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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...

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Detaylı Bibliyografya
Yayımlandı:J Phys Chem A
Asıl Yazarlar: Corsini, Chiara, Peeters, Stefan, Righi, M. C.
Materyal Türü: Artigo
Dil:Inglês
Baskı/Yayın Bilgisi: American Chemical Society 2020
Online Erişim:https://ncbi.nlm.nih.gov/pmc/articles/PMC8011918/
https://ncbi.nlm.nih.gov/pubmed/32881495
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpca.0c05040
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