Difference between Metal-S and Metal-O Bond Orders: A Descriptor of Oxygen Evolution Activity for Isolated Metal Atom-Doped MoS(2) Nanosheets

Exploration of predictive descriptors for the performance of electrocatalytic oxygen evolution reaction (OER) is significant for material development in many energy conversion processes. In this work, we used high-throughput density functional theory (DFT) calculations to systematically investigate...

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Detalles Bibliográficos
Autores principales: Hai, Guangtong, Gao, Hongyi, Zhao, Guixia, Dong, Wenjun, Huang, Xiubing, Li, Yi, Wang, Ge
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6806669/
https://www.ncbi.nlm.nih.gov/pubmed/31655059
http://dx.doi.org/10.1016/j.isci.2019.10.001

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6806669/
https://www.ncbi.nlm.nih.gov/pubmed/31655059
http://dx.doi.org/10.1016/j.isci.2019.10.001

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