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From Reactive Rainbow to Dynamic Resonance Well.

作者信息

Pan Huilin, Liu Shu, Zhang Dong H, Liu Kopin

机构信息

Institute of Atomic and Molecular Sciences (IAMS), Academia Sinica, Taipei 10617, Taiwan.

Southern University of Science and Technology, Shenzhen 518055, P. R. China.

出版信息

J Phys Chem Lett. 2020 Nov 5;11(21):9446-9452. doi: 10.1021/acs.jpclett.0c02916. Epub 2020 Oct 27.

DOI:10.1021/acs.jpclett.0c02916
PMID:33108183
Abstract

Scattering resonance is a fascinating phenomenon which manifests as a peak or a dip in an observable as a function of collisional energy (). Its occurrence requires a potential well to support the resonance states. In this regard, reactive resonance is unusual in that it can exist in a reaction with unbound Born-Oppenheimer potential energy surface, on which the quasi-bound states are dynamically trapped-meaning that some energy is temporarily tied to the other degrees of freedom than the reaction coordinate. The concept of vibrational adiabaticity has been the cornerstone in understanding this phenomenon, for which the vibrationally adiabatic well depth is of primary concern. Recent studies on the F + CHD reaction have accumulated compelling evidence for a dominant resonance-mediated pathway at low as well as for a rainbow feature in pair-correlated angular distribution at higher . Here, we report an in-depth study to not only substantiate both claims but also, more importantly, make the first attempt to quantify the vibrationally adiabatic well depth directly from the observed rainbow structure and then compare with the theoretical prediction.

摘要

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