成果/Result
- Bio-inspired zwitterionic copolymers for antifouling surface and oil-water separation被引量：44收藏
- 作者：Niu, Jingqi Wang, Hanhan Chen, Jiao Chen, Xueqian Han, Xia Liu, Honglai
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS 2021
- 关键词：Bio-inspired copolymer Zwitterionic polymer Grafting-to Surface modification Antifouling surface Oil-water separation
- Modeling Swelling Behavior of Thermoresponsive Polymer Brush with Lattice Density Functional Theory被引量：28收藏
- 作者：Lian, Cheng Wang, Le Chen, Xueqian Han, Xia Zhao, Shuangliang Liu, Honglai Hu, Ying
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol;Rice Univ;E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：LANGMUIR 2014
- 关键词：Density functional theory - Lattice theory - Phase diagrams
- A mussel-inspired catecholic ABA triblock copolymer exhibits better antifouling properties compared to a diblock copolymer被引量：22收藏
- 作者：Zhai, Yadan Chen, Xueqian Yuan, Zhaobin Han, Xia Liu, Honglai
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：POLYMER CHEMISTRY 2020
- 关键词：Grafting (chemical) - Self assembly - Solutions - Conformations - Molluscs - Surface roughness - Surface treatment - Chains
- Lock/Unlock Mechanism of Solvent-Responsive Binary Polymer Brushes: Density Functional Theory Approach被引量：17收藏
- 作者：Xu, Yuli Chen, Xueqian Han, Xia Xu, Shouhong Liu, Honglai Hu, Ying
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：LANGMUIR 2013
- 关键词：Chains - Dendrimers - Density functional theory - Locks (fasteners)
- Substrate Effect on the Phase Behavior of Polymer Brushes with Lattice Density Functional Theory被引量：12收藏
- 作者：Lian, Cheng Chen, Xueqian Zhao, Shuangliang Lv, Wenjie Han, Xia Wang, Hualin Liu, Honglai
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol;E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：MACROMOLECULAR THEORY AND SIMULATIONS 2014
- 关键词：Dendrimers - Hydrogels - Swelling - Grafting (chemical) - Density functional theory
- Density functional theory for the selective adsorption of small molecules on a surface modified with polymer brushes被引量：10收藏
- 作者：Xu, Yuli Chen, Xueqian Chen, Houyang Xu, Shouhong Liu, Honglai Hu, Ying
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：MOLECULAR SIMULATION 2012
- 关键词：density functional theory weighted density approximation polymer brushes selective adsorption
- Possible Way to Study Cononsolvency in Confinement: A Lattice Density Functional Theory Approach被引量：8收藏
- 作者：Chen, Xueqian Feng, Wei Han, Xia Liu, Honglai
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：LANGMUIR 2017
- 关键词：Binding energy - Lattice theory
- Surface modification by poly(ethylene glycol) with different end-grafted groups: Experimental and theoretical study被引量：3收藏
- 作者：Han, Xia Yuan, Zhaobin Niu, Yapeng Chen, Xueqian Liu, Honglai
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;China Tobacco Henan Ind Co Ltd;East China Univ Sci & Technol
- 来源：BIOINTERPHASES 2021
- 关键词：Iron oxides - Binding energy - Ethylene glycol - Calculations - Polyols - Hydroxylation - Silicon compounds - Silicon wafers - Gold - Polyethylene glycols - Substrates - Wetting
- A free-space density functional theory for polymer adsorption: Influence of packing effect on conformations of polymer被引量：2收藏
- 作者：Chen, Xueqian Chen, Houyang Liu, Honglai Hu, Ying
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL PHYSICS 2011
- 关键词：Conformations - Adsorption - Local density approximation - Free energy - Chains - Lattice theory
- Phase behavior of ionic fluid in charged confinement: An associating polymer density functional theory study被引量：2收藏
- 作者：Cheng, Jin Xu, Jipeng Wang, Sijie Chen, Xueqian Lian, Cheng Liu, Honglai
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：AICHE JOURNAL 2024
- 关键词：electrolyte phase behavior phase diagram polymer density functional theory porous electrode
- Calculation of helium 1D-3D term intervals for 1s nd (n=4-11) states被引量：1收藏
- 作者：He, LM Cao, W Chen, XQ Zhu, YX
- 机构：E China Univ Chem Technol
- 来源：ACTA PHYSICA SINICA 2005
- 关键词：helium Rydberg state many-body perturbation theory (MBPT) configuration wave function term interval
- 接枝聚合物对小分子的选择性吸附研究被引量：1收藏
- 作者：许裕栗 陈学谦 陈厚样 徐首红 刘洪来
- 机构：化学工程国家重点实验室;华东理工大学物理系
- 来源：《物理学报》 2011
- 关键词：密度泛函理论 接枝聚合物 选择性吸附 方阱链
- 摘要：文章应用密度泛函理论研究接枝于壁面的方阱链对二元小分子混合物的选择性吸附特性.系统的Helmholtz剩余自由能泛函被表示为硬球排斥和方阱吸引两部分贡献之和,分别由硬球链流体状态方程和变阱宽方阱链流体状态方程的简单加权密...
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- Zwitterionic sulfobetaine-enabled suppression of cononsolvency in PNIPAM hydrogels被引量：0收藏
- 作者：Xu, Huixia Zhang, Zekai Lu, Hongyu Han, Xia Chen, Xueqian
- 机构：East China Univ Sci & Technol;East China Univ Sci & Technol;East China Univ Sci & Technol
- 来源：COLLOID AND POLYMER SCIENCE 2026
- 关键词：NIPAM Zwitterion Hydrogel Cononsolvency Thermo-response
- 接枝聚合物对小分子的选择性吸附研究被引量：0收藏
- 作者：许裕栗 陈学谦 陈厚样 徐首红 刘洪来
- 机构：化学工程国家重点实验室;华东理工大学物理系
- 来源：《物理学报》 2011
- 关键词：密度泛函理论 接枝聚合物 选择性吸附 方阱链
- 摘要：文章应用密度泛函理论研究接枝于壁面的方阱链对二元小分子混合物的选择性吸附特性.系统的Helmholtz剩余自由能泛函被表示为硬球排斥和方阱吸引两部分贡献之和,分别由硬球链流体状态方程和变阱宽方阱链流体状态方程的简单加权密...
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