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Projects for the second funding period 12/2021 - 12/2024
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1. Project: Iron-based catalysts for CO2 conversion into higher hydrocarbons under dynamic conditions
Subproject 1: Kinetic and mechanistic studies of CO2 hydrogenation under dynamic and steady-state conditions
Contact: PD Dr. E. V. Kondratenko, Leibniz-Institut für Katalyse e.V. an der Universität Rostock
Subproject 2: Operando monitoring of changes in catalyst composition and development of cells/reactors
Contact: Prof. Dr. A. Brückner, Leibniz-Institut für Katalyse e.V. an der Universität Rostock
Subproject 3: Mesoporous iron oxides as a model system to study reaction-induced phase transformations in CO2-Fischer-Tropsch-Synthesis
Contact: Prof. Dr. Nicola Pinna, Humboldt-Universität zu Berlin
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2. Project: Analysis of forced periodic operation of chemical reactors considering methanol synthesis as an example
Subproject 1: Nonlinear frequency response analysis of forced periodic reactor operation
Contact: Dr. Daliborka Nikolic Paunic, University of Belgrade
Subproject 2: Dynamic optimization of forced periodic reactor operation
Contact: Prof. Dr.-Ing. Achim Kienle, Otto von Guericke University Magdeburg
Subproject 3: Experimental study of forced periodic reactor operation
Contact: Prof. Dr.-Ing. Andreas Seidel-Morgenstern, Max Planck Institute for Dynamics of Complex Technical Systems, Magdeburg
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3. Project: Tackling irreversible catalyst deactivation: knowledge-driven design and operation of dynamic responsive methanation catalysts
Subproject 1: Methods and models for deriving optimal operations policies for dynamic methanation from model-based optimization and kinetic measurements
Contact: Prof. Dr.-Ing. Hannsjörg Freund, Technische Universität Dortmund
Subproject 2: Development of dynamic responsive methanation catalysts and catalytic studies under forced dynamics
Contact: Prof. Dr. Tanja Franken, Friedrich-Alexander-Universität Erlangen Nürnberg
Subproject 3: Spatial and temporal resolved operando analysis of methanation catalysts under transient and deactivating operating conditions
Contact: Dr.-Ing. Michael Rubin, Karlsruher Institut für Technologie (KIT) , Eggenstein-Leopoldshafen
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4. Project: REALCO2DYN-X2: MOF-derived CO2 methanation catalysts –Mechanisms, activity and stability during industrially relevant, dynamic dropout scenarios using hard X-ray techniques
Subproject 1: Catalyst design, kinetic measurements and activity studies during various dropout scenarios
Contact: Prof. Dr. Wolfgang Kleist, TU Kaiserslautern
Subproject 2: Synchrotron high resolution X-ray spectroscopy for structural dynamics during drop out scenarios
Contact: Prof. Dr. Matthias Bauer, Universität Paderborn
Subproject 3: Dynamic in-situ PDF experiments of catalysis and dropout conditions
Contact: Prof. Dr. Mirijam Zobel, RWTH Aachen University
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5. Project: Degradation-control of perovskite oxide OER catalysts under dynamic operation conditions via advanced operando characterization and orbital-d-band engineering
Subproject 1: Synthesis, 3d band engineering and electrochemical benchmarking of the stability and ageing of epitaxial perovskite catalysts
Contact: Dr. Felix Gunkel, Forschungszentrum Jülich GmbH
Subproject 2: Analysis of active sites, surface transormations and morphology changes under dynamic operation conditons by sophisticated scannning probe microscopies
Contact: Dr. Florian Hausen, Forschungszentrum Jülich GmbH
Subproject 3: Ambient pressure NEXAFS and CTM calculations unraveling the elctronic structure and active sites of epitaxial perovskite catalysts for 3d band engineering
Contact: Dr. Karin Kleiner, Westfälische Wilhelms-Universität Münster
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6. Project: Stabilization of the RuO2 water splitting electrocatalyst under dynamic operating conditions by surface modification
Subproject 1: Theoretical studies of corrosion under dynamic potential conditions; ab initio thermodynamics and Kinetic Monte Carlo methods
Contact: Prof. Dr. Franziska Hess, Institut für Chemie, Fakultät II, Technische Universität Berlin
Subproject 2: Preparation, characterization, and corrosion experiments of RuO2-based model electrodes with and without protecting decoration
Contact: Prof. Dr. Herbert Over, Justus Liebig Universität Gießen
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7. Project: Dynamically driven rutile-based acidic oxygen evolution electrocatalysts beyond stationary efficiency (DaCapo)
Subproject 1: Atomic-scale simulations of electrocatalytic OER under dynamic oscillating conditions: develpoment of Kinetic Monte Carlo Methods and study of dynamic behavior
Contact: Prof. Dr. Franziska Hess, Institut für Chemie, Technische Universität Berlin
Subproject 2:Atomic and electronic structure prerequisites for catalytic resonance in the acidic O2 evolution reaction: UHV surface science and operando studies on well-defined rutile model system
Contact: Prof. Dr. Jan Philipp Hofmann, Fachgebiet Oberflächenforschung, Fachbereich Material- und Geowissenschaften, TU Darmstadt
Subproject 3: Studies on electrocatalytic resonance phenomena on polycrystalline and nanostructured Ir/Ru oxides
Contact: Prof. Dr. Peter Strasser, Institut für Chemie, TU Berlin
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8. Project: Design and in-depth investigation of nanostructured catalysts for CO2 electroreduction
Subproject 1: Catalytic investigations and time-resolved operando spectroscopy
Contact: Prof. Dr. Beatriz Roldan Cuenya, Fritz-Haber Institut
Subproject 2: Atomic-scale interface structure
Contact: Prof. Dr. Olaf Magnussen, Christian-Albrechts-Universität zu Kiel
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9. Project: Surface dynamics of reducible-oxide promoted inverse Ni and Cu catalysts: New concepts for CO2-hydrogenation
Subproject 1: Co-precipitation of MgO-supported MOx/TM inverse model catalysts (M=Zn, Ga; TM=Ni,Cu)
Contact: Prof. Dr. Malte Behrens, Christian-Albrechts-Universität zu Kiel
Subproject 2: In situ and operando spectroscopy during CO2-hydrogenation over oxide promoted inversse Cu and Ni catalysts
Contact: Prof. Dr. Jan-Dierk Grunwaldt, Karlsruher Institut für Technologie (KIT)
Subproject 3: Theoretical simulations of oxide prmoted inverse Cu and Ni catalysts for CO2 hydrogenation
Contact: Prof. Dr. Felix Studt, Karlsruher Institut für Technologie (KIT)
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10. Project: Sorption-Enhanced CO2 Hydrogenation to Methanol under Dynamic Reaction Conditions
Subproject 1: Novel Porous Materials for CO2 Sorption and Conversion to Methanol
Contact: Prof. Dr. Roger Gläser, Universität Leipzig
Subproject 2: Surface chemistry and kinetic studies during hydrogenation of CO2 to methanol under dynamic reaction conditions
Contact: Prof. Dr. Andreas Jentys, Technische Universität München
Subproject 3: Multiscale Modeling of Sorption and Conversion of CO2 for Methanol Production on Bifunctional Catalysts
Contact: Prof. Dr. Olaf Deutschmann, Karlsruhe Institute of Technology (KIT)
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11. Project: Temporally and spatially resolved non intrusive measurement of temperature and species concentration profiles during catalytic production of synthetic methane in open cell foam catalysts (CARS4KAT)
Subproject 1: Temporally and spatially resolved non instrusive measurement of temperature and species concentration profiles during catalytic production of synthetic methane in open cell foam catalysts (CARS4KAT)
Contact: Prof. Dr.-Ing. Wolfgang Krumm, Universität Siegen, Institut für Energietechnik, Siegen
Contact: Prof Dr.-Ing. Thomas Seeger, Universität Siegen, Institut Fluid- und Thermodynamik, Siegen
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12. Project: Structural Evolution of a High-Temperature Oxygen Evolution Catalyst under Transient Working Conditions
Subproject 1: Fabrication and electrochemical characterization of SOECs
Contact: Prof. Dr. Rüdiger Eichel, Research Centre Jülich GmbH
Subproject 2: In situ and operando charaterization of SOECs
Contact: Dr. Thomas Lunkenbein, Fritz-Haber-Institut der Max-Planck-Gesellschaft (FHI), Berlin
Subproject 3: Structural evolution of SOECs by first-principles modeling
Contact: Dr. Christoph Scheurer, Fritz-Haber-Institut der Max-Planck-Gesellschaft (FHI), Berlin
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Projects for the first funding period 2018-2021
1. Project : Structure-activity relationships on Ir-Ru electrodes for OER under dynamic conditions
Subproject 1 : Model-based analysis of structure-activity relationships on Ir-Ru electrodes
Contact: Prof. Dr.-Ing. Ulrike Krewer, Karlsruhe Institute of Technology (KIT)
Subproject 2 : Material development and spectroscopy on Ir-Ru electrodes for OER
Contact: Prof. Dr. Jan-Dierk Grunwaldt, Karlsruhe Institute of Technology (KIT)
Subproject 3 : Advanced characterization of activity and stability of Ir-Ru electrodes for OER
Contact: Dr. Serhiy Cherevko, Forschungszentrum Jülich GmbH and Helmholtz-Institute Erlangen-Nürnberg for Renewable Energy
2. Project : Iron-based catalysts for CO2 conversion into higher hydrocarbons under dynamic conditions
Subproject 1 : Kinetic and mechanistic studies of CO2 hydrogenation under dynamic and steady-state conditions
Contact: PD Dr. E. V. Kondratenko, Leibniz Institute for Catalysis eV at the University of Rostock
Subproject 2 : Operando monitoring of changes in catalyst composition and development of cells / reactors
Contact: Prof. Dr. A. Brückner, Leibniz Institute for Catalysis eV at the University of Rostock
Subproject 3 : Synthesis and phase transformations of nanostructured iron oxides
Contact: Dr.-Ing. Ralph Krähnert, Technical University Berlin
3. Project : Analysis of forced periodic modes of operation of chemical reactors using the example of methanol synthesis
Subproject 1 : Nonlinear frequency response analysis of forced periodic reactor operation
Contact: Prof. Dr.-Ing. Menka Petkovska, University of Belgrade
Subproject 2 : Dynamic optimization of forced periodic reactor operation
Contact: Prof. Dr.-Ing. Achim Kienle, Otto von Guericke University Magdeburg
Subproject 3 : Experimental study of forced periodic reactor operation
Contact: Prof. Dr.-Ing. Andreas Seidel-Morgenstern, Max Planck Institute for Dynamics of Complex Technical Systems, Magdeburg
4 Project : Multiscale Analysis and Rational Design of Dynamically Operated Integrated Catalyst-Reactor Systems for Methanation of CO 2
Subproject 1 : Multiscale modeling of catalyst and reactor dynamics / Experiments under dynamic conditions - Design of perturbation experiments
Contact: Prof. Dr.-Ing. habil. Kai Sundmacher, Otto von Guericke University Magdeburg
Subproject 2 : Defining structure, form and function of dynamically-operated catalysts for methanation of CO 2 using operando spectroscopy and synchrotron radiation
Contact: Dr. Thomas Sheppard, Karlsruhe Institute of Technology (KIT)
Subproject 3 : Design and preparation of monolithic catalysts with defined porosity / Experiments under dynamic conditions - Sorption, diffusion and catalytic activity
Contact: Prof. Dr. Roger Gläser, Leipzig University
5. Project : MOFCO 2 DYN-X 2 : New CO 2 methanation catalysts from MOF precursors - Structures and mechanisms under dynamic conditions by combination of (synchrotron-based) hard X-ray techniques
Subproject 1 : Catalyst synthesis and methanation studies under dynamic conditions
Contact: Prof. Dr. Wolfgang Kleist, TU Kaiserslautern
Subproject 2 : Mechanistic operando investigations using (HERFD-) XAS and XES
Contact: Prof. Dr. Matthias Bauer, University of Paderborn
Subproject 3 : Ex-situ and in-operando PDF investigations of short- and medium-range order
Contact: Prof. Dr. Mirijam Zobel, University of Bayreuth
6. Project : Influence of dynamic operating conditions on the electrolytic hydrogen production
Subproject 1 : Experimental investigations
Contact: Prof. Dr. Herbert Over, Justus Liebig University of Gießen
Subproject 2 : Theoretical multiscale calculations and electrochemical investigations
Contact: Prof. Dr. Timo Jacob, Ulm University
7. Project : Time and location resolved in operando analyzes using microstructured model reactors for the kinetic description of the methanation reaction, taking catalyst deactivation and dynamic operating conditions into account
Subproject 1 : Modeling and multiscale simulation to describe the methanation kinetics, taking catalyst deactivation and dynamic operating conditions into account
Contact: Prof. Dr.-Ing. Hannsjörg Freund, Friedrich-Alexander University Erlangen-Nuremberg
Subproject 2 : Microstructured model reactor for the operando analysis of the methanation reaction under dynamic and deactivating operating conditions
Contact: Dr.-Ing. Michael Klumpp, Karlsruhe Institute of Technology (KIT)
8. Project : Long-term stable, Co-based catalysts for the Sabatier reaction operated with load changes
Subproject 1 : Catalytic studies on the Sabatier reaction on Co-based catalysts with load changes
Contact: Prof. Dr. Marcus Bäumer, University of Bremen
Subproject 2 : Catalyst synthesis using multiple flame spray pyrolysis
Contact: Prof. Dr.-Ing. Lutz Mädler, University of Bremen
Subproject 3 : Spatially resolved operando quantification of the reactivability of Co-based catalysts for the Sabatier reaction operated with load changes
Contact: Prof. Dr.-Ing. Jorg Thöming, University of Bremen
9. Project: Design and in-depth investigation of nanostructured catalysts for CO2 electroreduction
Subproject 1 : Catalyst design and operando X-ray spectroscopy
Contact: Prof. Dr. Beatriz Roldan Cuenya, Fritz Haber Institute
Subproject 2 : Operando surface X-ray diffraction
Contact: Prof. Dr. Olaf Magnussen, Christian Albrechts University in Kiel
10. Project : Dynamic metal-oxide interactions in promoted copper catalysts for methanol synthesis
Subproject 1 : synthesis and characterization
Contact: Prof. Dr. Malte Behrens, University of Duisburg-Essen
Subproject 2 : Operando spectroscopy on Cu-based methanol catalysts
Contact: Prof. Dr. Jan-Dierk Grunwaldt, Karlsruhe Institute of Technology (KIT)
Subproject 3 : Theoretical simulations of Cu/ZnO dynamics
Contact: Prof. Dr. Felix Studt, Karlsruhe Institute of Technology (KIT)
11. Project: Hydrogenation of CO 2 to Methanol under Dynamic Reaction Conditions: A Novel Concept for Carbon Capture and Utilization
Subproject 1 : Kinetics of sorption, diffusion and reaction on Ru-based catalyst for methanol synthesis under dynamic conditions
Contact: Prof. Dr. Roger Gläser, Leipzig University
Subproject 2 : Surface chemistry and kinetic studies during hydrogenation of CO 2 to methanol under dynamic reaction conditions
Contact: Prof. Andreas Jentys, Technical University of Munich
Subproject 3 : Development of detailed kinetic model of CO 2 hydrogenation to methanol combined with CO 2 capture and release
Contact: Prof. Olaf Deutschmann, Karlsruhe Institute of Technology (KIT)
12. Project : Transient High-temperature Oxygen Evolution Reaction
Subproject 1 : Fabrication and electrochemical characterization
Contact: Prof. Dr. Rüdiger Eichel, Research Center Jülich GmbH
Subproject 2 : First-principles modelling
Contact: Prof. Dr. Karsten Reuter, Fritz Haber Institute
Subproject 3 : In situ analyses
Contact: Prof. Dr. Robert Schlögl, Fritz Haber Institute
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