O 34: Catalysis and surface reactions I
Dienstag, 10. März 2026, 10:30–12:30, HSZ/0204
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10:30 |
O 34.1 |
From Global Optimization to Transition State Search: Automatic Workflow for Surface Reaction Kinetics — •Hyunwook Jung, Emanuel Colombi Manzi, Johannes T. Margraf, Hendrik H. Heenen, and Karsten Reuter
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10:45 |
O 34.2 |
Machine-learning Driven Approach of Surface Adsorption Energy Prediction — •Karlo Sovic and Johannes Margraf
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11:00 |
O 34.3 |
Modeling Solvothermal Reactions at Surfaces with Machine Learning Interatomic Potentials — •Maciej Baradyn, Nils Gönnheimer, and Johannes T. Margraf
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11:15 |
O 34.4 |
Converting MoS2 to MoO2 by Thermal Treatment Under Dilute O2 — •Armin Sahinovic, Jixi Zhang, Osamah Kharsah, Marika Schleberger, Rossitza Pentcheva, and Rodney Smith
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11:30 |
O 34.5 |
2D TiS2 Nanoparticles in reductive and oxidative Atmospheres as Model (Photo-)Catalysts — •Niko Kruse, Justin Klimek, Aaron von Seggern, Martin Hedevang, Sergi Camposs Jara, Jeppe Vang Lauritsen, and Lars Morhusen
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11:45 |
O 34.6 |
In situ X-ray Imaging of PtPd Core-Shell Nanoparticles under Methane Oxidation Conditions — •Lydia J. Bachmann, Thomas F. Keller, Ivan A. Vartanyants, and Andreas Stierle
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12:00 |
O 34.7 |
The mechanism and Rate-Determining Step of Catalytic Ammonia Oxidation on Pd(332) at High Temperatures — •Jan Fingerhut, Jessalyn DeVine, Rongrong Yin, Mark Bernard, Alice Bremer, Dmitriy Borodin, Kai Golibrzuch, Theofanis Kitsopoulos, Daniel Auerbach, Hua Guo, and Alec Wodtke
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12:15 |
O 34.8 |
Promoting Role of Isolated Surface Hydroxyls on Selective Dehydrogenation of 2-Propanol over Co3O4 Catalyst — •Jan Smyczek, Patrick Hubert, Hauke Scheele, Carsten Schröder, Sharif Najafishirtari, Paul Kohlmorgen, Malte Behrens, and Swetlana Schauermann
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