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...
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| Autors principals: | , , |
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| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
MDPI AG
2016-06-01
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| Col·lecció: | Molecules |
| Matèries: | |
| Accés en línia: | http://www.mdpi.com/1420-3049/21/6/748 |
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