Chemistry Journal of Moldova

TOPOLOGICAL ANALYSIS AND FREQUENCY DEPENDENT HYPERPOLARIZABILITY CALCULATIONS OF FDDNP: A DFT STUDY

Author(s):

Keivan Akhtari, Keyumars Hassanzadeh, Bahareh Fakhraei, Ghazal Akhtari


Field: Physical chemistry and chemical physics
Type: Research paper
Issue: 2016 Volume 11, no.2
Pages: 84-92
Keywords:

second-harmonic generation, FDDNP, near-infrared, QTAIM.


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DOI: 
dx.doi.org/10.19261/cjm.2016.11(2).04
 
Abstract (PDF)
Graphical Abstract: In this study, we have shown that FDDNP as a functional fluorescent biomarker has high performance in near-infrared region. The best predicted working wavelength belongs to Ti:sapphire laser (880 nm). The employed near-infrared (NIR) wavelengths reduce scattering and maximize tissue penetration.

 

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