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Dissociative Chemisorption of O(2) on Al(111): Dynamics on a Correlated Wave-Function-Based Potential Energy Surface
[Image: see text] Dissociative chemisorption of O(2) on the Al(111) surface represents an extensively studied prototype for understanding the interaction between O(2) and metal surfaces. It is well known that the experimentally observed activation barrier for O(2) dissociation is not captured by con...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2018
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6025882/ https://www.ncbi.nlm.nih.gov/pubmed/29843512 http://dx.doi.org/10.1021/acs.jpclett.8b01470 |