Experimental and theoretical study of the photoionization and dissociative photoionizations of carbon tetrachloride

被引:19
|
作者
Li, QX
Ran, Q
Chen, CX
Yu, SQ
Ma, XX
Sheng, LS
Zhang, YW
Li, WK
机构
[1] CHINESE UNIV HONG KONG, DEPT CHEM, SHA TIN, NT, HONG KONG
[2] UNIV SCI & TECHNOL CHINA, DEPT CHEM PHYS, HEFEI 230026, ANHUI, PEOPLES R CHINA
[3] UNIV SCI & TECHNOL CHINA, NATL SYNCHROTRON RADIAT LAB, HEFEI 230026, ANHUI, PEOPLES R CHINA
基金
中国国家自然科学基金;
关键词
ab initio calculations; photoionization; synchrotron radiation;
D O I
10.1016/0168-1176(95)04349-7
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
The photoionization and dissociative photoionizations of carbon tetrachloride have been studied both experimentally and theoretically. In experiments, we have combined the techniques of synchrotron radiation, molecular beam and mass spectrometry to obtain the photoionization efficiency spectra for CCl3+, CCl2+, CCl+, C+ and Cl+. Thus we have measured the appearance energies of these ion fragments, which in turn lead to the various dissociation energies (Do) for CCln+ and CCln. Computationally, we have also obtained the D-0 values by the ab initio Gaussian-2 method. The two sets of D-0 values are in good agreement with each other.
引用
收藏
页码:29 / 36
页数:8
相关论文
共 50 条
  • [31] An experimental and numerical study of the thermal oxidation of carbon tetrachloride
    Lou, JC
    Chou, ZH
    HAZARDOUS WASTE & HAZARDOUS MATERIALS, 1996, 13 (03): : 399 - 407
  • [32] A theoretical study on dissociative photoionization and photoionization cross-sections of a typical ketohydroperoxide in n-butane low-temperature oxidation
    Huang, Jiabin
    Huang, Can
    Hou, Qifeng
    Wu, Mengqi
    Wu, Xiaoqing
    Zhang, Yaogang
    Tian, Guangjun
    Zhang, Feng
    COMBUSTION AND FLAME, 2023, 257
  • [33] Photoionization and dissociative photoionization study of HFC-152a using synchrotron radiation
    Huang, CQ
    Wei, LX
    Yang, B
    Yang, R
    Wang, SS
    Shan, XB
    Qi, F
    Zhang, YW
    Sheng, LS
    Hao, LQ
    Zhou, SK
    Wang, ZY
    ACTA PHYSICA SINICA, 2006, 55 (03) : 1083 - 1088
  • [34] Photoionization and dissociation study of p-nitrotoluene: Experimental and theoretical insights
    Zhang, Qiang
    Fang, Wenzheng
    Xie, Yang
    Cao, Maoqi
    Zhao, Yujie
    Shan, Xiaobin
    Liu, Fuyi
    Wang, Zhenya
    Sheng, Liusi
    JOURNAL OF MOLECULAR STRUCTURE, 2012, 1020 : 105 - 111
  • [35] Experimental and theoretical study of core-valence double photoionization of OCS
    Niskanen, J.
    Carravetta, V.
    Vahtras, O.
    Agren, H.
    Aksela, H.
    Andersson, E.
    Hedin, L.
    Linusson, P.
    Eland, J. H. D.
    Karlsson, L.
    Rubensson, J. -E.
    Feifel, R.
    PHYSICAL REVIEW A, 2010, 82 (04):
  • [36] Experimental and theoretical study of linear and circular dichroism in helium double photoionization
    Kheifets, A
    Bray, I
    Soejima, K
    Danjo, A
    Okuno, K
    Yagishita, A
    JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1999, 32 (17) : L501 - L509
  • [37] Abstraction Reactions of Heavy Cyclobutenes with Carbon Tetrachloride. A Theoretical Study
    Chen, Chi-Hui
    Hsiao, Jun
    Su, Ming-Der
    JOURNAL OF PHYSICAL CHEMISTRY A, 2009, 113 (15): : 3602 - 3609
  • [38] Theoretical and Experimental Studies of the Dechlorination Mechanism of Carbon Tetrachloride on a Vivianite Ferrous Phosphate Surface
    Jeon, Keonghee
    Lee, Nara
    Bae, Sungjun
    Goddard, William A., III
    Kim, Hyungjun
    Lee, Woojin
    JOURNAL OF PHYSICAL CHEMISTRY A, 2015, 119 (22): : 5714 - 5722
  • [39] Experimental and quantum-chemical studies on photoionization and dissociative photoionization of CH2Br2
    Chiang, SY
    Fang, YS
    Sankaran, K
    Lee, YP
    JOURNAL OF CHEMICAL PHYSICS, 2004, 120 (07): : 3270 - 3276
  • [40] Lethal effect of carbon K-shell photoionizations in Chinese hamster V79 cell nuclei: Experimental method and theoretical analysis
    du Penhoat, MAH
    Fayard, B
    Abel, F
    Touati, A
    Gobert, F
    Despiney-Bailly, I
    Ricoul, M
    Sabatier, L
    Stevens, DL
    Hill, MA
    Goodhead, DT
    Chetioui, A
    RADIATION RESEARCH, 1999, 151 (06) : 649 - 658