Conformational and electronic properties of hydroquinone adsorption on C60 fullerenes: Doping atom, solvent and basis set effects
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DOI: 10.1016/j.molstruc.2018.04.092
Abstract: Abstract Hydroquinone (HQ) is widely used as a reducing agent with well-known antioxidant properties. The interaction with pristine and doped fullerenes seems to have a promising research field particularly for the drug delivery and sensor… read more here.
Keywords: properties hydroquinone; hydroquinone adsorption; basis; electronic properties ... See more keywords