization
In: 31th European Symposium on Computer Aided Process Engineering : ESCAPE-31 / edited by Metin Türkay and Rafiqul Gani, 273-278, 2021
[DOI: 10.1016/B978-0-323-88506-5.50044-9]

[Journal Article]
Evdochenko, Elizaveta; Kamp, Johannes; Dunkel, Richard; Nikonenko, V. V.; Wessling, Matthias
Charge distribution in polyelectrolyte multilayer nanofiltration membranes affects ion separation and scaling propensity
In: Journal of membrane science, 636, 119533, 2021
[DOI: 10.1016/j.memsci.2021.119533]

[Journal Article]
Kovalenko, A. V.; Wessling, Matthias; Nikonenko, V. V.; Mareev, S. A.; Moroz, I. A.; Evdochenko, Elizaveta; Urtenov, M. Kh
Space-Charge breakdown phenomenon and spatio-temporal ion concentration and fluid flow patterns in overlimiting current electrodialysis
In: Journal of membrane science, 636, 119583, 2021
[DOI: 10.1016/j.memsci.2021.119583]

[Journal Article]
Linz, Georg Franz; Rauer, Sebastian Bernhard; Stüwe, Lucas Maximilian; Bell, Daniel Josef; Rausch, Markus; Wessling, Matthias
Tollens Reaction-Based Integration of Thin Film Wall Electrodes into Microfluidic PDMS Devices
In: Advanced materials technologies, 6 (10), 2100250, 2021
[DOI: 10.1002/admt.202100250]