25th anniversary article: key points for high‐mobility organic field‐effect transistors

H Dong, X Fu, J Liu, Z Wang, W Hu - Advanced materials, 2013 - Wiley Online Library
Remarkable progress has been made in develo** high performance organic field‐effect
transistors (OFETs) and the mobility of OFETs has been approaching the values of …

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

A Troisi - Chemical Society Reviews, 2011 - pubs.rsc.org
The theories developed since the fifties to describe charge transport in molecular crystals
proved to be inadequate for the most promising classes of high mobility molecular …

Computational methods for design of organic materials with high charge mobility

L Wang, G Nan, X Yang, Q Peng, Q Li… - Chemical Society …, 2010 - pubs.rsc.org
Charge carrier mobility is at the center of organic electronic devices. The strong couplings
between electrons and nuclear motions lead to complexities in theoretical description of …

First-principles investigation of anistropic hole mobilities in organic semiconductors

SH Wen, A Li, J Song, WQ Deng, KL Han… - The Journal of …, 2009 - ACS Publications
We report a simple first-principles-based simulation model (combining quantum mechanics
with Marcus− Hush theory) that provides the quantitative structural relationships between …

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

G Nan, X Yang, L Wang, Z Shuai, Y Zhao - Physical Review B—Condensed …, 2009 - APS
The mechanism of charge transport in organic materials is still controversial from both
experimental and theoretical perspectives. At room temperature, molecular deformations …

Theoretical study of the organic photovoltaic electron acceptor PCBM: Morphology, electronic structure, and charge localization

DL Cheung, A Troisi - The Journal of Physical Chemistry C, 2010 - ACS Publications
The electronic structure of the lowest unoccupied orbitals of [6, 6]-phenyl-C61-butyric acid
methyl ester (PCBM) is computed using a combination of classical molecular dynamics …

Influence of alkyl side-chain length on the carrier mobility in organic semiconductors: Herringbone vs. pi–pi stacking

Z Ma, H Geng, D Wang, Z Shuai - Journal of Materials Chemistry C, 2016 - pubs.rsc.org
The influence of the alkyl side-chains on the electronic structures, molecular packing and
charge transport for five naphthalene diimide (NDI) derivatives, four [1] benzoselenopheno …

Multiscale study of charge mobility of organic semiconductor with dynamic disorders

L Wang, Q Li, Z Shuai, L Chen, Q Shi - Physical Chemistry Chemical …, 2010 - pubs.rsc.org
The impact of dynamic disorder arising from the thermal fluctuations on the charge transport
in organic semiconductors is studied by a multi-scale approach combining molecular …

How to design more efficient hole-transporting materials for perovskite solar cells? Rational tailoring of the triphenylamine-based electron donor

YL Xu, WL Ding, ZZ Sun - Nanoscale, 2018 - pubs.rsc.org
Designed with a symmetrical naphthatetrathiophene (NTT) core and triphenylamine (TPA)-
based side arms, a series of novel organic small molecule hole-transporting materials are …

Organic Single‐Crystalline Semiconductors for Light‐Emitting Applications: Recent Advances and Developments

R Ding, MH An, J Feng, HB Sun - Laser & Photonics Reviews, 2019 - Wiley Online Library
Organic single‐crystalline semiconductors (OSCSs), as a vital branch of organic
semiconductors, have recently attracted intense interest due to their numerous advantages …