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    Chinese Abstracts
    2017, 30(1): I-Ⅱ.
    Abstract PDF
    Acetone Formation from Photolysis of 2-Propanol on Anatase-TiO2(101)
    Zhen-hua Geng, Xiao Chen, Qing Guo, Dong-xu Dai, Xue-ming Yang
    2017, 30(1): 1-6. DOI: 10.1063/1674-0068/30/cjcp1608170
    Abstract PDF
    Experimental and Density Functional Theory Calculation Studies on Raman and Infrared Spectra of 1,1'-Binaphthyl-2,2'-diamine
    Zhen-lin Zhang, Wen-lou Wang, Shi-lin Liu, Dong-ming Chen
    2017, 30(1): 7-15. DOI: 10.1063/1674-0068/30/cjcp1606118
    Abstract PDF
    Differential Cross Sections for the H+D2O→HD+OD Reaction: a Full Dimensional State-to-State Quantum Dynamics Study
    Zhi-qiang Zhao, Shu Liu, Dong H. Zhang
    2017, 30(1): 16-24. DOI: 10.1063/1674-0068/30/cjcp1608163
    Abstract PDF
    Molecular Dynamics Simulation Study of ClF in Water: Halogen Bonding Interaction in Liquid
    Yu-feng Ye, Cen-feng Fu, Shan-xi Tian
    2017, 30(1): 25-28. DOI: 10.1063/1674-0068/30/cjcp1608157
    Abstract PDF
    Imaging Molecular Orbitals of Single Picene Molecules Adsorbed on Cu(111) Surface: a Combined Experimental and Theoretical Study
    Chun-sheng Zhou, Huan Shan, Bin Li, Ai-di Zhao
    2017, 30(1): 29-35. DOI: 10.1063/1674-0068/30/cjcp1606123
    Abstract PDF
    g-C3N4/SnS2 Heterostructure: a Promising Water Splitting Photocatalyst
    Shao-hua Chen, Jia-jun Wang, Jing Huang, Qun-xiang Li
    2017, 30(1): 36-42. DOI: 10.1063/1674-0068/30/cjcp1605113
    Abstract PDF
    Theoretical Study of Isoprene Dissociative Photoionization
    Qiao Ma, Ming-qiang Huang, Xian-yun Liu, Yan-bo Gai, Xiao-xiao Lin, Cheng-qiang Yang, Liu-si Sheng, Xiao-bin Shan, Wei-jun Zhang
    2017, 30(1): 43-49. DOI: 10.1063/1674-0068/30/cjcp1606131
    Abstract PDF
    High Resolution Synchrotron Diffraction Study on Charge Density Distribution of Ampicillin Trihydrate
    C. Anzline, S. Israel, R. Niranjana Devi, R. A. J. R. Sheeba, P. Richard Rajkumar
    2017, 30(1): 50-62. DOI: 10.1063/1674-0068/30/cjcp1607143
    Abstract PDF
    Solvent Effects on Two-Photon Absorption of Alkyne and Alkene π-bridging Chromophores
    Jing Li, Chuan-kui Wang, Yu-zhi Song
    2017, 30(1): 63-70. DOI: 10.1063/1674-0068/30/cjcp1607142
    Abstract PDF
    Molecular Dynamics Study of Hydrogen Dissociation on Pd Surfaces using Reactive Force Fields
    Yue-mei Sun, Xiang-jian Shen, Xiao-hong Yan
    2017, 30(1): 71-76. DOI: 10.1063/1674-0068/30/cjcp1605096
    Abstract PDF
    Theoretical Simulations of Irradiation-Induced Sputtering at Tungsten Surface
    Xue-min Hua, Hai-yan He, Wen-yi Ding, Ru Ding, Jun-ling Chen, Bi-cai Pan
    2017, 30(1): 77-82. DOI: 10.1063/1674-0068/30/cjcp1607138
    Abstract PDF
    Calculation of Surface Excitation Parameters by a Monte Carlo Method
    Zhe Zheng, Bo Da, Shi-feng Mao, Ze-jun Ding
    2017, 30(1): 83-89. DOI: 10.1063/1674-0068/30/cjcp1607146
    Abstract PDF
    Catalytic Performance of Graphite Oxide Supported Au Nanoparticles in Aerobic Oxidation of Benzyl Alcohol: Support Effect
    Yu-jia Huo, Fan-fan Yao, Yun-sheng Ma
    2017, 30(1): 90-96. DOI: 10.1063/1674-0068/30/cjcp1604088
    Abstract PDF
    Narrow Band Gap and Roomtemperature Ferromagnetism in KNb1-xFexO3-δ
    Dan Nie, Jiang Zhang, Wen-ji Deng, Xi Chen, Zhong-quan Mao, Ling-yun Tang
    2017, 30(1): 97-102. DOI: 10.1063/1674-0068/30/cjcp1608154
    Abstract PDF
    Preparation of Li4Ti5O12 Microspheres with a Pure Cr2O3 Coating Layer and its Effect for Lithium Storage
    Hai-lin Zou, Xin Liang, Zhong-hui Wang, Sheng Cheng, Hong-fa Xiang
    2017, 30(1): 103-111. DOI: 10.1063/1674-0068/30/cjcp1607152
    Abstract PDF
    Electrochemical Preparation of Polypyrrole/Graphene Films on Titanium Mesh as Active Materials for Supercapacitors
    Jun-hao Chen, Xia-yu Feng, Wu-feng Chen, Yu-qing Song, Li-feng Yan
    2017, 30(1): 112-116. DOI: 10.1063/1674-0068/30/cjcp1604092
    Abstract PDF
    Real-Time Observation of Pyoverdine Dissolving Ferric Hydroxide
    Jia-hong Li
    2017, 30(1): 117-122. DOI: 10.1063/1674-0068/30/cjcp1605114
    Abstract PDF