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Adsorption and Dissociation of Ni(acac)(2) on Iron by Ab Initio Calculations
[Image: see text] Among metal β-diketonates, nickel acetylacetonate (Ni(acac)(2)) has been widely employed as a precursor for many chemical structures, due to its catalytic properties. Here, we investigate, by means of density functional theory (DFT) calculations, the adsorption and dissociation of...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2020
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8011918/ https://www.ncbi.nlm.nih.gov/pubmed/32881495 http://dx.doi.org/10.1021/acs.jpca.0c05040 |