DFT calculations towards the geometry optimization, electronic structure, infrared spectroscopy and UV-vis analyses of Favipiravir adsorption on the first-row transition metals doped fullerenes; a new strategy for COVID-19 therapy

Title
DFT calculations towards the geometry optimization, electronic structure, infrared spectroscopy and UV-vis analyses of Favipiravir adsorption on the first-row transition metals doped fullerenes; a new strategy for COVID-19 therapy
Authors
Keywords
COVID-19, Favipiravir, Metallofullerene, Adsorption, Water solvent, Density Functional Theory
Publisher
Elsevier BV
Online
2020-10-17
DOI
10.1016/j.saa.2020.119082

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