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    Chinese Abstract
    2007, 20(3)
    Abstract PDF
    Electron Transfer Dynamics in Solution Using Imaginary-time Split Operator Approach
    Wen-juan Zhu, Miao-miao Han, Yi Zhao
    2007, 20(3): 217-223. DOI: 10.1088/1674-0068/20/03/217-223
    Abstract PDF
    Theoretical Study of Decomposition Mechanism of Azoisobutyronitrile
    Xue-fei Lin, Cheng-ke Sun, Si-ya Yang, Zong-he Li
    2007, 20(3): 224-232. DOI: 10.1088/1674-0068/20/03/224-232
    Abstract PDF
    Heat Capacity and GrAuneisen Parameter for GaN with Zinc-Blende Structure
    Xiao-wei Sun, Zi-jiang Liu, Ting Song, Xiao-bin Liu, Cheng-wei Wang, Qi-feng Chen
    2007, 20(3): 233-236. DOI: 10.1088/1674-0068/20/03/233-236
    Abstract PDF
    Characterization of V5+/TiO2-Rutile Using Molecular Dynamics Simulations
    Li-pen Zhang, Hai-bo Pan, Jin-ling Huang
    2007, 20(3): 237-242. DOI: 10.1088/1674-0068/20/03/237-242
    Abstract PDF
    Theoretical Investigation of CH3CF2O2+HOO Reaction
    Xue-li Cheng, Gui-xin Li, Zuo-mao Wang, Yan-yun Zhao, Yi-feng Sun
    2007, 20(3): 243-248. DOI: 10.1088/1674-0068/20/03/243-248
    Abstract PDF
    Theoretical Study on Mechanism of C5H7·+O2 Reaction
    Wei Tan, Tian-jing He, Fan-chen Liu, Dong-ming Chen
    2007, 20(3): 249-257. DOI: 10.1088/1674-0068/20/03/249-257
    Abstract PDF
    DSC Study on Cooperative Relaxation in 1,2-propanediol
    Cai Gao, Tie-jun Wang, Xiang-nong Liu, Guo-yan Zhou, Tse-chao Hua
    2007, 20(3): 258-264. DOI: 10.1088/1674-0068/20/03/258-264
    Abstract PDF
    Calculations for Spin-allowed Transitions Between Energy Levels Above the 3s3p State in Si III
    Jing Fan, Tian-yi Zhang, Neng-wu Zheng, Dong-xia Ma, Tao Wang
    2007, 20(3): 265-272. DOI: 10.1088/1674-0068/20/03/265-272
    Abstract PDF
    Absorption Spectra and Photoreactivity of Para-aminobenzophenone by Time-dependent Density Functional Theory
    Xue-mei Cheng, Yao Huang, Jian-yi Ma, Xiang-yuan Li
    2007, 20(3): 273-278. DOI: 10.1088/1674-0068/20/03/273-278
    Abstract PDF
    Effect of Surface Impurities on Oscillation in NO+CO/Pt(100) Reaction System
    Jin-jun Liu, Da-yin Hua, Luo-luo Jiang
    2007, 20(3): 279-284. DOI: 10.1088/1674-0068/20/03/279-284
    Abstract PDF
    Study of (2, 0) Band of A2∏u-X2∑+ g System of N2+ by Optical Heterodyne Detected Velocity Modulation Spectroscopy
    Yan-dan Wu, Jin-wen Ben, Ling Li, Li-juan Zheng, Yang-qin Chen, Xiao-hua Yang
    2007, 20(3): 285-290. DOI: 10.1088/1674-0068/20/3/285-290
    Abstract PDF
    First Principle Calculation of Electric and Magnetic Properties for New Half-metal Fe2ScO4
    Jun Liu, Xin-qiang Wang, Yu Liu, Hui-ning Dong
    2007, 20(3): 291-296. DOI: 10.1088/1674-0068/20/03/291-296
    Abstract PDF
    Characterization of C12A7-O- Catalyst and Mechanism of Phenol Formation by Hydroxylation of Benzene
    Ting Dong, Zhao-xiang Wang, Tao Kan, Quan-xin Li
    2007, 20(3): 297-304. DOI: 10.1088/1674-0068/20/03/297-304
    Abstract PDF
    Growth of 3C-SiC Films on On-axis 6H-SiC Substrates by LPCVD
    Hai-wu Zheng, Zhu-xi Fu, Bi-xia Lin, Xiao-guang Li
    2007, 20(3): 305-307. DOI: 10.1088/1674-0068/20/03/305-307
    Abstract PDF
    Preparation and Photoluminescence of ZnO Comb-Like Structure and Nanorod Arrays
    Song Yin, Yi-qing Chen, Yong Su, Qing-tao Zhou
    2007, 20(3): 308-314. DOI: 10.1088/1674-0068/20/03/308-314
    Abstract PDF
    Gas Sensing Properties of Co3O4-loaded SnO2 to Ethanol and Acetone
    Ming-ming Zhang, Guo-shun Jiang
    2007, 20(3): 315-318. DOI: 10.1088/1674-0068/20/03/315-318
    Abstract PDF
    Synthesis and Electrorheological Properties of LTNO-PS Composites
    Jia-xiang Hou, Lei Shi, Shi-ming Zhou, Qing-ren Zhu
    2007, 20(3): 319-323. DOI: 10.1088/1674-0068/20/03/319-323
    Abstract PDF
    Effects of Neutron Irradiation on Superconducting Properties of GdBa2Cu3O7-δ Single Domain Superconductor
    Hong Zhang, Guang Li, Tao-fei Zhou, Yong Liu, Xiao-guang Li, Yu Chen
    2007, 20(3): 324-328. DOI: 10.1088/1674-0068/20/03/324-328
    Abstract PDF