Publications of Karsten Reuter

Carbogno, C.; Groß, A.; Meyer, J.; Reuter, K.: O₂ Adsorption Dynamics at Metal Surfaces: Non-adiabatic Effects, Dissociation and Dissipation. In: Dynamics of Gas-Surface Interactions: Atomic-level Understanding of Scattering Processes at Surfaces, pp. 389 - 419 (Eds. Díez Muiño, R.; Busnengo, H. F.). Springer, Berlin, Heidelberg (2013)

Reuter, K.: First-principles kinetic Monte Carlo simulations for heterogeneous catalysis: Concepts, status, and frontiers. In: Modeling and Simulation of Heterogeneous Catalytic Reactions: From the Molecular Process to the Technical System, pp. 71 - 111 (Ed. Deutschmann, O.). Wiley-VCH, Weinheim (2012)

Reuter, K.: Nanometer and subnanometer thin oxide films at surfaces of late transition metals. In: Nanocatalysis, pp. 343 - 376 (Eds. Heiz, U.; Landman, U.). Springer, Berlin (2006)

Reuter, K.; Stampfl, C.; Scheffler, M.: Ab initio atomistic thermodynamics and statistical mechanics of surface properties and functions. In: Handbook of Materials Modeling, pp. 149 - 194 (Ed. Yip, S.). Springer, Dordrecht (2005)

Hermann, K.; Reuter, K.: Theoretische Bausteine zum Verständnis katalytischer Reaktionen an Übergangsmetall-Oxidoberflächen. In: MPG Jahrbuch. Max-Planck-Gesellschaft, Munich (2003)

Rogal, J.; Reuter, K.: Ab initio atomistic thermodynamics for surfaces: A primer. In: Experiment, Modeling and Simulation of Gas-Surface Interactions for Reactive Flows in Hypersonic Flights, pp. 2-1 - 2-18. VT-142 RTO AVT/VKI Lecture Series, von Karman Institute, Rhode St. Genèse, Belgium, February 06, 2006 - February 10, 2006. NATO Research and Technology Organisation, Neuilly-sur-Seine (2007)

Reuter, K.: Data-Enhanced Multiscale Theory of Operando Energy Conversion Systems. International Conference on Data-Integrated Simulation Science (SimTech2023), Stuttgart, Germany (2023)

Reuter, K.: Multiscale Modelling of Operando Energy Conversion Systems. The Inaugural Lennard-Jones Centre Meeting: Theory and Molecular Simulation in the Physical Sciences, University of Cambridge, Cambridge, UK (2023)

Reuter, K.: Exploring Catalytic Reaction Network with Machine Learning. 5th Conference of Theory and Applications of Computational Chemistry (TACC2023), Sapporo, Japan (2023)

Reuter, K.: Out of the Crystalline Comfort Zone: Atomistic Modelling of Operando Energy Conversion System. ICAT-FHI Symposium: Approaching to the Catalysis Reality, Sapporo, Japan (2023)

Reuter, K.: Adaptive Design of Experiment. Catalysis Summit 2023, Filzmoos, Austria (2023)

Reuter, K.: Exploring Catalytic Reaction Networks with Machine Learning. Joint TACO-NanoCat Conference 2023, TAming COmplexity in Materials: Synergies between Experiment and Modelling, Vienna, Austria (2023)

Reuter, K.: Multiscale Modelling of Operando Energy Conversion Systems. Inauguration of the Christian Doppler Laboratory, TU Wien, Vienna, Austria (2023)

Reuter, K.: Data-Enhanced Multiscale Modeling of Heterogeneous Catalysis. SUNCAT Summer Institute 2023, SUNCAT Center for Interface Science and Catalysis, Stanford, CA, USA (2023)

Reuter, K.: Exploring Catalytic Reaction Networks with Machine Learning. 2023 ACS Fall National Meeting & Exposition, San Francisco, CA, USA (2023)

Reuter, K.: Out of the Crystalline Comfort Zone: Atomistic Modelling of Operando Energy Conversion Systems. Workshop, New Horizons in Materials Design, Max-Planck-Institut für Eisenforschung, Düsseldorf, Germany (2023)

Reuter, K.: First-Principles Based Modelling of Electrocatalysis Beyond the Potential of Zero Charge. Satellite Meeting, Intermolecular Interactions and Properties of Gases, Liquids and Solids, International Congress of Quantum Chemistry (ICQC) 2023, Graz, Austria (2023)

Reuter, K.: Out of the Crystalline Comfort Zone: Atomistic Modelling of Operando Energy Conversion System. Chemistry Colloquium, Institute of Chemistry, Universität Graz, Graz, Austria (2023)

Reuter, K.: Exploring Catalytic Reaction Networks with Machine Learning. Workshop, Computational Materials Science, Telluride Science Research Center, Telluride, CO, USA (2023)

Reuter, K.: First-Principles Based Modelling of Electrocatalysis Beyond the Potential of Zero Charge. NAM 28, 2023 North American Catalysis Society Meeting, Providence, RI, USA (2023)