A DFT based insights for molecular designing of pyridine dipyrrolide core with benzodithiophene-based acceptors for organic solar cells

A DFT based insights for molecular designing of pyridine dipyrrolide core with benzodithiophene-based acceptors for organic solar cells

Abstract This study introduces a new series of organic compounds (PPH1–PPH8) derived from a pyridine dipyrrolide (PDP) core, aimed at enhancing the efficacy of organic solar cells. Their light absorption and charge transport capabilities were improved by altering the terminal groups of a reference m...

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Bibliographic Details
Main Authors: Mashal Khan, Ayesha Tariq, Iram Irshad, Muhammad Adnan Asghar, Tansir Ahamad, Ke Chen
Format: Article
Language:English
Published: Nature Portfolio 2025-07-01
Series:Scientific Reports
Subjects:
Pyridine dipyrrolide
Photovoltaic materials
Benzodithiophene acceptors
A − π − A
Open circuit voltage
DFT
Online Access:https://doi.org/10.1038/s41598-025-10748-x
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