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Simulation of phase equilibria for lattice polymers被引量:52收藏 分享
作者:Yan, Qiliang Liu, Honglai Hu, Ying
机构:E CHINA UNIV SCI & TECHNOL
来源:MACROMOLECULES  1996
关键词:Approximation theory - Calculations - Composition - Computer simulation - Molecules - Phase diagrams - Phase equilibria - Thermodynamics - Vaporization  
Gas solubilities in molten polymers based on an equation of state被引量:31收藏 分享
作者:Peng, C.J. Liu, H.L. Hu, Y.
机构:E China Univ Sci & Technol
来源:CHEMICAL ENGINEERING SCIENCE  2001
关键词:molecular thermodynamics   equation of state   gas solubility   molten polymer  
LIQUID-LIQUID EQUILIBRIA FOR SOLUTIONS OF POLYDISPERSE POLYMERS - CONTINUOUS THERMODYNAMICS FOR THE CLOSE-PACKED LATTICE MODEL被引量:24收藏 分享
作者:Hu, Ying Ying, Xugen Wu, D.T. Prausnitz, J.M.
机构:UNIV CALIF BERKELEY;E CHINA UNIV SCI & TECHNOL;DUPONT CO INC;LAWRENCE BERKELEY LAB
来源:MACROMOLECULES  1993
关键词:Computational methods - Describing functions - Mathematical models - Mixtures - Paraffins - Phase diagrams - Phase equilibria - Polystyrenes - Solutions - Thermodynamics  
Molecular thermodynamic theory for polymer systems - III. Equation of state for chain-fluid mixtures被引量:21收藏 分享
作者:Liu, Honglai Hu, Ying
机构:E China Univ Sci & Technol
来源:FLUID PHASE EQUILIBRIA  1997
关键词:molecular thermodynamics   equation of state   vapor-liquid equilibrium   polymer solution  
Monte Carlo simulation for the adsorption of diblock copolymers. I. In nonselective solvent被引量:19收藏 分享
作者:Chen, T. Liu, H. Hu, Y.
机构:E China Univ Sci & Technol
来源:JOURNAL OF CHEMICAL PHYSICS  2001
关键词:Adsorption - Adsorption isotherms - Computer simulation - Conformations - Interfaces (materials) - Mathematical models - Microstructure - Molecular dynamics - Molecular structure - Monte Carlo methods - Reaction kinetics - Surface active agents  
PHASE-EQUILIBRIA FOR COMPLEX-MIXTURES - CONTINUOUS-THERMODYNAMICS METHOD BASED ON SPLINE FIT被引量:18收藏 分享
作者:Ying, Xugeng Ye, Ruqiang Hu, Ying
机构: East China Inst of Chemical
来源:FLUID PHASE EQUILIBRIA  1989
关键词:Mathematical Techniques--Algebra - Thermodynamics--Mathematical Models  
Solid-liquid equilibria based on an equation of state for chain fluids被引量:18收藏 分享
作者:Peng, Changjun Liu, Honglai Hu, Ying
机构:E China Univ Sci & Technol
来源:FLUID PHASE EQUILIBRIA  2001
关键词:molecular thermodynamic model   solid-liquid equilibrium   solubility   normal alkane   aromatic hydrocarbon  
Estimation of vapor-liquid equilibria for polymer solutions by a group-contribution method被引量:16收藏 分享
作者:Hu, Ying Zhou, Hao Liu, Honglai Wu, D.T. Prausnitz, John M.
机构:DUPONT CO INC;UNIV CALIF BERKELEY;UNIV CALIF BERKELEY
来源:FLUID PHASE EQUILIBRIA  1997
关键词:vapor-liquid equilibria   polymer solutions   hydrogen-bonded systems  
Monte Carlo simulations of liquid-liquid equilibria for ternary chain molecule systems on a lattice被引量:13收藏 分享
作者:Jiang, Jianwen Yan, Qiliang Liu, Honglai Hu, Ying
机构:E China Univ Sci & Technol
来源:MACROMOLECULES  1997
关键词:Composition effects - Computer simulation - Crystal lattices - Molecular dynamics - Monte Carlo methods - Vaporization  
Monte Carlo simulation of phase equilibria for random copolymers被引量:11收藏 分享
作者:Chen, Ting Liu, Honglai Hu, Ying
机构:E China Univ Sci & Technol
来源:MACROMOLECULES  2000
关键词:Computer simulation - Homopolymerization - Mathematical models - Molecular structure - Monomers - Monte Carlo methods - Phase equilibria - Random processes - Temperature  
Molecular thermodynamic model for fluids containing associated molecules被引量:11收藏 分享
作者:Liu, Honglai Zhou, Hao Hu, Ying
机构: East China Univ of Science and
来源:CHINESE JOURNAL OF CHEMICAL ENGINEERING  1997
关键词:chemical association   molecular thermodynamics   equation of state   compressibility factor  
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LIQUID-LIQUID EQUILIBRIA FOR SOLUTIONS OF POLYDISPERSE POLYMERS - CONTINUOUS THERMODYNAMICS FOR THE LATTICE FLUID MODEL被引量:11收藏 分享
作者:Hu, Ying Ying, Xugen Wu, D.T. Prausnitz, J.M.
机构:LAWRENCE BERKELEY LAB;E CHINA UNIV SCI & TECHNOL;DUPONT CO INC
来源:FLUID PHASE EQUILIBRIA  1994
关键词:THEORY   POLYMER SOLUTIONS   POLYDISPERSE POLYMERS   CONTINUOUS THERMODYNAMICS   LATTICE FLUID MODEL  
Equations of state for hard-sphere chain fluids and square-well chain fluids被引量:6收藏 分享
作者:Liu, Honglai Rong, Zongming Hu, Ying
机构: East China Univ of Science and
来源:CHINESE JOURNAL OF CHEMICAL ENGINEERING  1996
关键词:equation of state   polymer solution   polymer blend   compressibility factor   second Virial coefficient   statistical theory   chemical association  
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Activity coefficients of NaCl in polyelectrolyte solutions from EMF measurements被引量:5收藏 分享
作者:Yu, C. Zhang, B. Liu, H. Hu, Y.
机构:E China Univ Sci & Technol
来源:FLUID PHASE EQUILIBRIA  2001
关键词:data   activity coefficient   polyeletrolyte solution   electromotive force (EMF)   ion-selective electrode (ISE)  
Thermodynamic properties of unsymmetrical sticky electrolytes with overlap between ions from OrnstEIn-Zernike equation被引量:3收藏 分享
作者:Jiang, Jianwen Liu, Honglai Hu, Ying
机构:E CHINA UNIV CHEM TECHNOL
来源:FLUID PHASE EQUILIBRIA  1997
关键词:statistical mechanics   model   excess properties   electrolyte  
Equation of state for polymer systems被引量:0收藏 分享
作者:Liu, Honglai Hu, Ying
机构: Thermodynamics Research Laboratory
来源:Fluid Phase Equilibria  1998
关键词:Association reactions - Computer simulation - Equations of state of liquids - Hydrogen bonds - Mathematical models - Molecular orientation - Molecular structure - Perturbation techniques - Phase equilibria  
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