Insights into the optoelectronic, quantum chemical, NBO and dynamic nonlinear optical properties of meso-BODIPY dyes

Insights into the optoelectronic, quantum chemical, NBO and dynamic nonlinear optical properties of meso-BODIPY dyes

Herein, understanding the effect of substituents on the electronic absorption, optoelectronic, static and dynamic nonlinear optical (NLO) properties, and molecular stability of (CF3-, CH3-, CCl3-, NH2-, NO2-) meso-substituted BODIPY dyes was specifically aimed at using density functional (B3LYP and...

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Bibliographic Details
Main Authors: Oluwatoba Emmanuel Oyeneyin, Nathanael Damilare Ojo, Adesoji Alani Olanrewaju, Blessing Lully Isaiah, Nnenna Winifred Odozi, Edmore Farayi Kangara, Matshawandile Tukulula
Format: Article
Language:English
Published: Elsevier 2025-03-01
Series:Scientific African
Subjects:
BODIPY dye
DFT
dynamic NLO
direct current second harmonic generation
DSSC
natural bond orbital
Online Access:http://www.sciencedirect.com/science/article/pii/S246822762500078X
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