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    Chinese Abstracts
    2017, 30(6): I-Ⅱ.
    Abstract PDF
    Crossed Molecular Beam Study of H+CH4 and H+CD4 Reactions: Vibrationally Excited CH3/CD3 Product Channels
    Wen-tao Chen, Sheng-rui Yu, Dao-fu Yuan, Ting Xie, Jia-yue Yang, Si-wen Wang, Chang Luo, Yu-xin Tan, Yue Miao, Wei-qing Zhang, Guo-rong Wu, Xue-ming Yang, Xing-an Wang
    2017, 30(6): 609-613. DOI: 10.1063/1674-0068/30/cjcp1711215
    Abstract PDF
    Efficient Preparation of D2 Molecules in v=2 by Stimulated Raman Pumping
    Tian-gang Yang, Long Huang, Tao Wang, Chun-lei Xiao, Dong-xu Dai, Xue-ming Yang
    2017, 30(6): 614-618. DOI: 10.1063/1674-0068/30/cjcp1711221
    Abstract PDF
    Direct Vibrational Energy Transfer in Monomeric Water Probed with Ultrafast Two Dimensional Infrared Spectroscopy
    De-xia Zhou, Qian-shun Wei, Hong-tao Bian, Jun-rong Zheng
    2017, 30(6): 619-625. DOI: 10.1063/1674-0068/30/cjcp1710189
    Abstract PDF
    Photoelectron Spectroscopic Study of Methanol Adsorbed Rutile TiO2(110) Surface
    Qun-qing Hao, Zhi-qiang Wang, Dong-xu Dai, Chuan-yao Zhou, Xue-ming Yang
    2017, 30(6): 626-630. DOI: 10.1063/1674-0068/30/cjcp1711219
    Abstract PDF
    Ionization Suppression of Heteronuclear Diatomic and Triatomic Molecules in Strong Infrared Laser Fields
    Lei Zhao, Rui Wang, Shi-wen Zhang, Tian-xiang Yang, Yi Lian, Hang Lv, Hai-feng Xu
    2017, 30(6): 631-636. DOI: 10.1063/1674-0068/30/cjcp1711209
    Abstract PDF
    Coherent Exciton-Phonon Coupling in CdSe/ZnS Nanocrystals Studied by Two-Dimensional Electronic Spectroscopy
    Rui Wang, Xin-yu Huang, Chun-feng Zhang, Xiao-yong Wang, Min Xiao
    2017, 30(6): 637-642. DOI: 10.1063/1674-0068/30/cjcp1711222
    Abstract PDF
    Modification of Surface Reactivity by CO: Effects on Decomposition and Polymerization of Acetaldehyde on Ru(0001)
    Xiao Chen, Fang-liang Li, Qing Guo, Dong-xu Dai, Xue-ming Yang
    2017, 30(6): 643-648. DOI: 10.1063/1674-0068/30/cjcp1711214
    Abstract PDF
    Long-lived Single Excitons, Trions, and Biexcitons in CdSe/CdTe Type-Ⅱ Colloidal Quantum Wells
    Jun-hui Wang, Gui-jie Liang, Kai-feng Wu
    2017, 30(6): 649-656. DOI: 10.1063/1674-0068/30/cjcp1711206
    Abstract PDF
    Contacted Ion Pairs in Aqueous CuCl2 by the Combination of Ratio Spectra, Difference Spectra, Second Order Difference Spectra in the UV-Visible Spectra
    Si-wen Ju, Ning Zhang, Zhi-qiang Wang, Rui-ting Zhang, De-wen Zeng, Xiao-peng Shao, Ke Lin
    2017, 30(6): 657-663. DOI: 10.1063/1674-0068/30/cjcp1711211
    Abstract PDF
    Experimental and Theoretical Study of Deprotonation of DNA Adenine Cation Radical
    Jia-long Jie, Chen Wang, Hong-mei Zhao, Di Song, Hong-mei Su
    2017, 30(6): 664-670. DOI: 10.1063/1674-0068/30/cjcp1710198
    Abstract PDF
    A Highly Sensitive Femtosecond Time-Resolved Sum Frequency Generation Vibrational Spectroscopy System with Simultaneous Measurement of Multiple Polarization Combinations
    Junjun Tan, Yi Luo, Shuji Ye
    2017, 30(6): 671-677. DOI: 10.1063/1674-0068/30/cjcp1706114
    Abstract PDF
    Infrared Spectra and Theoretical Calculations of BS2 and BS2-: Strong Pseudo Jahn-Teller Effect
    Jie Zhao, Wen-jie Yu, Teng-fei Huang, Xue-feng Wang
    2017, 30(6): 678-684. DOI: 10.1063/1674-0068/30/cjcp1711201
    Abstract PDF
    Exploring the Interactions of Atomic Oxygen on Silver Clusters with Hydrogen
    Xi-zi Cao, Bao-qi Yin, Ting-ting Wang, Xiao-peng Xing
    2017, 30(6): 685-690. DOI: 10.1063/1674-0068/30/cjcp1710193
    Abstract PDF
    Infrared-Vacuum Ultraviolet Spectroscopic and Theoretical Study of Neutral Trimethylamine Dimer
    Bing-bing Zhang, Xiang-tao Kong, Shu-kang Jiang, Zhi Zhao, Hua Xie, Ce Hao, Dong-xu Dai, Xue-ming Yang, Ling Jiang
    2017, 30(6): 691-695. DOI: 10.1063/1674-0068/30/cjcp1711213
    Abstract PDF
    Mechanistic Insights into the Photophysics of Ortho-hydroxyl GFP Core Chromophores
    Wei-wei Guo, Ye-guang Fang, Qiu Fang, Gang-long Cui
    2017, 30(6): 696-704. DOI: 10.1063/1674-0068/30/cjcp1709179
    Abstract PDF
    Ab initio Quantum Mechanics/Molecular Mechanics Molecular Dynamics Simulation of CO in the Heme Distal Pocket of Myoglobin
    Xian-wei Wang, John Z. H. Zhang, Xiao He
    2017, 30(6): 705-716. DOI: 10.1063/1674-0068/30/cjcp1709169
    Abstract PDF
    Structural and Electronic Properties of ConC3-/0 and ConC4-/0 (n=1-4) Clusters: Mass-Selected Anion Photoelectron Spectroscopy and Density Functional Theory Calculations
    Xi-ling Xu, Jin-yun Yuan, Bin Yang, Hong-guang Xu, Wei-jun Zheng
    2017, 30(6): 717-726. DOI: 10.1063/1674-0068/30/cjcp1710197
    Abstract PDF
    Accelerating the Construction of Neural Network Potential Energy Surfaces: A Fast Hybrid Training Algorithm
    Yao-long Zhang, Xue-yao Zhou, Bin Jiang
    2017, 30(6): 727-734. DOI: 10.1063/1674-0068/30/cjcp1711212
    Abstract PDF
    Understanding Molecular Dynamics with Stochastic Processes via Real or Virtual Dynamics
    De-zhang Li, Zi-fei Chen, Zhi-jun Zhang, Jian Liu
    2017, 30(6): 735-760. DOI: 10.1063/1674-0068/30/cjcp1711223
    Abstract PDF
    An Exact Propagator for Solving the Triatomic Reactive Schrödinger Equation
    Xue-ming Li, Zhi-gang Sun
    2017, 30(6): 761-770. DOI: 10.1063/1674-0068/30/cjcp1711220
    Abstract PDF
    Quasiparticle Band Structures of Defects in Anatase TiO2 Bulk
    Ting-wei Chen, Ya-nan Hao, Yu-chen Ma
    2017, 30(6): 771-775. DOI: 10.1063/1674-0068/30/cjcp1711217
    Abstract PDF
    The Role of High Excitations in Constructing Sub-spectroscopic Accuracy Intermolecular Potential of He-HCN: Critically Examined by the High-Resolution Spectra with Resonance States
    Dan Hou, Xiao-Long Zhang, Yu Zhai, Hui Li
    2017, 30(6): 776-788. DOI: 10.1063/1674-0068/30/cjcp1712231
    Abstract PDF
    Comparison of Accuracy and Convergence Rate between Equilibrium and Nonequilibrium Alchemical Transformations for Calculation of Relative Binding Free Energy
    Peng-fei Li, Xiang-yu Jia, Mei-ting Wang, Ye Mei
    2017, 30(6): 789-799. DOI: 10.1063/1674-0068/30/cjcp1711204
    Abstract PDF
    Ultrafast Electron Transfer with Symmetrical Quasi-classical Dynamics based on Mapping Hamiltonian and Quantum Dynamics based on ML-MCTDH
    Jie Zheng, Yu Xie, Sheng-shi Jiang, Yun-ze Long, Xin Ning, Zheng-gang Lan
    2017, 30(6): 800-810. DOI: 10.1063/1674-0068/30/cjcp1711210
    Abstract PDF
    Salting-in/Salting-out Mechanism of Carbon Dioxide in Aqueous Electrolyte Solutions
    Xia Zhang, Lu Zhang, Tan Jin, Zhi-jun Pan, Zhe-ning Chen, Qiang Zhang, Wei Zhuang
    2017, 30(6): 811-816. DOI: 10.1063/1674-0068/30/cjcp1711230
    Abstract PDF