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Linjun Wang
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Computational methods for design of organic materials with high charge mobility
L Wang, G Nan, X Yang, Q Peng, Q Li, Z Shuai
Chemical Society Reviews 39 (2), 423-434, 2010
4942010
Influences of crystal structures and molecular sizes on the charge mobility of organic semiconductors: Oligothiophenes
X Yang, L Wang, C Wang, W Long, Z Shuai
Chemistry of Materials 20 (9), 3205-3211, 2008
3482008
Theoretical Predictions of Size-dependent Carrier Mobility and Polarity in Graphene
MQ Long, L Tang, D Wang, L Wang, Z Shuai
Journal of the American Chemical Society 131 (49), 17728-17729, 2009
3352009
Nuclear tunneling effects of charge transport in rubrene, tetracene, and pentacene
G Nan, X Yang, L Wang, Z Shuai, Y Zhao
Physical Review B 79 (11), 115203, 2009
3202009
A simple solution to the trivial crossing problem in surface hopping
L Wang, OV Prezhdo
The Journal of Physical Chemistry Letters 5 (4), 713-719, 2014
1892014
Flexible Surface Hopping Approach to Model the Crossover from Hopping to Band-like Transport in Organic Crystals
L Wang, D Beljonne
The Journal of Physical Chemistry Letters 4 (11), 1888-1894, 2013
1812013
Multiscale study of charge mobility of organic semiconductor with dynamic disorders
L Wang, Q Li, Z Shuai, L Chen, Q Shi
Physical Chemistry Chemical Physics 12 (13), 3309-3314, 2010
1782010
Maximizing Singlet Fission by Intermolecular Packing
L Wang, Y Olivier, OV Prezhdo, D Beljonne
The Journal of Physical Chemistry Letters 5 (19), 3345-3353, 2014
1762014
Charge separation in semicrystalline polymeric semiconductors by photoexcitation: is the mechanism intrinsic or extrinsic?
F Paquin, G Latini, M Sakowicz, PL Karsenti, L Wang, D Beljonne, ...
Physical review letters 106 (19), 197401, 2011
1702011
Energetics of Electron–Hole Separation at P3HT/PCBM Heterojunctions
G D’Avino, S Mothy, L Muccioli, C Zannoni, L Wang, J Cornil, D Beljonne, ...
The Journal of Physical Chemistry C 117 (25), 12981-12990, 2013
1602013
Global Flux Surface Hopping Approach for Mixed Quantum-Classical Dynamics
L Wang, D Trivedi, OV Prezhdo
Journal of Chemical Theory and Computation 10 (9), 3598-3605, 2014
1562014
Evaluation of Charge Mobility in Organic Materials: From Localized to Delocalized Descriptions at a First‐Principles Level
Z Shuai, L Wang, Q Li
Advanced Materials 23 (9), 1145-1153, 2011
1532011
Time-Domain Ab Initio Modeling of Photoinduced Dynamics at Nanoscale Interfaces
L Wang, R Long, OV Prezhdo
Annual review of physical chemistry 66, 549-579, 2015
1472015
Optical Properties of Oligothiophene Substituted Diketopyrrolopyrrole Derivatives in the Solid Phase: Joint J-and H-Type Aggregation
M Kirkus, L Wang, S Mothy, D Beljonne, J Cornil, RAJ Janssen, ...
The Journal of Physical Chemistry A 116 (30), 7927-7936, 2012
1452012
Toward Quantitative Prediction of Charge Mobility in Organic Semiconductors: Tunneling Enabled Hopping Model
H Geng, Q Peng, L Wang, H Li, Y Liao, Z Ma, Z Shuai
Advanced Materials 24 (26), 3568-3572, 2012
1222012
Theory of charge transport in carbon electronic materials
Z Shuai, L Wang, C Song
Springer Verlag, 2012
1212012
Charge transfer rates in organic semiconductors beyond first-order perturbation: From weak to strong coupling regimes
G Nan, L Wang, X Yang, Z Shuai, Y Zhao
The Journal of chemical physics 130, 024704, 2009
1132009
Roles of inter-and intramolecular vibrations and band-hopping crossover in the charge transport in naphthalene crystal
LJ Wang, Q Peng, QK Li, Z Shuai
The Journal of chemical physics 127, 044506, 2007
1052007
Mixed quantum-classical dynamics for charge transport in organics
L Wang, OV Prezhdo, D Beljonne
Physical Chemistry Chemical Physics 17 (19), 12395-12406, 2015
1022015
Energy Level Alignment and Charge Carrier Mobility in Noncovalently Functionalized Graphene
L Chen, L Wang, Z Shuai, D Beljonne
The Journal of Physical Chemistry Letters 4 (13), 2158-2165, 2013
1022013
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Articles 1–20