| Plenary 1 Room: 1 Monday 10:00-11:00 |
| Reactor Design and Scale-up for CO2-free Manufacturing, CO2 Capture and Utilization |
| Professor Vemuri Balakotaiah (University of Houston) |
| Keynote 1 Room: 1 Monday 11:30-12:00 |
| Could you do more with segmented flow? |
| Professor Claude de Bellefon, (CPE-Lyon) |
| Keynote 2 Room: 2 Monday 11:30-12:00 |
| Remote control of reaction-diffusion processes in drug delivery |
| Professor Frantisek Stepanek (Vysoka Skola Chemicko-Technologicka, Prague) |
| Keynote 3 Room: 3 Monday 11:30-12:00 |
| Modelling-based catalytic bio-refining reaction engineering |
| Professor Blaz Likozar (Kemijski Institut, Ljubljana) |
| Keynote 4 Room: 4 Monday 11:30-12:00 |
| Modelling and simulation of hydrogen reduction of iron ore in a direct reduction furnace |
| Professor Henrik Saxen (Abo Akademi University) |
| Keynote 5 Room: 5 Monday 11:30-12:00 |
| Cyclically-integrated CO2 capture and conversion into synthetic natural gas |
| Professor Luis Miguel Madeira (Universidade do Porto) |
| F1 Room: 1 Monday 9.40-10:00 |
| Generalized Runaway Diagrams for Catalytic Reactors with Stacked Catalyst Activities |
| Jingxian Zhang, Christopher Tighe, Klaus Hellgardt, Dominik Unruh, Rene' Bos |
| F2 Room: 1 Monday 12:00-12:20 |
| Modeling of catalytic fixed-bed reactors: comparison of 1D and 3D particle-resolved simulations |
| Akash Bhimrao Shirsath, Matthias Hettel, Eric Daymo, Steffen Tischer, Olaf Deutschmann |
| F3 Room: 1 Monday 12:20-12:40 |
| Redox kinetics for the low-temperature NH3-SCR and N2O formation over Cu-CHA catalysts |
| Ramona Resmini, Nicola Usberti, Roberta Villamaina, Maria Pia Ruggeri, Djamela Bounechada, Andy York, Isabella Nova, Enrico Tronconi |
| F4 Room: 1 Monday 12:40-13:00 |
| Investigating the Reduction Half-Cycle of Standard SCR at Low and High Temperature: Influence of HTA and H2O |
| Nicole Daniela Nasello, Umberto Iacobone, Andrea Gjetja, Isabella Nova, Enrico Tronconi, Rohil Daya, Lai Wei, Hongmei An, Krishna Kamasamudram |
| F5 Room: 1 Monday 14:40-15:00 |
| Gaining Kinetic Insights into Knorr Pyrazole Synthesis via Transient Flow Experiments |
| Fernando Vega-Ramon, Linden Schrecker, King Kuok (Mimi) Hii, Dongda Zhang |
| F6 Room: 1 Monday 15:00-15:20 |
| Hydrous Hydrazine decomposition over Rh/Al2O3 catalyst: CFD studies |
| Panayiota Adamou, Silvio Bellomi, Eleana Harkou, Alberto Villa, Nikolaos Dimitratos, Achilleas Constantinou |
| F7 Room: 1 Monday 15:20-15:40 |
| Jadeite Hydrogen from catalytic decomposition of non-methane hydrocarbons |
| Bofan Li, Ruijing Jiao, Chaojie Cui Weizhong Qian, Fei Wei, Yong Jin |
| F8 Room: 1 Monday 15:40-16:00 |
| A Lagrangian Approach To Predict The Flow Behaviour And Residence Time Distribution In Chemical Reactors |
| Mohammad Asif and Carlos A. Grande |
| F9 Room: 1 Monday 16:00-16:20 |
| Influence of the electrochemical cell configuration over the stability of tunable and stable production of syngas for efficient coupling with hydroformylation reaction. |
| Mario Gallone, Alessia Fortunati, Federico Dattila, Simelys Hernandez |
| F10 Room: 1 Monday 16:20-16:40 |
| Kinetic and mechanistic implications of CO2-assisted ethane dehydrogenation over Fe-based catalysts |
| Maria Tasioula, Stavros A. Theofanidis, Alessandro Longo, Angeliki A. Lemonidou |
| F11 Room: 1 Monday 16:40-17:00 |
| A model of bubble coalescence in the presence of a nonionic surfactant |
| Yuelin Wang, Tiefeng Wang |
| F12 Room: 1 Monday 17:00-17:20 |
| Iron oxide reduction using hydrogen as green reducing agent |
| Antonio D'Angelo, E. Salucci, V. Russo, H. Gre'nman, H. Saxe'n |
| F13 Room: 1 Monday 17:20-17:40 |
| Revealing the role of parallel reaction pathways during CO2 hydrogenation to methanol over Cu-ZrO2 and Cu-ZnO catalysts at low pressure |
| George J. Fulham Ewa J. Marek |
| F14 Room: 1 Monday 17:40-18:00 |
| A new Monte Carlo-based approach for addressing stiff chemical kinetics. |
| Abderrahim Sahim, Marion Carrier, Mouna El Hafi, Simon Eibner , Yaniss Nyffenegger-Pere, Ste'phane Blanco, Richard Fournier |
| F15 Room: 1 Monday 18:00-18:20 |
| Fixed Bed Heat Transfer Parameter Estimatio - A New Look at an Old Problem |
| Anthony G. Dixon |
| F16 Room: 1 Monday 18:20-18:40 |
| Modelling PS pyrolysis combining the Method of Moments and full chemistry simulations |
| Daniel Withoeck, Florence Vermeire, Onur Dogu, Oguzhan Akin, Robin John Varghese, Steven De Meester, Kevin Van Geem, Paul Van Steenberge |
| F17 Room: 1 Monday 18:40-19:00 |
| CFD Simulations for the Methanation of CO2 in Packed Bed Reactor Using Dual Function Materials |
| Eleana Harkou, Anastasios I. Tsiotsias, Nikolaos D. Charisiou, Maria A. Goula, George Manos and Achilleas Constantinou |
| F18 Room: 1 Monday 19:00-1920 |
| Ozone-assisted Catalytic Oxidation (OzCO) of Methane: Impact of the Cu/Mn Ratio in Bimetallic Hydroxyapatite-supported Catalysts |
| Reza Monjezi, Alexandra Bouriakova, Karen Leus, Philippe M. Heynderickx, Pascal Van Der Voort, Rino Morent, Joris W. Thybaut |
| F19 Room: 1 Monday 19:20-19:40 |
| Probing pellet-scale reaction-diffusion phenomena in a trickle bed reactor using operando magnetic resonance spectroscopic imaging |
| Scott V. Elgersma, Jordan A. Ward-Williams, Qingyuan Zheng, Jack Davies, Andrew J. Sederman, Michael D. Mantle, Constant M. Gue'don, Lynn F. Gladden |
| F20 Room: 1 Monday 19:40-20:00 |
| Kinetic Analysis of Ammonia Cracking over Ru-based Catalysts for COx-free Hydrogen Production |
| Yi Qiu, Federico Sascha Franchi, Nicola Usberti, Alessandra Beretta |
| B1 Room: 2 Monday 12:00-12:20 |
| Potential and limits of thermodynamic rate approaches to hydroformylation: A case study for modelling solvent effects on reaction kinetics for gas/liquid reactions |
| Martin Gerlach, Fabian Huxoll, Andreas Seidel-Morgenstern, Gabriele Sadowski, Christof Hamel |
| B2 Room: 2 Monday 12:20-12:40 |
| Kinetic Modeling of Plastic Waste Catalytic Cracking over Phosphorous-Modified Mesoporous ZSM-5: an Isooctane Model Compounds Study |
| Yannick Ureel, Anas Jamil Abdulrahman, Oguzhan Akın, Maarten K. Sabbe, Kevin M. Van Geem |
| B3 Room: 2 Monday 12:40-13:00 |
| Propene epoxidation over titanium silicate catalyst a new understanding |
| Matias Alvear, Faysal Ibrahim, Jadiel Lopez-Gonzalez, Tapio Salmi, Ive Hermans |
| B4 Room: 2 Monday 14:40-15:00 |
| Understanding the synergistic effects of Si/Al and structure of zeolites for isobutane alkylation based on experiments and MD simulations. |
| Bihong Li, Weizhong Zheng, Weizhen Sun, and Ling Zhao |
| B5 Room: 2 Monday 15:00-15:20 |
| Accounting for entropy in reactor-level simulations of ethylene epoxidation: does it really matter? |
| Jurij Golobic, Andraz Pavlisic, Miha Grilc, Anders Hellman, Blaz Likozar, Matej Hus |
| B6 Room: 2 Monday 15:20-15:40 |
| Photoreforming of organics for hydrogen production: Microkinetic analysis and experimental validation |
| Ruiman Ma, Matthew Wigglesworth, Marica Muscetta, Natalia Martsinovich, Sergio Vernuccio |
| B7 Room: 2 Monday 15:40-16:00 |
| Microkinetic modelling of isosynthesis over monoclinic zirconia catalyst |
| Juha Lehtonen, Kristian Chen, Bhumi Baraiya, Krista Kuutti, Ville Korpelin, Niko Heikkinen, Laura Keskivali, Matti Reinikainen, Karoliina Honkala |
| B8 Room: 2 Monday 16:00-16:20 |
| Machine Learning of Rate Coefficients of SNAr Reactions through rapid Quantum Chemical Property Prediction |
| Lowie Tomme, Florence Vermeire, Christian Stevens, Kevin M. Van Geem |
| B9 Room: 2 Monday 16:20-16:40 |
| Carbon dioxide capture with choline-based DESs solvents |
| Gabriela Ciriaco Villegas, Alain Ledoux, Lionel Estel, Arnaud Delanney |
| B10 Room: 2 Monday 16:40-17:00 |
| Property Estimations with Chemical Accuracy for Industrially Relevant Molecules Using Geometric Deep Learning |
| Maarten R. Dobbelaere, Istvan Lengyel, Christian V. Stevens, Kevin M. Van Geem |
| B11 Room: 2 Monday 17:00-17:20 |
| Catalytic semi-hydrogenation of acetylene under front end conditions - Kinetic measurement and modeling |
| Leonhard Iser, Marcus Rose |
| B12 Room: 2 Monday 17:20-17:40 |
| Unconventional coke composition originating from Catalytic fast pyrolysis model reaction |
| Nathan Pichot, Thomas Lemaitre, Nourrdine Chaouati, Yannick Pouilloux, Anthony Dufour, Ludovic Pinard |
| B13 Room: 2 Monday 17:40-18:00 |
| Combining Metadynamics and Mean Force Integration for studying chemical reactions in solution: an application to backbiting of poly-Butyl Acrylate. |
| Francesco Serse, Antoniu Bjola, Matteo Salvalaglio, Matteo Pelucchi |
| B14 Room: 2 Monday 18:00-18:20 |
| Mechanistic insights into r-WGS reaction on Rh and Pt via a combined experimental and structure-dependent microkinetic analysis |
| Gabriele Spano, Luca Nardi, Gabriele Contaldo, Raffaele Cheula, Chiara Negri, Matteo Maestri |
| B15 Room: 2 Monday 18:20-18:40 |
| CO hydrogenation conversion driven by micro-environments of active sites over iron carbide catalysts |
| Nan Song, Xingxing Li, Ebtihal Abograin, Wenyao Chen, Junbo Cao, Jing Zhang, De Chen, Xuezhi Duan, Xinggui Zhou |
| B16 Room: 2 Monday 18:40-19:00 |
| Forced dynamic (operando) reactors to understand the structure and deactivation of CO2 dry reforming over the NiZn alloy catalyst |
| Xueqin Bai, Vijay K. Velisoju, Bambar Davaasuren, Pedro Castano |
| B17 Room: 2 Monday 19:00-1920 |
| Modeling HDPE thermal pyrolysis |
| Laura Pires da M. Costa, Julian Garcua Cardenas, Oguzhan Akin, Robin John Varghese, Istvan Lengyel, Kevin Van Geem |
| B18 Room: 2 Monday 19:20-19:40 |
| Selective CO2 absorption in bioreactors based on molecular modelling, thermodynamics, kinetics and experiments |
| Ping Wu and Juei-Yu Chiu |
| B19 Room: 2 Monday 19:40-20:00 |
| Multiphysics modelling and Electrochemical Impedance Spectroscopy as a tool for predicting Solid Oxide Fuel Cells performance and rational cell design |
| Andrea Pizzato, Paolo Canu |
| M1 Room: 5 Monday 9.40-10:00 |
| Potential of producing medium chain dicarboxylic acids from kerogen in kukersite in a continuous-flow oxidation reactor |
| Maria Reinaas, Kristiina Kaldas, Kati Muldma, Jaan Mihkel Uustalu, Villem Odner Koern, Kaarel Siirde, Estelle Silm, Birgit Mets, Mariliis Kimm, Kristi Rouk, Margus Lopp |
| M2 Room: 5 Monday 12:00-12:20 |
| Modeling of a heat-integrated biomass downdraft gasifier: Influence of feed moisture and airflow |
| Houda M. Haidar, James W. Butler, Samira Lotfi, Anh-Duong Dieu Vo, Peter Gogolek, Kimberley McAuley |
| M3 Room: 5 Monday 12:20-12:40 |
| Solid Foam Catalysts Applied to Sugar Hydrogenation: Towards Continuous Production of Sugar Alcohols |
| German Araujo-Barahona, Alberto Goicoechea-Torres, Maria Ciaramella, Miriam Cavaliere, Kari Eranen, Dmitry Y. Murzin, Juan Garcia-Serna, Vincenzo Russo, Tapio Salmi |
| M4 Room: 5 Monday 12:40-13:00 |
| Catalytic sugar oxidation in continuous packed bed reactor: effect of liquid flow rate |
| Mouad Hachhach, Vincenzo Russo, Irina Simakova, Kari Eranen, Dmitry Yu. Murzin, Tapio Salmi |
| M5 Room: 5 Monday 18:00-18:20 |
| Study of hydrodynamics and CO2 adsorption in multistage fluidised beds via computational and experimental investigations. |
| Haile Jose, Swapna Rabha |
| M6 Room: 5 Monday 18:20-18:40 |
| Trajectory-Based Breakup Modelling for Dense Bubbly Flows |
| Christian Weiland, Alexandra von Kameke, Michael Schlüter |
| M7 Room: 5 Monday 18:40-19:00 |
| Integrated CO2 Capture and Catalytic Methanation over Dual Function Materials in a Lab-Scale Interconnected Fluidized Bed System |
| Fiorella Massa, Elisabetta Maria Cepollaro, Stefano Cimino, Antonio Coppola, Fabrizio Scala |
| M8 Room: 5 Monday 19:00-1920 |
| Computational fluid dynamic (CFD) of the Liquid organic hydrogen carrier (LOHC) dehydrogenation reactor and furnace |
| Nihal Rao, Ashwin W Patwardhan |
| M9 Room: 5 Monday 19:20-19:40 |
| Breakthrough in epoxidation of vegetable oils: from semibatch to continuous technology |
| Tommaso Cogliano, Kari Eranen, Riccardo Tesser, Martino DiSerio, Vincenzo Russo, Tapio Salmi |
| M10 Room: 5 Monday 19:40-20:00 |
| From Lab to Pilot: Enginzyme's Developments in Enzymatic Glycosylation |
| Adriana Freites Aguilera |
| P1 Room: 3 Monday 9.40-10:00 |
| Light Olefin Production via Catalytic, Melt, Electrified Pyrolysis of Polyethylene |
| Jacqueline Ngu, Esun Selvam, Arun Sundaramoorthy, Pavel Kots, Dionisios G. Vlachos |
| P2 Room: 3 Monday 12:00-12:20 |
| Low-Temperature Ammonia Decomposition using Cs-Ru/CeO2 Catalyst |
| Gaetano Anello, Luca Di Felice, Fausto Gallucci |
| P3 Room: 3 Monday 12:20-12:40 |
| Low-carbon hydrogen production via reactive intensification technologies Rational design of materials |
| Diana Iruretagoyena, Paul Fennell, Ronny Pini, Nilay Shah |
| P4 Room: 3 Monday 12:40-13:00 |
| Intensified hydrogenation process via catalytic chemistry and engineering |
| Yutao Ding, Chong Peng |
| P5 Room: 3 Monday 14:40-15:00 |
| Intensification of zinc dithionite production: from a batch to a mesofluidic reactor. |
| Jean-Luc Hoxha, Mathurin Grogna, Dominique Toye |
| P6 Room: 3 Monday 15:00-15:20 |
| High throughput screening of ionic liquids to enhanced catalytic performance of H2SO4- catalyzed C4 alkylation based on multi-scale simulations. |
| Weizhong Zheng, Zhihong Ma, Weizhen Sun, Ling Zhao |
| P7 Room: 3 Monday 15:20-15:40 |
| Electrifying Ethanol Dehydration for Emission-free Ethylene Production |
| Emre Turan (Presenting author) , Robert Dieckmann, Michael Geske, Raoul Naumann D'Alnoncourt, Michael Bender, Benjamin Frank, Johannes Bode, Frank Rosowski |
| P8 Room: 3 Monday 15:40-16:00 |
| Assessing industrial-scale H2SO4-catalyzed C4 Alkylation enhanced by novel [N1,1,1,1][C10SO4] additives based on a complex kinetic model |
| Zhihong Ma Weizhong Zheng Weizhen Sun Ling Zhao |
| P9 Room: 3 Monday 16:00-16:20 |
| Sustainable hydrogen through decomposition of renewable ammonia: De-centralized supply applying micro-structured heat-exchangers and novel catalyst technology. |
| Gunther Kolb, Jonas Schramm, Christian Hofmann, Tobias Weissenberger, Martin Wichert |
| P10 Room: 3 Monday 16:20-16:40 |
| Printing of microscopic POCS from copper using scan line patterning for the intensification of gas phase reactors |
| Alexander Limper, Lukas Portheine, Anselm Brodersen, Francesca Zaio, Robert Keller, Mathias Wessling, Alessandra Beretta, Gianpiero Groppi, Matteo Ambrosetti, John Linkhorst, Enrico Tronconi |
| P11 Room: 3 Monday 16:40-17:00 |
| Low-carbon H2 production via electrified steam reforming of biogas in conductive structured reactors |
| Giulia Ferri, Matteo Ambrosetti, Alessandra Beretta, Gianpiero Groppi, Enrico Tronconi |
| P12 Room: 3 Monday 17:00-17:20 |
| Comparative Evaluation of Reactor Configurations with Intensified Heat Transport for Heterogeneously Catalyzed Endothermal Reactions |
| Mira Zallmann and Hannsjorg Freund |
| P13 Room: 3 Monday 17:20-17:40 |
| Novel Annular Jet Reactor for Direct Conversion of Oligomers to Olefins and Aromatics with Pathway to Carbon Neutrality |
| Sreekanth Pannala, Byeongjin Baek, Mike Mier, David Robichaud, Lei Chen, Retheesh VM, Balamurali Nair, Vladimir Shtern, Navin Asthana, and David West |
| P14 Room: 3 Monday 17:40-18:00 |
| CPFD Simulation of Sorption Enhanced Gasification in a Pressurized Fluidized Bed System |
| Alessandro Antonio Papa, Armando Vitale, Umberto Pasqual Laverdura, Andrea Di Carlo |
| P15 Room: 3 Monday 18:00-18:20 |
| Evaluation of the Integration of Direct Air Capture and Methanation Processes. |
| Mattia Galanti, Francesco Sabatino, Ivo Roghair, Martin Van Sint Annaland |
| P16 Room: 3 Monday 18:20-18:40 |
| Promotion of heat transfer in compact Fischer-Tropsch tubular reactors using structured conductive internals: a pilot scale study |
| Martino Panzeri, Carlo Giorgio Visconti, Gianpiero Groppi, Enrico Tronconi |
| P17 Room: 3 Monday 18:40-19:00 |
| Polymer fouling in tubular reactors for radical polymerizations |
| Stefan Welzel, Ulrich Nieken |
| P18 Room: 3 Monday 19:00-1920 |
| Simulated Moving Bed Reactor to Valorise Glycerol into Solketal: Coupling Green Chemicals and Process Intensification |
| Isabella Correa, Rui P. V. Faria, Alirio E. Rodrigues |
| P19 Room: 3 Monday 19:20-19:40 |
| Steam-Methane Reforming on Joule Heated Ni-Coated Metal Wires |
| Elmer B. Ledesma, Meghana Idamakanti, Praveen Bollini, Ram R. Ratnakar, Michael P. Harold |
| P20 Room: 3 Monday 19:40-20:00 |
| Methanol synthesis in a fluidized bed reactor with continuous addition/removal of sorbent |
| R. Ciercoles, J. Lasobras, J. Soler, J. Herguido, M. Menendez |
| R1 Room: 4 Monday 18:00-18:20 |
| Kinetics of homogeneously catalyzed dehydrogenation of 1-phenyl-1,3-propanediol-derived lignin model compound |
| Dmitry Yu. Murzin, Veronika D. Badazhova, Risto Savela, Johan Warna, Reko Leino |
| R2 Room: 4 Monday 18:20-18:40 |
| Catalytic valorization of non-condensable pyrolysis gases derived from mixed plastic waste towards selective and sustainable propylene production |
| Ehsan Mahmoudi, Stavros A. Theofanidis, Stamatia A. Karakoulia, Alessandro Longo, Christoph Sahle, Dirk E. De Vos, Angeliki A. Lemonidou |
| R3 Room: 4 Monday 18:40-19:00 |
| Purification of glycerol from a real process and kinetic modelling of its conversion to triacetin with Amberlyst 36. |
| Aya Sandid, Taha Attarbachi, Vincenzo Spallina, Jesu's Esteban |
| R4 Room: 4 Monday 19:00-1920 |
| Optimization and efficiency increase of syngas fermentation through control of elementary process variables |
| Lukas Perret, Nikolaos Boukis, Joerg Sauer |
| R5 Room: 4 Monday 19:20-19:40 |
| Experimental validation of process modeling in methanol synthesis using the CAMARE process: influence of byproducts on selectivity and conversion |
| Ine's Alejandra Carbajal Ramos, Quido Smejkal, Arash Bagherzadeh, Sergey Sokolov, Sebastian Wohlrab |
| R6 Room: 4 Monday 19:40-20:00 |
| Cell and Electrode Engineering in Green H2 Production via Photo-Electro-Catalytic (PEC) Approach |
| Francesco Tavella, Daniele Giusi, Matteo Miceli, Luana De Pasquale, Veronica Costantino, Angela M. Ronsisvalle, Chiara Genovese, Siglinda Perathoner, Gabriele Centi, Claudio Ampelli |