Xiaoyan Zheng

发表

Coarse-grained molecular dynamics simulations of photoswitchable assembly and disassembly.

Dong Wang, Z. Shuai, Xiaoyan Zheng, 2013, Nanoscale.

Charge‐Transfer Complex Crystal Based on Extended‐π‐Conjugated Acceptor and Sulfur‐Bridged Annulene: Charge‐Transfer Interaction and Remarkable High Ambipolar Transport Characteristics

Daoben Zhu, W. Hu, Z. Shuai, 2014, Advanced materials.

A “clicked” porphyrin cage with high binding affinity towards fullerenes

Z. Shuai, Huibiao Liu, Yongjun Li, 2014 .

Molecular dynamics simulations of the supramolecular assembly between an azobenzene-containing surfactant and α-cyclodextrin: role of photoisomerization.

Dong Wang, Z. Shuai, Xiaoyan Zheng, 2012, The journal of physical chemistry. B.

Stretching single polymer chains of donor-acceptor foldamers: toward the quantitative study on the extent of folding.

Kai Liu, Dong Wang, S. Ramakrishnan, 2013, Langmuir : the ACS journal of surfaces and colloids.

Anion-binding properties of π-electron deficient cavities in bis(tetraoxacalix[2]arene[2]triazine): a theoretical study.

Dong Wang, Z. Shuai, Xiaoyan Zheng, 2013, The journal of physical chemistry. A.

Understanding the Charge Transport and Polarities in Organic Donor–Acceptor Mixed‐Stack Crystals: Molecular Insights from the Super‐Exchange Couplings

Z. Shuai, Lingyun Zhu, Yuanping Yi, 2015, Advanced materials.

Understanding Lattice Strain‐Controlled Charge Transport in Organic Semiconductors: A Computational Study

Dong Wang, Z. Shuai, Yuanping Yi, 2014 .

Theoretical Prediction of Isotope Effects on Charge Transport in Organic Semiconductors.

Zhigang Shuai, Xiaoyan Zheng, Hua Geng, 2014, The journal of physical chemistry letters.

Molecular dynamics simulations of the supramolecular assembly between an azobenzene-containing surfactant and α-cyclodextrin: role of photoisomerization.

Dong Wang, Z. Shuai, Xiaoyan Zheng, 2012, The journal of physical chemistry. B.