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

This review describes advances which have occurred during the past decade in chemical
reaction dynamics using crossed molecular beams. After a brief historical introduction …

▪ Abstract This paper describes the reproducing kernel Hilbert space (RKHS) method for
constructing accurate, smooth, and efficient global potential energy surface (PES) …

A procedure for the transformation from reactant to product Jacobi coordinates is proposed,
which is designed for the extraction of state-to-state reaction probabilities using a time …

Recent quasi-classical trajectory (QCT) calculations of the dynamics of some prototypic
elementary reactions, from state-resolved differential cross-sections (DCS) to thermal rate …

The state-to-state differential cross sections for some atom+ diatom reactions have been
calculated using a new wave packet code, MAD-WAVE3, which is described in some detail …

We review the recent progress achieved in the theoretical description of chemical reactions
at low temperatures. In particular, we discuss the crucial role played by the van der Waals …

The initial state selected time-dependent wave packet method has been extended to
calculate integral cross sections for diatom-diatom chemical reactions without the CS …

A global potential energy surface (PES) for the electronic ground state of the Na+ HF
reactive system is constructed by three-dimensional cubic spline interpolation of 37 000 ab …

The H+ NaF reaction is investigated at the quantum state-resolved level using the time-
dependent wave-packet method based on a set of accurate diabatic potential energy …