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Applications of the Conceptual Density Functional Theory Indices to Organic Chemistry Reactivity

Theoretical reactivity indices based on the conceptual Density Functional Theory (DFT) have become a powerful tool for the semiquantitative study of organic reactivity. A large number of reactivity indices have been proposed in the literature. Herein, global quantities like the electronic chemical p...

Ausführliche Beschreibung

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Bibliografische Detailangaben
Hauptverfasser: Luis R. Domingo, Mar Ríos-Gutiérrez, Patricia Pérez
Format: Artigo
Sprache:Inglês
Veröffentlicht: MDPI AG 2016-06-01
Schriftenreihe:Molecules
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Online-Zugang:http://www.mdpi.com/1420-3049/21/6/748
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