Abstract

A three-dimensional quasiclassical trajectory study of the Li→HF→LiF+H reaction has been performed on a recently proposed analytical potential energy surface (PES) fitted to ab initio points. The results of the calculations are compared with the experiment. Previous related work on a semiempirical PES is noted.

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call

Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.