Fantauzzi D, Krick Calderon S, Mueller JE, Grabau M, Papp C, Steinrück HP, Senftle TP, van Duin ACT, Jacob T (2017)
Publication Language: English
Publication Status: Published
Publication Type: Journal article, Original article
Publication year: 2017
Publisher: Wiley-VCH Verlag
Book Volume: 56
Pages Range: 2594-2598
Journal Issue: 10
URI: http://onlinelibrary.wiley.com/wol1/doi/10.1002/anie.201609317/abstract
Detailed knowledge of the structure and degree of oxidation of platinum surfaces under operando conditions is essential for understanding catalytic performance. However, experimental investigations of platinum surface oxides have been hampered by technical limitations, preventing in situ investigations at relevant pressures. As a result, the time-dependent evolution of oxide formation has only received superficial treatment. In addition, the amorphous structures of many surface oxides have hindered realistic theoretical studies. Using near-ambient pressure X-ray photoelectron spectroscopy (NAP-XPS) we show that a time scale of hours (t≥4 h) is required for the formation of platinum surface oxides. These experimental observations are consistent with ReaxFF grand canonical Monte Carlo (ReaxFF-GCMC) calculations, predicting the structures and coverages of stable, amorphous surface oxides at temperatures between 430–680 K and an O partial pressure of 1 mbar.
APA:
Fantauzzi, D., Krick Calderon, S., Mueller, J.E., Grabau, M., Papp, C., Steinrück, H.-P.,... Jacob, T. (2017). Growth of Stable Surface Oxides on Pt(111) at Near-Ambient Pressures. Angewandte Chemie International Edition, 56(10), 2594-2598. https://doi.org/10.1002/anie.201609317
MLA:
Fantauzzi, Donato, et al. "Growth of Stable Surface Oxides on Pt(111) at Near-Ambient Pressures." Angewandte Chemie International Edition 56.10 (2017): 2594-2598.
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