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Assessment of a set of twelve density functionals to estimate the global reactivity of myricetin through the Koopmans' theorem
Keywords: flavonoids, myricetin, conceptual dft, Global reactivity, Koopmans' theorem
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| Título según WOS: | Assessment of a set of twelve density functionals to estimate the global reactivity of myricetin through the Koopmans' theorem |
| Título según SCOPUS: | Assessment of a set of twelve density functionals to estimate the global reactivity of myricetin through the Koopmans theorem |
| Título de la Revista: | CHEMICAL PHYSICS LETTERS |
| Volumen: | 715 |
| Editorial: | Elsevier |
| Fecha de publicación: | 2019 |
| Página de inicio: | 354 |
| Página final: | 359 |
| Idioma: | English |
| DOI: |
10.1016/j.cplett.2018.11.056 |
| Notas: | ISI, SCOPUS |