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An improved d-band model of the catalytic activity of magnetic transition metal surfaces

The d-band center model of Hammer and Nørskov is widely used in understanding and predicting catalytic activity on transition metal (TM) surfaces. Here, we demonstrate that this model is inadequate for capturing the complete catalytic activity of the magnetically polarized TM surfaces and propose it...

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Detalles Bibliográficos
Autores principales: Bhattacharjee, Satadeep, Waghmare, Umesh V., Lee, Seung-Cheol
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5093898/
https://www.ncbi.nlm.nih.gov/pubmed/27808100
http://dx.doi.org/10.1038/srep35916