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科研成果


期刊论文

2021
45. Shilong Wu, Huanhuan Yang, Wen-Sheng Xu, and Quan Chen*. “Thermodynamics and Reaction Kinetics of Symmetric Vitrimers Based on Dioxaborolane Metathesis,” Macromolecules 2021, in press.
44. Xiaolei Xu, Jack F. Douglas, and Wen-Sheng Xu*. “Influence of Side-Chain Length and Relative Rigidities of Backbone and Side Chains on Glass Formation of Branched Polymers,” Macromolecules 2021, 54, 6327-6341.
43. Jack F. Douglas* and Wen-Sheng Xu*, “Equation of State and Entropy Theory Approach to Thermodynamic Scaling in Polymeric Glass-Forming Liquids,” Macromolecules 2021, 54, 3247-3269.
42. 刘爱清, 徐文生*, 徐晓雷*, 陈继忠*, 安立佳. 高分子/棒状纳米粒子复合物的分子动力学模拟. 高等学校化学学报 2021, 42, 875-883.
41. Wen-Sheng Xu*, Jack F. Douglas*, and Zhao-Yan Sun*, “Polymer Glass Formation: Role of Activation Free Energy, Configurational Entropy, and Collective Motion,” Macromolecules 2021, 54, 3001-3033.
40. Ai-Qing Liu, Li-Jun Liu*, Wen-Sheng Xu*, Xiao-Lei Xu*, Ji-Zhong Chen*, and Li-Jia An, "Stress-Structure Relationship of the Reversible Associating Polymer Network under Start-up Shear Flow," Chinese Journal of Polymer Science 2021, 39, 387-396.

2020
39. Wen-Sheng Xu*, Jack F. Douglas*, and Xiaolei Xu*, “Role of Cohesive Energy in Glass Formation of Polymers with and without Bending Constraints,” Macromolecules 2020, 53, 9678-9697.
38. Wen-Sheng Xu*, Jack F. Douglas*, Wenjie Xia*, and Xiaolei Xu*, “Understanding Activation Volume in Glass-Forming Polymer Melts via Generalized Entropy Theory,” Macromolecules 2020, 53, 7239-7252.
37. Wen-Sheng Xu*, Jack F. Douglas*, Wenjie Xia*, and Xiaolei Xu*, “Investigation of the Temperature Dependence of Activation Volume in Glass-Forming Polymer Melts under Variable Pressure Conditions,” Macromolecules 2020, 53, 6828-6841.
36. Wen-Sheng Xu*, Jack F. Douglas*, and Xiaolei Xu*, “Molecular Dynamics Study of Glass Formation in Polymer Melts with Varying Chain Stiffness,” Macromolecules 2020, 53, 4796-4809.
35. Wen-Sheng Xu and Wenjie Xia*, “Energy Renormalization for Coarse-Graining Polymers with Different Fragilities: Predictions from the Generalized Entropy Theory,” Macromolecular Theory and Simulations 2020, 29, 1900051. (Selected as the cover article)
 
2019
34.  Xinyi Wang, Wen-Sheng Xu, Hao Zhang*, and Jack F. Douglas*, “Universal nature of dynamic heterogeneity in glass-forming liquids: A comparative study of metallic and polymeric glass-forming liquids,” The Journal of Chemical Physics 2019, 151, 184503.
33.  Wenjie Xia*, Nitin K. Hansoge, Wen-Sheng Xu, Frederick R. Phelan Jr., Sinan Keten*, and Jack F. Douglas*, “Energy renormalization for coarse-graining polymers having different segmental structures,” Science Advances 2019, 5, eaav4683.
 
开展独立工作之前
 
2019
32. Wen-Sheng Xu, Christopher N. Lam, Jan-Michael Y. Carrillo, Bobby G. Sumpter, and Yangyang Wang*, “Comment on “Relating Chain Conformations to Extensional Stress in Entangled Polymer Melts”,” Physical Review Letters 2019, 122, 059803.
 
2018
31. Christopher N. Lam#, Wen-Sheng Xu#, Wei-Ren Chen, Zhe Wang, Christopher B. Stanley, Jan-Michael Y. Carrillo, David Uhrig, Weiyu Wang, Kunlun Hong, Yun Liu, Lionel Porcar, Changwoo Do, Gregory S. Smith, Bobby G. Sumpter, and Yangyang Wang*, “Scaling Behavior of Anisotropy Relaxation in Deformed Polymers,” Physical Review Letters 2018, 121, 117801.
30. Wen-Sheng Xu, Jan-Michael Y. Carrillo, Christopher N. Lam, Bobby G. Sumpter, and Yangyang Wang*, “Molecular Dynamics Investigation of the Relaxation Mechanism of Entangled Polymers after a Large Step Deformation,” ACS Macro Letters 2018, 7, 190-195.
 
2017
29. Wen-Sheng Xu*, Jack F. Douglas*, and Karl F. Freed*, “Influence of Pressure on Glass Formation in a Simulated Polymer Melt,” Macromolecules 2017, 50, 2585-2598.
28. Xiaozheng Duan, Ran Zhang, Mingming Ding*, Qingrong Huang, Wen-Sheng Xu*, Tongfei Shi*, and Lijia An, “Adsorption of a Hydrophobic Cationic Polypeptide onto Acidic Lipid Membrane,” Polymer 2017, 122, 125-138.
27. Xiaozheng Duan, Yang Zhang, Liangyi Li, Ran Zhang, Mingming Ding*, Qingrong Huang, Wen-Sheng Xu*, Tongfei Shi*, and Lijia An, “Effects of Concentration and Ionization Degree of Anchoring Cationic Polymers on the Lateral Heterogeneity of Anionic Lipid Monolayers,” The Journal of Physical Chemistry B 2017, 121, 984-994.
 
2016
26. Wen-Sheng Xu*, Jack F. Douglas*, and Karl F. Freed*, “Generalized entropy theory of glass-formation in fully flexible polymer melts,” The Journal of Chemical Physics 2016, 145, 234509.
25. Wen-Sheng Xu*, Jack F. Douglas*, and Karl F. Freed*, “Stringlike Cooperative Motion Explains the Influence of Pressure on Relaxation in a Model Glass-Forming Polymer Melt,” ACS Macro Letters 2016, 5, 1375-1380.
24. WEN-SHENG XU, JACK F. DOUGLAS, and KARL F. FREED, “ENTROPY THEORY OF POLYMER GLASS-FORMATION IN VARIABLE SPATIAL DIMENSION,” Advances in Chemical Physics 2016, 161, 443-497.
23. Wen-Sheng Xu*, Jack F. Douglas*, and Karl F. Freed*, “Influence of Cohesive Energy on Relaxation in a Model Glass-Forming Polymer Melt,” Macromolecules 2016, 49, 8355-8370.
22. Wen-Sheng Xu*, Jack F. Douglas*, and Karl F. Freed*, “Influence of Cohesive Energy on the Thermodynamic Properties of a Model Glass-Forming Polymer Melt,” Macromolecules 2016, 49, 8341-8354.
21. Xiaozheng Duan, Ran Zhang, Yang Zhang, Mingming Ding*, Tongfei Shi*, Lijia An, Qingrong Huang, and Wen-Sheng Xu*, “Monte Carlo study on a complex of cationic polymers and anionic lipid monolayer,” Polymer 2016, 104, 138-148.
20. Xiaozheng Duan, Yang Zhang, Ran Zhang, Mingming Ding*, Tongfei Shi*, Lijia An, Qingrong Huang, and Wen-Sheng Xu*, “Spatial Rearrangement and Mobility Heterogeneity of an Anionic Lipid Monolayer Induced by the Anchoring of Cationic Semiflexible Polymer Chains,” Polymers 2016, 8, 235.
19. Wen-Sheng Xu* and Karl F. Freed*, “Self-assembly and glass-formation in a lattice model of telechelic polymer melts: Influence of stiffness of the sticky bonds,” The Journal of Chemical Physics 2016, 144, 214903.
 
2015
18. Wen-Sheng Xu* and Karl F. Freed*, “Lattice model of linear telechelic polymer melts. II. Influence of chain stiffness on basic thermodynamic properties,” The Journal of Chemical Physics 2015, 143, 024902.
17. Wen-Sheng Xu* and Karl F. Freed*, “Lattice model of linear telechelic polymer melts. I. Inclusion of chain semiflexibility in the lattice cluster theory,” The Journal of Chemical Physics 2015, 143, 024901.
16. Wen-Sheng Xu*, Xiaozheng Duan*, Zhao-Yan Sun*, and Li-Jia An*, “Glass formation in a mixture of hard disks and hard ellipses,” The Journal of Chemical Physics 2015, 142, 224506.
15. Xiaozheng Duan, Mingming Ding, Ran Zhang, Liangyi Li, Tongfei Shi*, Lijia An, Qingrong Huang, and Wen-Sheng Xu*, “Effects of Chain Rigidity on the Adsorption of a Polyelectrolyte Chain on Mixed Lipid Monolayer: A Monte Carlo Study,” The Journal of Physical Chemistry B 2015, 119, 6041-6049.
14. Wen-Sheng Xu* and Karl F. Freed, “Generalized Entropy Theory of Glass Formation in Polymer Melts with Specific Interactions,” Macromolecules 2015, 48, 2333–2343.
13. Wen-Sheng Xu*, Zhao-Yan Sun*, and Li-Jia An*, “Relaxation dynamics in a binary hard-ellipse liquid,” Soft Matter 2015, 11, 627-634.
 
2014
12. Wen-Sheng Xu* and Karl F. Freed*, “Influence of Cohesive Energy and Chain Stiffness on Polymer Glass Formation,” Macromolecules 2014, 47, 6990-6997.
11. Wen-Sheng Xu* and Karl F. Freed*, “Lattice cluster theory for polymer melts with specific interactions,” The Journal of Chemical Physics 2014, 141, 044909.
10. Yan-Wei Li, Wen-Sheng Xu, and Zhao-Yan Sun*, “Growing point-to-set length scales in Lennard-Jones glass-forming liquids,” The Journal of Chemical Physics 2014, 140, 124502.
 
2013
9. Wen-Sheng Xu, Yan-Wei Li, Zhao-Yan Sun*, and Li-Jia An*, “Hard ellipses: Equation of state, structure, and self-diffusion,” The Journal of Chemical Physics 2013, 139, 024501. (Selected as the cover article)
8. Wen-Sheng Xu and Karl F. Freed*, “Thermodynamic scaling of dynamics in polymer melts: Predictions from the generalized entropy theory,” The Journal of Chemical Physics 2013, 138, 234501.
 
2012
7. Wen-Sheng Xu, Zhao-Yan Sun*, and Li-Jia An*, “Effect of attractions on correlation length scales in a glass-forming liquid,” Physical Review E 2012, 86, 041506. (Selected as Kaleidoscope)
6. Wen-Sheng Xu, Zhao-Yan Sun*, and Li-Jia An, “Structure, compressibility factor and dynamics of highly size-asymmetric binary hard-disk liquids,” The Journal of Chemical Physics 2012, 137, 104509.
5. Wen-Sheng Xu, Zhao-Yan Sun*, and Li-Jia An*, “Dynamics and correlation length scales of a glass-forming liquid in quiescent and sheared conditions,” Journal of Physics: Condensed Matter 2012, 24, 325101.
4. Wen-Sheng Xu, Zhao-Yan Sun*, and Li-Jia An, “Diffusive redistribution of small spheres in crystallization of highly asymmetric binary hard-sphere mixtures,” EPL 2012, 97, 66007.
 
2011
3. W.-S. Xu, Z.-Y. Sun*, and L.-J. An*, “Assembly of body-centered cubic crystals in hard spheres,” The European Physical Journal E 2011, 34, 47.
 
2010
2. W.-S. Xu, Z.-Y. Sun*, and L.-J. An*, “Dense packing in the monodisperse hard-sphere system: A numerical study,” The European Physical Journal E 2010, 31, 377-382.
1. Wen-Sheng Xu, Zhao-Yan Sun*, and Li-Jia An*, “Heterogeneous crystallization of hard spheres on patterned substrates,” The Journal of Chemical Physics 2010, 132,144506.
 
注:星号(*)表示通讯作者,井号(#)表示共同一作