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

The effect of acoustic phonon scattering on the carrier mobility in the semiconducting zigzag single wall carbon nanotubes

(2010) B. Xu et al.   APPLIED PHYSICS LETTERS

Multiscale study of charge mobility of organic semiconductor with dynamic disorders

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

Charge carrier scattering by defects in semiconductors

(2010) Vincenzo Lordi et al.   PHYSICAL REVIEW B

First-principles calculations of electron mobilities in silicon: Phonon and Coulomb scattering

(2009) O. D. Restrepo et al.   APPLIED PHYSICS LETTERS

Computational methods for design of organic materials with high charge mobility

(2009) Linjun Wang et al.   CHEMICAL SOCIETY REVIEWS

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

(2009) Guangjun Nan et al.   PHYSICAL REVIEW B

How Perfect Can Graphene Be?

(2009) P. Neugebauer et al.   PHYSICAL REVIEW LETTERS

The role of acoustic phonon scattering in charge transport in organic semiconductors: a first-principles deformation-potential study

(2009) Ling Tang et al.   Science in China. Series B, Chemistry

Influences of Crystal Structures and Molecular Sizes on the Charge Mobility of Organic Semiconductors: Oligothiophenes

(2008) Xiaodi Yang et al.   CHEMISTRY OF MATERIALS

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

Polarization Energies in Oligoacene Semiconductor Crystals

(2008) Joseph E. Norton et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Insights into Current Limitations of Density Functional Theory

(2008) A. J. Cohen et al.   SCIENCE

Intermolecular Potentials

(2008) A. J. Stone   SCIENCE

Theoretical study on non-covalent functionalization of armchair carbon nanotube by tetrathiafulvalene molecule

(2007) Niya Sa et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES