▪ Abstract This article reviews recent progress in our understanding of gas-phase neutral reaction dynamics as made possible by improvements in the crossed molecular beam …
Conclusive evidence is presented for the existence of a reactive resonance in the F+ HD reaction. In a molecular beam experiment, the resonance appears in the integral cross …
We have studied the reaction F+ HD at low collision energies using a combination of experimental and theoretical methods. Clear evidence for a reactive resonance is found in …
TX Xie, Y Zhang, MY Zhao, KL Han - Physical Chemistry Chemical …, 2003 - pubs.rsc.org
In this paper, the three-dimensional time-dependent quantum wave packet calculation has been employed to study the non-adiabatic reaction dynamics of F+ HD on three …
W Hu, GC Schatz - The Journal of chemical physics, 2006 - pubs.aip.org
This paper is an overview of the theory of reactive scattering, with emphasis on fully quantum mechanical theories that have been developed to describe simple chemical …
The workability of beyond Born-Oppenheimer theory to construct diabatic potential energy surfaces (PESs) of a charge transfer atom-diatom collision process has been explored by …
F Dong, SH Lee, K Liu - The Journal of Chemical Physics, 2000 - pubs.aip.org
Complementary to our recent report on the FHD reaction, the reactive excitation functions for the other isotopomers are presented. Through analysis of the differential cross section data …
A general quantum-mechanical method for computing kinetic isotope effects is presented. The method is based on the quantum-instanton approximation for the rate constant and on …
The dynamics of the H+ H2+ reaction has been analyzed from the electronically first excited state of diabatic potential energy surfaces constructed by employing the Beyond Born …