DFT/TD-DFT study of novel triphenylamine-based dyes with azo moieties and π-spacer variations for enhanced dye-sensitized solar cell performance

DFT/TD-DFT study of novel triphenylamine-based dyes with azo moieties and π-spacer variations for enhanced dye-sensitized solar cell performance

This study involves a computational analysis of new D-π-A dyes obtained from triphenylamine (TPA), which contain various azo-dye components. The structural, molecular, electrical, and optical properties of these dyes were computed using Density Functional Theory (DFT) and Time-Dependent DFT, utilizi...

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Bibliographic Details
Main Authors: Jubaer Ahmod Shakil, Shassatha Paul Saikat, Niloy Bhattacharjee, Md. Rithoan Hossain, Mahafuz Hossen, Jahidul Islam, Mayeen Uddin Khandaker, Jamal Uddin, Faisal Islam Chowdhury
Format: Article
Language:English
Published: Elsevier 2024-12-01
Series:Chemical Physics Impact
Subjects:
Dye-sensitized solar cell
Renewable energy
Donor-π-acceptor
Triphenylamine
Azo moieties
π-linker
Online Access:http://www.sciencedirect.com/science/article/pii/S266702242400269X
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