Impact of Electrostatic Disorder on Intramolecular Electronic Coupling in Organic Mixed Ionic–Electronic Conductors: A Combined GRRM, MD, and QM/MM-CDFT Study.

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Bibliographic Details
Title: Impact of Electrostatic Disorder on Intramolecular Electronic Coupling in Organic Mixed Ionic–Electronic Conductors: A Combined GRRM, MD, and QM/MM-CDFT Study.
Authors: Gao, Zhanglei1 (AUTHOR), Xiao, Bowen1,2 (AUTHOR), Kishimoto, Naoki2,3 (AUTHOR) kishimoto@tohoku.ac.jp, Murashima, Takahiro1,3 (AUTHOR)
Source: Molecules. Mar2026, Vol. 31 Issue 5, p774. 20p.
Database: Academic Search Ultimate
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