引用次数
引用: 36,111
H-指数: 105
I10-指数 : 362
出版物: 544
Charge Transport inPerylene Diimides Based n-type Organic Semiconductors
Hua Geng , Zhigang Shuai , Yi Luo , Lili Lin
2012
Theory of Charge Transport in Carbon Electronic Materials
Chenchen Song , Zhigang Shuai , Linjun Wang
23
2012
Intrinsic Charge Transport in Stanene: Roles of Bucklings and Electron-Phonon Couplings
Tianqi Zhao , Wen Shi , Jinyang Xi , Zhigang Shuai
arXiv: Chemical Physics
49
2017
A General Automatic Method for Optimal Construction of Matrix Product Operators Using Bipartite Graph Theory
Jiajun Ren , Zhigang Shuai , Weitang Li , Tong Jiang
arXiv: Chemical Physics
18
2020
Molecular Design Strategy for Simultaneously Strong Luminescence and High Mobility: Multichannel CH-π Interaction.
Hua Geng , Yi Liao , Qi Ou , Zhigang Shuai
Journal of Physical Chemistry Letters 12 ( 2) 938 -946
11
2021
Influences of dynamic and static disorder on the carrier mobility of BTBT-C12 derivatives: a multiscale computational study
Zhigang Shuai , Qikai Li , Xingliang Peng
Nanoscale 13 ( 5) 3252 -3262
4
2021
Theoretical Characterizations of TADF Materials: Roles of ΔG and the Singlet-Triplet Excited States Interconversion.
Qi Ou , Zhigang Shuai , Qian Peng , Lu Wang
Journal of Physical Chemistry A 125 ( 7) 1468 -1475
29
2021
Elucidating the Electronic Structure of a Delayed Fluorescence Emitter via Orbital Interactions, Excitation Energy Components, Charge-Transfer Numbers, and Vibrational Reorganization Energies.
Felix Plasser , Qi Ou , Zhigang Shuai , Yuezhi Mao
Journal of Physical Chemistry Letters 12 ( 11) 2712 -2720
24
2021
International chemistry for a sustainable society
Zhigang Shuai
National Science Review 8 ( 5) 1 -1
1
2021
Abnormal Seebeck effect in doped conducting polymers
Zhigang Shuai , Yufei Ge , Ran Liu
Applied Physics Letters 118 ( 12) 123301
7
2021
Aggregation-Enhanced Thermally Activated Delayed Fluorescence Efficiency for Two-Coordinate Carbene–Metal–Amide Complexes: A QM/MM Study
Qi Ou , Zhigang Shuai , Qian Peng , Shiyun Lin
Journal of Physical Chemistry Letters 12 ( 11) 2944 -2953
2021
Tuning carrier injection barriers by self-assembled monolayers – a theoretical view
Egbert Zojer , Ferdinand Rissner , Gerold Rangger , Georg Heimel
9th International Symposium on Functional -Electron Systems
2010
Understanding the Temperature Dependence of the Seebeck Coefficient from First-Principles Band Structure Calculations for Organic Thermoelectric Materials
Zhigang Shuai , Yufei Ge , Ran Liu , Dong Wang
CCS Chemistry 1477 -1483
8
2021
Structure-property relationships for multi-photon absorption: A quantum-chemical study
Egbert Zojer , David Beljonne , Stephen Barlow , Peter Pacher
ACS March meeting
2006
Intrinsic hydroquinone-functionalized aggregation-induced emission core shows redox and pH sensitivity
Xiaoyong Zhang , Yen Wei , Yen Wei , Jinying Yuan
Communications Chemistry 4 ( 1) 1 -9
5
2021
Theoretical modelling of carrier transports in molecular semiconductors: molecular design of triphenylamine dimer systems.
Xiaodi Yang , Qikai Li , Zhigang Shuai
Nanotechnology 18 ( 42) 424029 -424029
158
2007
Excited states structure and processes: Understanding organic light-emitting diodes at the molecular level
Zhigang Shuai , Qian Peng
Physics Reports 537 ( 4) 123 -156
199
2014
Single Crystalline Nanotubes from Small Organic Molecules
Yong Sheng Zhao , Wensheng Yang , Debao Xiao , Xiaohai Sheng
Chemistry of Materials 20 ( 19) 6288 -6288
2
2008
Effect of donor length on electronic structures and charge transport polarity for DTDPP-based D–A copolymers: a computational study based on a super-exchange model
Feifei He , Changli Cheng , Hua Geng , Yuanping Yi
Journal of Materials Chemistry 6 ( 25) 11985 -11993
19
2018
Computational methods for design of organic materials with high charge mobility
Linjun Wang , Guangjun Nan , Xiaodi Yang , Qian Peng
Chemical Society Reviews 39 ( 2) 423 -434
447
2010