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Oxygen Evolution Reaction Kinetic Barriers on Nitrogen-Doped Carbon Nanotubes

[Image: see text] We investigate kinetic barriers for the oxygen evolution reaction (OER) on singly and doubly nitrogen-doped single-walled carbon nanotubes (NCNTs) using the climbing image nudged elastic band method with solvent effects represented by a 45-water-molecule droplet. The studied sites...

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Detalles Bibliográficos
Autores principales:	Partanen, Lauri, Murdachaew, Garold, Laasonen, Kari
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2018
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6203181/ https://www.ncbi.nlm.nih.gov/pubmed/30405870 http://dx.doi.org/10.1021/acs.jpcc.8b03269

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