An extensive introduction to spin-orbit coupling (SOC) is presented, starting from a
discussion of the phenomenological operators and general chemical importance of SOC to …

▪ Abstract This review discusses recent quantum scattering calculations on bimolecular
chemical reactions in the gas phase. This theory provides detailed and accurate predictions …

The S-matrix for a scattering system provides the most detailed information about the
dynamics. In this work, we discuss the calculation of S-matrix elements for the A+ BC→ AB+ …

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 …

This article gives a perspective view of some representative experimental information
available on interatomic forces. They play a role in gaseous properties, but modern …

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 …

In this work, we present quantum-mechanical rate constants for the prototypical reaction F
(2P3/2)+ H2 (v= 0, j= 0,…, 5)→ HF (v′, j′)+ H for temperatures ranging from∼ 10 up to …

Activation energies Ea calculated as the negative of the logarithmic derivatives of rate
constants with respect to the inverse of absolute temperature T, are presented for three …

For the reaction between F and HD, giving HF+ D and DF+ H, the rate constants, obtained
from rigorous quantum scattering calculations at temperatures ranging from 350 K down to …

We report a study on the behavior with total angular momentum J of several resonances
occurring at collision energies below or slightly above the reaction barrier in the F+ H 2→ …