biblio

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Filters: Keyword is Time-dependent density functional theory  [Clear All Filters]
2019
K. Selvam, Gandhi, S., Krishnarnurty, S., and Gopalakrishnan, G., “Effect of substitution on the excited state photophysical and spectral properties of boron difluoride curcumin complex dye and their derivatives: a time dependent-DFT study”, Journal of Photochemistry and Photobiology B-Biology, vol. 199, p. 111595, 2019.
2020
S. Sundaram M. Sundaram, Karthick, S., Sailaja, K., Karkuzhali, R., and Gopu, G., “Theoretical study on cyclophane amide molecular receptors and its complexation behavior with TCNQ”, Journal of Photochemistry and Photobiology B-Biology, vol. 203, p. 111735, 2020.