[Journal Article]
Burre, Jannik; Bongartz, Dominik; Mitsos, Alexander
Production of Oxymethylene Dimethyl Ethers from Hydrogen and Carbon Dioxide : Part II: Modeling and Analysis for OME$_{3-5}$
In: Industrial & engineering chemistry research, 58 (14), 5567-5578, 2019
[DOI: 10.1021/acs.iecr.8b05577]

[Journal Article]
Djelassi, Hatim; Glass, Moll Helene; Mitsos, Alexander
Discretization-based algorithms for generalized semi-infinite and bilevel programs with coupling equality constraints
In: Journal of global optimization, 75 (2), 341-392, 2019
[DOI: 10.1007/s10898-019-00764-3]

[Journal Article]
Linzenich, Anika; Arning, Katrin; Bongartz, Dominik; Mitsos, Alexander; Ziefle, Martina
What fuels the adoption of alternative fuels? Examining preferences of German car drivers for fuel innovations
In: Applied energy, 249, 222-236, 2019
[DOI: 10.1016/j.apenergy.2019.04.041]

[Journal Article]
Kluge, Stefanie; Bonhage, Benjamin; Viell, Jörn; Granström, Mari; Kindler, Alois; Spieß, Antje
Enzymatic production of cello-oligomers with endoglucanases
In: Cellulose, 26 (7), 4279-4290, 2019
[DOI: 10.1007/s10570-019-02390-4]

[Contribution to a book, Journal Article]
Daoutidis, Prodromos; Mitsos, Alexander
AIChE Journal Special PSE Issue on Sustainable Energy
In: AIChE journal, 65 (7), e16630, 2019
[DOI: 10.1002/aic.16630]

[Journal Article]
Amar, Yehia; Schweidtmann, Artur M.; Deutsch, Paul; Cao, Liwei; Lapkin, Alexei
Machine learning and molecular descriptors enable rational solvent selection in asymmetric catalysis
In: Chemical science, 10 (27), 6697-6706, 2019
[DOI: 10.1039/C9SC01844A]

[Journal Article]
Holtorf, Flemming; Mitsos, Alexander; Biegler, Lorenz T.
Multistage NMPC with on-line generated scenario trees: Application to a semi-batch polymerization process
In: Journal of process control, 80, 167-179, 2019
[DOI: 10.1016/j.jprocont.2019.05.007]

[Journal Article]
Caspari, Adrian; Offermanns, Christoph; Schäfer, Pascal; Mhamdi, Adel; Mitsos, Alexander
A flexible air separation process : 1. Design and steady‐state optimizations
In: AIChE journal, 65 (11), e16705, 2019
[DOI: 10.1002/aic.16705]

[Journal Article]
Joy, Preet Joseph; Djelassi, Hatim; Mhamdi, Adel; Mitsos, Alexander
Optimization-based global structural identifiability
In: Computers & chemical engineering, 128, 417-420, 2019
[DOI: 10.1016/j.compchemeng.2019.06.019]

[Journal Article]
Roh, Kosan; Al‐Hunaidy, Ali S.; Imran, Hasan; Lee, Jay H.
Optimization‐based identification of CO2 capture and utilization processing paths for life cycle greenhouse gas reduction and economic benefits
In: AIChE journal, 65 (7), e16580, 2019
[DOI: 10.1002/aic.16580]

[Journal Article]
Caspari, Adrian; Offermanns, Christoph; Schäfer, Pascal; Mhamdi, Adel; Mitsos, Alexander
A Flexible Air Separation Process: 2. Optimal Operation using Economic Model Predictive Control
In: AIChE journal, 65 (11), e16721, 2019
[DOI: 10.1002/aic.16721]

[Contribution to a conference proceedings, Journal Article]
Holtorf, Flemming; Mitsos, Alexander; Biegler, Lorenz T.
Adaptive Scenario Generation for Multistage NMPC with Shrinking Horizons
In: IFAC-PapersOnLine, 52 (1), 586-591, 2019
[DOI: 10.1016/j.ifacol.2019.06.126]

[Contribution to a conference proceedings, Journal Article]
Jung, Falco Constantin; Caspari, Adrian; Mhamdi, Adel; Mitsos, Alexander
Set-Membership Parameter Estimation: Improved Understanding of Microgel Polymerization
In: IFAC-PapersOnLine, 52 (1), 580-585, 2019
[DOI: 10.1016/j.ifacol.2019.06.125]

[Contribution to a conference proceedings, Journal Article]
Jung, Falco Constantin; Janssen, Franca Alisa Laura; Caspari, Adrian; Spütz, Hendrik; Kröger, Leif Christian; Leonhard, Kai; Mhamdi, Adel; Mitsos, Alexander
Dynamic Optimization of a Fed-Batch Microgel Synthesis
In: IFAC-PapersOnLine, 52 (1), 394-399, 2019
[DOI: 10.1016/j.ifacol.2019.06.094]

[Journal Article]
Luo, Jiu; Yang, Qing-Qing; Lu, Shuai; Mhamdi, Adel; Mo, Dong-Chuan; Lyu, Shu-Shen; Heng, Yi
A novel formulation and sequential solution strategy with time-space adaptive mesh refinement for efficient reconstruction of local boundary heat flux
In: International journal of heat and mass transfer, 141, 1288-1300, 2019
[DOI: 10.1016/j.ijheatmasstransfer.2019.05.094]

[Contribution to a conference proceedings, Journal Article]
Huster, Wolfgang Raphael; Schweidtmann, Artur M.; Mitsos, Alexander
Working fluid selection for organic rankine cycles via deterministic global optimization of design and operation
In: Optimization and engineering, 21 (2), 517-536, 2019
[DOI: 10.1007/s11081-019-09454-1]

[Journal Article]
Najman, Jaromil; Mitsos, Alexander
Tighter McCormick relaxations through subgradient propagation
In: Journal of global optimization, 75 (3), 565-593, 2019
[DOI: 10.1007/s10898-019-00791-0]

[Journal Article]
Najman, Jaromil; Bongartz, Dominik; Mitsos, Alexander
Convex Relaxations of Componentwise Convex Functions
In: Computers & chemical engineering : CACE, 130, 106527, 2019
[DOI: 10.1016/j.compchemeng.2019.106527]

[Journal Article]
Oh, Jaewoo; Jung, Dabin; Oh, Seung Hwan; Roh, Kosan; Ga, Seongbin; Lee, Jay H.
Design, simulation and feasibility study of a combined CO2 mineralization and brackish water desalination process
In: Journal of CO2 utilization, 34, 446-464, 2019
[DOI: 10.1016/j.jcou.2019.07.004]

[Contribution to a book, Journal Article]
Tsichla, Angeliki; Severins, Christian; Gottfried, Michael; Marquardt, Wolfgang
An Experimental Assessment of Model-Based Solvent Selection for Enhancing Reaction Kinetics
In: Industrial & engineering chemistry research, 58 (30), 13517-13532, 2019
[DOI: 10.1021/acs.iecr.9b01040]

[Journal Article]
Faust, Johannes Michael Magnus; Chalupka, Tomas; Kosek, Juraj; Mhamdi, Adel; Mitsos, Alexander
Dynamic optimization of an emulsion copolymerization process for product quality using a deterministic kinetic model with embedded Monte Carlo simulations
In: Computers & chemical engineering, 130, 106566, 2019
[DOI: 10.1016/j.compchemeng.2019.106566]

[Journal Article]
Najman, Jaromil; Bongartz, Dominik; Mitsos, Alexander
Relaxations of thermodynamic property and costing models in process engineering
In: Computers & chemical engineering : CACE, 130 (2), 106571, 2019
[DOI: 10.1016/j.compchemeng.2019.106571]

[Journal Article]
Marks, Caroline; Mitsos, Alexander; Viell, Jörn
Change of C(2)-Hydrogen-Deuterium Exchange in Mixtures of EMIMAc
In: Journal of solution chemistry, 48 (8/9), 1188-1205, 2019
[DOI: 10.1007/s10953-019-00899-7]

[Journal Article]
Roh, Kosan; Brée, Luisa Carola; Perrey, Karen; Bulan, Andreas; Mitsos, Alexander
Flexible operation of switchable chlor-alkali electrolysis for demand side management
In: Applied energy, 255, 113880, 2019
[DOI: 10.1016/j.apenergy.2019.113880]

[Journal Article]
Schäfer, Pascal; Caspari, Adrian; Mhamdi, Adel; Mitsos, Alexander
Economic nonlinear model predictive control using hybrid mechanistic data-driven models for optimal operation in real-time electricity markets : In-silico application to air separation processes
In: Journal of process control, 84, 171-181, 2019
[DOI: 10.1016/j.jprocont.2019.10.008]

[Contribution to a book, Journal Article]
Burre, Jannik; Bongartz, Dominik; Brée, Luisa Carola; Roh, Kosan; Mitsos, Alexander
Power‐to‐X : Between Electricity Storage, e‐Production, and Demand Side Management
In: Chemie - Ingenieur - Technik : CIT, 92 (1/2), 74-84, 2019
[DOI: 10.1002/cite.201900102]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]

[Journal Article]
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]