Full-Dimensional Quantum Dynamical Studies of the Cl + HOD → HCl/DCl + OD/OH Reaction: Bond Selectivity and Isotopic Branching Ratio

Full-Dimensional Quantum Dynamical Studies of the Cl + HOD → HCl/DCl + OD/OH Reaction: Bond Selectivity and Isotopic Branching Ratio

Full-dimensional quantum dynamical calculations are carried out to study the mode specificity, bond selectivity, and isotopic branching ratio of the Cl + HOD reaction on an accurate global potential energy surface. Total reaction cross sections have been computed for several low-lying vibrational st...

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Bibliographic Details
Main Authors: Song, Hongwei, Lee, Soo-Ying, Lu, Yunpeng, Guo, Hua
Other Authors: School of Physical and Mathematical Sciences
Format: Article
Language:English
Published: 2016
Subjects:
Vector projection
Isotopes
Online Access:https://hdl.handle.net/10356/81534
http://hdl.handle.net/10220/39601
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Institution: Nanyang Technological University
Language: English

Internet

https://hdl.handle.net/10356/81534
http://hdl.handle.net/10220/39601

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