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Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study; Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study
Lin, SY; Han, KL; He, GZ
刊名CHEMICAL PHYSICS ; CHEMICAL PHYSICS
2001-11-15 ; 2001-11-15
273期:2-3页:169-174
收录类别SCI ; SCI
文章类型Article ; Article
部门归属11015 ; 11015
项目归属1101 ; 1101
WOS标题词Science & Technology ; Science & Technology ; Physical Sciences ; Physical Sciences
类目[WOS]Chemistry, Physical ; Chemistry, Physical ; Physics, Atomic, Molecular & Chemical ; Physics, Atomic, Molecular & Chemical
研究领域[WOS]Chemistry ; Chemistry ; Physics ; Physics
关键词[WOS]ABSORPTION CROSS-SECTION ; ABSORPTION CROSS-SECTION ; HARTLEY BAND ; HARTLEY BAND ; PHOTO-DISSOCIATION ; PHOTO-DISSOCIATION ; AUTOCORRELATION FUNCTION ; AUTOCORRELATION FUNCTION ; WAVE-PACKET ; WAVE-PACKET ; SPECTRA ; SPECTRA ; O-3 ; O-3 ; RECURRENCES ; RECURRENCES ; CONTINUUM ; CONTINUUM ; RESONANCE ; RESONANCE
英文摘要The effects of the transition dipole moment function (TDMF) on the dynamics Of O-3 photodissociation in the Hartley band have been exploited by means of exact 3D time-dependent wavepacket method using the SW potential energy surface [J. Chem. Phys. 78 (1983) 7191]. The calculations show that the explicit inclusion of the TDMF results in slight uniform reductions for the intensities of recurrence peaks of the autocorrelation function and a slight broadening of the absorption spectrum, in comparison with the result where the TDMF is assumed to be constant. The pattern of recurrence structures of the autocorrelation function is essentially unaffected. (C) 2001 Elsevier Science B.V. All rights reserved.; The effects of the transition dipole moment function (TDMF) on the dynamics Of O-3 photodissociation in the Hartley band have been exploited by means of exact 3D time-dependent wavepacket method using the SW potential energy surface [J. Chem. Phys. 78 (1983) 7191]. The calculations show that the explicit inclusion of the TDMF results in slight uniform reductions for the intensities of recurrence peaks of the autocorrelation function and a slight broadening of the absorption spectrum, in comparison with the result where the TDMF is assumed to be constant. The pattern of recurrence structures of the autocorrelation function is essentially unaffected. (C) 2001 Elsevier Science B.V. All rights reserved.
语种英语 ; 英语
原文出处查看原文 ; 查看原文
WOS记录号WOS:000172324600008 ; WOS:000172324600008
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文献类型期刊论文
条目标识符http://cas-ir.dicp.ac.cn/handle/321008/83627
专题中国科学院大连化学物理研究所
作者单位1.Chinese Acad Sci, Ctr Computat Chem, Dalian 116023, Peoples R China
2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China
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Lin, SY,Han, KL,He, GZ. Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study, Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study[J]. CHEMICAL PHYSICS, CHEMICAL PHYSICS,2001, 2001,273, 273(2-3):169-174, 169-174.
APA Lin, SY,Han, KL,&He, GZ.(2001).Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study.CHEMICAL PHYSICS,273(2-3),169-174.
MLA Lin, SY,et al."Effects of the transition dipole moment function on the dynamics of ozone photodissociation: an exact 3D quantum mechanical study".CHEMICAL PHYSICS 273.2-3(2001):169-174.
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