Chinese Journal of Chemical Physics latest papers http://stacks.iop.org/1674-0068 Founded in 1988, Chinese Journal of Chemical Physics is devoted to reporting new and original experimental and theoretical research on interdisciplinary areas with a strong chemistry and physics foundation. The papers are of interest to a wide community of (..) en-gb Copyright © IOP Publishing 2009 Thu, 01 Jan 1970 00:00:00 GMT Thu, 01 Jan 1970 00:00:00 GMT http://syndication.iop.org/about/ custserv@iop.org (Customer Services) Chinese Journal of Chemical Physics http://images.iop.org/website-logos/ejs_logo.png http://stacks.iop.org/ Continuum Model for Electronic Polarization Based on a Novel Dielectric Response Function http://stacks.iop.org/1674-0068/22/i=5/a=06?rss=2.0 Author(s): Quan-de Wang, Han-yu Wu, Ke-xiang Fu and Xiang-yuan Li<br>Affiliation(s): College of Chemical Engineering, Sichuan University, Chengdu 610065, China Thu, 12 Nov 2009 00:00:00 GMT Density Functional Theory Study on Organic Dye Sensitizers Containing Bis-dimethylfluorenyl Amino Benzofuran http://stacks.iop.org/1674-0068/22/i=5/a=07?rss=2.0 Author(s): Cai-rong Zhang, Zi-jiang Liu, Yu-hong Chen, Jun Ma, Hong-shan Chen and Mei-ling Zhang<br>Affiliation(s): State Key Laboratory of Gansu Advanced Non-ferrous Metal Materials, Lanzhou University of Technology, Lanzhou 730050, China; Department of Applied Physics, Lanzhou University of Technology, Lanzhou 730050, China; Institute of Applied Physics and Computational Mathematics, Beijing 100088, China; Institute of Electronic Information Science and Technology, Lanzhou City Universiy Lanzhou 730070, China; College of Physics and Electronic Engineering, Northwest Normal University, Lanzhou 730070, China Thu, 12 Nov 2009 00:00:00 GMT Efficient Stochastic Simulation Algorithm for Chemically Reacting Systems Based on Support Vector Regression http://stacks.iop.org/1674-0068/22/i=5/a=09?rss=2.0 Author(s): Xin-jun Peng and Yi-fei Wang<br>Affiliation(s): Department of Mathematics, Shanghai Normal University, Shanghai 200234, China; Scientific Computing Key Laboratory of Shanghai Universities, Shanghai 200234, China; Department of Mathematics, Shanghai University, Shanghai 200444, China Thu, 12 Nov 2009 00:00:00 GMT Structures and Hydrogen Bonding Interactions in Urea-water System Studied by All-atom MD Simulation and Chemical Shifts in NMR Spectrum http://stacks.iop.org/1674-0068/22/i=5/a=10?rss=2.0 Author(s): Rong Zhang, Guan-sheng Zhao and Wen-juan Wu<br>Affiliation(s): Lab of Physical Chemistry, College of Pharmacy, Guangdong Pharmaceutical University, Guangzhou 510006, China Thu, 12 Nov 2009 00:00:00 GMT Using PVP/SDS Complex as a Probe to Study the Inclusion Complex of β-cyclodextrin with SDS in Aqueous Solution http://stacks.iop.org/1674-0068/22/i=5/a=15?rss=2.0 Author(s): Xiao-ming Chen, Hai-yang Yang and Ping-sheng He<br>Affiliation(s): Department of Polymer Science and Engineering, University of Science and Technology of China, Hefei 230026, China Thu, 12 Nov 2009 00:00:00 GMT Hydrogen Bonding Character Between the Glycine and BF4- http://stacks.iop.org/1674-0068/22/i=5/a=11?rss=2.0 Author(s): Qin He, Jing Yang and Xiang-jun Meng<br>Affiliation(s): Department of Chemistry, Tangshan Teachers College, Tangshan 063000, China Thu, 12 Nov 2009 00:00:00 GMT Transition Dipole, Charge Transfer, and Electron-hole Coherence in Two-photon Absorption: Visualizations with Two Dimensional Site and Three Dimensional Cube Representations http://stacks.iop.org/1674-0068/22/i=5/a=13?rss=2.0 Author(s): Yuan-zuo Li, Wen-qin Zhang, Xiao-hong Zhao, Feng-cai Ma and Mao-du Chen<br>Affiliation(s): School of Physics and Optoelectronic Technology, and College of Advanced Science and Technology, Dalian University of Technology, Dalian 116024, China; Department of Physics, Liaoning University, Shenyang 110036, China Thu, 12 Nov 2009 00:00:00 GMT Radiation Vulcanization of Magnetorheological Elastomers Based on Silicone Rubber http://stacks.iop.org/1674-0068/22/i=5/a=14?rss=2.0 Author(s): Wei Zhang, Xing-long Gong, Jian-feng Li, Hong Zhu and Wan-quan Jiang<br>Affiliation(s): CAS Key Laboratory of Mechanical Behavior and Design of Materials, Department of Modern Mechanics, University of Science and Technology of China, Hefei 230027, China; Department of Chemistry, University of Science and Technology of China, Hefei 230026, China Thu, 12 Nov 2009 00:00:00 GMT First-principles Band Structures Calculation of Tin-phthalocyanine http://stacks.iop.org/1674-0068/22/i=5/a=08?rss=2.0 Author(s): Yan-ting Yang, Fu-gen Wu and Zhi-gang Wei<br>Affiliation(s): Experimental Education Department, Guangdong University of Technology, Guangzhou 510006, China; College of Light Industry and Chemical Engineering, Gaungdong University of Technology, Guangzhou 510006, China Thu, 12 Nov 2009 00:00:00 GMT Analysis and Verification on the Chain-like Model with Normal Distribution of Magnetorheological Elastomer http://stacks.iop.org/1674-0068/22/i=5/a=16?rss=2.0 Author(s): Miao Yu, Yong-qiang Xia and Xiao-rui Yan<br>Affiliation(s): The Key Lab for Optoelectronic Technology and Systems, Ministry of Education; Department of Optoelectronic Engineering, Chongqing University, Chongqing 400044, China. Thu, 12 Nov 2009 00:00:00 GMT Quasi-classical Trajectory Study of the Intramolecular Isotope Effect in the Reaction O(3P)+H2/HD http://stacks.iop.org/1674-0068/22/i=5/a=12?rss=2.0 Author(s): Qiang Wei, Xing Li and Tie Li<br>Affiliation(s): Department of Applied Physics, Chongqing University of Technology, Chongqing 400050, China; School of Physics and Optoelectronic Technology, Dalian University of Technology, Dalian 116024, China Thu, 12 Nov 2009 00:00:00 GMT Transitional Process of Ploy(N-isopropylacrylamide) in Deuterated Solution http://stacks.iop.org/1674-0068/22/i=5/a=01?rss=2.0 Author(s): Shao-hua Zhang, Yang Chen, Heng Li and Yu-xiang Weng<br>Affiliation(s): Hefei National Laboratory for Physical Sciences at the Microscale, Department of Chemical Physics, University of Science and Technology of China, Hefei 230026, China; Laboratory of Soft Matter Physics, Institute of Physics, Chinese Academy of Sciences; Beijing National Laboratory of Condensed Matter Physics, Beijing 100080, China Thu, 12 Nov 2009 00:00:00 GMT Simulation Study on the Structure and Dynamics of Water in Sodium Tetrafluoroborate/Water http://stacks.iop.org/1674-0068/22/i=5/a=03?rss=2.0 Author(s): Guo-cai Tian, Jian Li and Yi-xin Hua<br>Affiliation(s): Faculty of Materials and Metallurgical Engineering, Kunming University of Science and Technology, Kunming 650093, China Thu, 12 Nov 2009 00:00:00 GMT Molecular Modeling and Design of Arylthioindole Derivatives as Tubulin Inhibitors http://stacks.iop.org/1674-0068/22/i=5/a=05?rss=2.0 Author(s): Si-yan Liao, Ti-fang Miao, Jin-can Chen, Hai-liang Lu and Kang-cheng Zheng<br>Affiliation(s): School of Chemistry and Chemical Engineering, Zhongshan (Sun Yat-Sen) University, Guangzhou 510275, China; Analysis Centre of Guangdong Medical College, Zhanjiang 524023, China Thu, 12 Nov 2009 00:00:00 GMT Molecular Dynamics Simulation of Temperature-dependent Flexibility of Thermophilic Xylose Isomerase http://stacks.iop.org/1674-0068/22/i=5/a=04?rss=2.0 Author(s): Wei Xu, Ping Cai, Ming Yan, Lin Xu and Ping-kai Ouyang<br>Affiliation(s): School of Chemical and Biological Engineering, Yancheng Institute of Technology, Yancheng 224051, China; State Key Laboratory of Materials-Oriented Chemical Engineering, College of Life Science and Pharmacy, Nanjing University of Technology, Nanjing 210009, China Thu, 12 Nov 2009 00:00:00 GMT Phase Behavior of Liquid Crystals Formed in [C12mim]CI/H2O and [C12mim]CI/Alcohols Systems http://stacks.iop.org/1674-0068/22/i=5/a=02?rss=2.0 Author(s): Mei-shan Pei, Zhi-yan Wu, Lu-yan Wang, Xin-zhou Wu and Xu-tang Tao<br>Affiliation(s): School of Chemistry and Chemical Engineering, University of Jinan, Ji'nan 250022, China; State Key Laboratory of Crystal Material, Shandong University, Ji'nan 250100, China Thu, 12 Nov 2009 00:00:00 GMT