Article ID Journal Published Year Pages File Type
5379686 Chemical Physics Letters 2015 5 Pages PDF
Abstract

- We performed the time-dependent wave packet calculation for the title reaction.
- The calculated rate constants on the PES-ZH are larger than that on the DMBE PES.
- The calculated room-temperature rate constants on both PES agree with the experimental estimation.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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