Intermediate polaronic charge transport in organic crystals from a many-body first-principles approach

Abstract Charge transport in organic molecular crystals (OMCs) is conventionally categorized into two limiting regimes − band transport, characterized by weak electron-phonon (e-ph) interactions, and charge hopping due to localized polarons formed by strong e-ph interactions. However, between these...

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Bibliographic Details
Main Authors: Benjamin K. Chang, Jin-Jian Zhou, Nien-En Lee, Marco Bernardi
Format: Article
Language:English
Published: Nature Portfolio 2022-04-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-022-00742-6