Charge transport in organic semiconductors: Assessment of the mean field theory in the hopping regime

Flexible Surface Hopping Approach to Model the Crossover from Hopping to Band-like Transport in Organic Crystals

(2013) Linjun Wang et al.   Journal of Physical Chemistry Letters

Charge transport in high mobility molecular semiconductors: classical models and new theories

(2011) Alessandro Troisi   CHEMICAL SOCIETY REVIEWS

Mixed quantum-classical simulations of charge transport in organic materials: Numerical benchmark of the Su-Schrieffer-Heeger model

(2011) Linjun Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Standard surface hopping predicts incorrect scaling for Marcus’ golden-rule rate: The decoherence problem cannot be ignored

(2011) Brian R. Landry et al.   JOURNAL OF CHEMICAL PHYSICS

Evaluation of Charge Mobility in Organic Materials: From Localized to Delocalized Descriptions at a First-Principles Level

(2010) Zhigang Shuai et al.   ADVANCED MATERIALS

Communications: A nonperturbative quantum master equation approach to charge carrier transport in organic molecular crystals

(2010) Dong Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Multiscale study of charge mobility of organic semiconductor with dynamic disorders

(2010) Linjun Wang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Quantum dynamic localization in the Holstein Hamiltonian at finite temperatures

(2010) Alessandro Troisi   PHYSICAL REVIEW B

Phonon-Induced Dephasing of Excitons in Semiconductor Quantum Dots: Multiple Exciton Generation, Fission, and Luminescence

(2009) Angeline B. Madrid et al.   ACS Nano

Computational methods for design of organic materials with high charge mobility

(2009) Linjun Wang et al.   CHEMICAL SOCIETY REVIEWS

Transition from dynamic to static disorder in one-dimensional organic semiconductors

(2009) Alessandro Troisi et al.   JOURNAL OF CHEMICAL PHYSICS

Theory of charge transport in organic crystals: Beyond Holstein’s small-polaron model

(2009) Frank Ortmann et al.   PHYSICAL REVIEW B

Nuclear tunneling effects of charge transport in rubrene, tetracene, and pentacene

(2009) Guangjun Nan et al.   PHYSICAL REVIEW B

Charge Transport in Semiconductors with Multiscale Conformational Dynamics

(2009) Alessandro Troisi et al.   PHYSICAL REVIEW LETTERS

Effects of pressure and temperature on the carrier transports in organic crystal: A first-principles study

(2008) L. J. Wang et al.   JOURNAL OF CHEMICAL PHYSICS

A unified theory for charge-carrier transport in organic crystals

(2008) Yuan-Chung Cheng et al.   JOURNAL OF CHEMICAL PHYSICS