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Updated: Sep 10, 2025

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
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有機太陽電池におけるドナー-受容体複合体に対するハロゲン原子の影響に関する洞察:キノキシル化ドナーファミリーの密度関数理論研究

Alessandro Romo-Gutiérrez1, Zuriel Natanael Cisneros-García1, Carlos Iván Méndez-Barrientos1

  • 1Departamento de Ciencias Exactas y Tecnología, Centro Universitario de los Lagos, Universidad de Guadalajara, Enrique Díaz de León 1144, Lagos de Moreno, 47460, Jalisco, México.

Chemphyschem : a European journal of chemical physics and physical chemistry
|August 25, 2025
PubMed
まとめ

この研究では,有機太陽電池のクイノキサリンベースのドナー材料を分析しています. PBQ6-Fのようなドナーのハロゲン原子の変異は 分子相互作用と電荷輸送を強化し デバイスの性能を向上させます

キーワード:
密度関数理論ハロゲン変化有機太陽電池キノキサリンベースのドナー小さな分子

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