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Theoretical analysis of hydrogen spillover mechanism on carbon nanotubes

The spillover mechanism of molecular hydrogen on carbon nanotubes in the presence of catalytically active platinum clusters was critically and systematically investigated by using density-functional theory. Our simulation model includes a Pt(4) cluster for the catalyst nanoparticle and curved and pl...

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Detalles Bibliográficos
Autores principales:	Juarez-Mosqueda, Rosalba, Mavrandonakis, Andreas, Kuc, Agnieszka B., Pettersson, Lars G. M., Heine, Thomas
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2015
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4313777/ https://www.ncbi.nlm.nih.gov/pubmed/25699250 http://dx.doi.org/10.3389/fchem.2015.00002

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