Hydrogen atom scattering at the Al2O3(0001) surface: a combined experimental and theoretical study

Author:

Liebetrau Martin12ORCID,Dorenkamp Yvonne3,Bünermann Oliver345ORCID,Behler Jörg12ORCID

Affiliation:

1. Lehrstuhl für Theoretische Chemie II, Ruhr-Universität Bochum, D-44780 Bochum, Germany

2. Research Center Chemical Sciences and Sustainability, Research Alliance Ruhr, D-44780 Bochum, Germany

3. Georg-August-Universität Göttingen, Institut für Physikalische Chemie, Tammannstraße 6, D-37077 Göttingen, Germany

4. Department of Dynamics at Surfaces, Max-Planck-Institute for Multidisciplinary Sciences, Am Fassberg 11, D-37007 Göttingen, Germany

5. International Center of Advanced Studies of Energy Conversion, Georg-August-Universität Göttingen, Tammannstraße 6, D-37077 Göttingen, Germany

Abstract

We report a combined theoretical and experimental study on the scattering of hydrogen atoms at aluminium oxide. The scattering mechanism and impact sites are identified using a machine learning potential.

Funder

Deutsche Forschungsgemeinschaft

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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