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CO oxidization catalyzed by B, N, and their co-doped fullerenes: a first-principles investigation
Using the elastic band method based on first-principles calculations, we have carefully studied the catalytic properties of B, N, and their co-doped fullerenes. During oxidization of CO, both C(59)B and C(59)N can be oxidized to form durable oxide catalysts for successive CO oxidizations, the rate d...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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The Royal Society of Chemistry
2019
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9066515/ https://www.ncbi.nlm.nih.gov/pubmed/35518886 http://dx.doi.org/10.1039/c9ra02172h |