Experimental and computational data on two-photon absorption and spectral deconvolution of the upper excited states of dye IR780.
Data in brief(2021)
摘要
Evaluating candidates for novel materials with high nonlinear absorption properties for applications as biomarkers is a very important field of research. In this context, experimental and computational information on the two-photon absorption (TPA) properties of the dye IR780 is shown. The two-photon absorption data from 850 to 1000 nm for IR780 and other two well-known dyes, taken as reference, are presented. The experimental data were collected via an implementation of the two-photon induced fluorescence technique, while the quantum chemical data were produced by implementing DFT (Density-functional theory) methods. The data presented here supplement the paper "Two-photon absorption spectrum and characterization of the upper electronic states of dye IR780" by Guarin et al. (2021).
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