Dissociation of acetaldehyde in moderate strong laser field of was investigated. Singly charged parent ion and fragmental ions and were produced by 800 nm laser of 100 fs pulse duration and recorded by time-of-flight mass spectrometer. The fragment further dissociated to and ions at higher intensity. Ab initio calculated results show that the singly-, doubly-, and triply charged parent ions are stable. So, the dissociation mechanism was not due to Coulomb explosion of multicharged ion. A field-assisted dissociation (FAD) theory, which assumes that only one bond undergoes dissociation while the rest of the molecular geometry stays unchanged, was employed to treat the dissociation dynamics. Accordingly, the dressed potential energy surfaces of the ground state for the parent and the fragment ions were calculated. Corresponding quasiclassical trajectory calculations show that the bond ruptures take place in the order of C–C, C–O, and C–H, agreeing with the observation. The observed angular dependence and charge distribution of the product ions can also be interpreted by the FAD theory.
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15 September 2003
Research Article|
September 15 2003
Dissociation of acetaldehyde in intense laser field: Coulomb explosion or field-assisted dissociation? Available to Purchase
Mohamed E. Elshakre;
Mohamed E. Elshakre
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Lirong Gao;
Lirong Gao
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Xiaoping Tang;
Xiaoping Tang
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Sufan Wang;
Sufan Wang
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Yafei Shu;
Yafei Shu
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Fanao Kong
Fanao Kong
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
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Mohamed E. Elshakre
Lirong Gao
Xiaoping Tang
Sufan Wang
Yafei Shu
Fanao Kong
Institute of Chemistry, Chinese Academy of Sciences, Beijing, 100080, China
J. Chem. Phys. 119, 5397–5405 (2003)
Article history
Received:
March 19 2003
Accepted:
June 17 2003
Citation
Mohamed E. Elshakre, Lirong Gao, Xiaoping Tang, Sufan Wang, Yafei Shu, Fanao Kong; Dissociation of acetaldehyde in intense laser field: Coulomb explosion or field-assisted dissociation?. J. Chem. Phys. 15 September 2003; 119 (11): 5397–5405. https://doi.org/10.1063/1.1598955
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