Articles with "cyclohexane acetonitrile" as a keyword



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A theoretical study of the low-lying excited states and the photophysics of dimethoxy curcumin in cyclohexane and acetonitrile

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Published in 2017 at "Theoretical Chemistry Accounts"

DOI: 10.1007/s00214-017-2108-9

Abstract: Two important aspects of the photophysics of dimethoxy curcumin in solvents are theoretically analysed. First, the large Stokes shift in cyclohexane and in acetonitrile is calculated using time-dependent density functional theory with large basis set.… read more here.

Keywords: cyclohexane acetonitrile; dimethoxy curcumin; low lying; photophysics dimethoxy ... See more keywords