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
- Lattice density functional theory for confined Ising fluids: comparison between different functional approximations in slit pore被引量：28收藏
- 作者：Chen, Xueqian Feng, Wei Liu, Honglai Hu, Ying
- 机构： State Key Laboratory of Chemical and Engineering and Department of Physics; State Key Laboratory of Chemical and Engineering and Department of Chemistry
- 来源：Molecular Physics 2016
- 关键词：Entropy - Lattice theory - Local density approximation - Approximation theory - Ising model - Intelligent systems
- 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
- 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
- 氦原子1snd（n=4-11）组态下^1D-^3D谱项分裂值的计算被引量：2收藏
- 作者：贺黎明 曹伟 陈学谦 朱云霞
- 机构：华东理工大学物理系
- 来源：《物理学报》 2005
- 关键词：氦原子,Rydberg态,多体微扰,组态波函数,能级分裂 计算表 氦原子 分裂 谱项 组态 多体微扰理论 Rydberg态 近似算法 束缚态
- 摘要：利用多体微扰理论(MBPT)计算了氦原子1snd(n=4—11)组态的1D—3D谱项分裂值.基于两种不同的模型分别计算RaylEIgh-Shr dinger微扰展开式中仅含束缚态的部分和包含连续态的部分.对于束缚态,较严...
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- 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
- 氦原子Rydberg态^1D—^3D谱项分裂值的多体微扰计算被引量：0收藏
- 作者：陈学谦 贺黎明 曹伟 朱云霞
- 机构：华东理工大学物理系
- 来源：《华东理工大学学报（自然科学版）》 2004
- 关键词：氦原子 Rydberg态 能级分裂 多体微扰 组态波函数
- 摘要：通过自洽迭代求解Hartree方程得到各组态下的轨道波函数。以此构造组态波函数为基矢,对氦Rydberg态1snd组态的1D-3D谱项分裂值进行了多体微扰计算,计算结果与实验结果符合得较好。对于由同科电子构成的组态,由于...
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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
