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Title: State-to-state integral cross section for the H + H2O → H2 + OH abstraction reaction
Authors: Zhang, D.H. 
Xie, D. 
Yang, M. 
Lee, S.-Y. 
Issue Date: 31-Dec-2002
Citation: Zhang, D.H.,Xie, D.,Yang, M.,Lee, S.-Y. (2002-12-31). State-to-state integral cross section for the H + H2O → H2 + OH abstraction reaction. Physical Review Letters 89 (28 I) : 283203/1-283203/4. ScholarBank@NUS Repository.
Abstract: An overview is given on the first five dimensional (5D) state-to-state integral cross sections (ICS) for the H + H2O → H2(v1,j1)+OH(j2) reaction for the initial ground vibrational state. Since three of the four atoms are hydrogens, the system is an ideal candidate for pursuing both high quality ab initio calculation of a potential energy surface (PES) and accurate quantum reactive scattering calculations.
Source Title: Physical Review Letters
ISSN: 00319007
Appears in Collections:Staff Publications

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