The transition state is a key concept in the field of chemistry and is important in the study of
chemical kinetics and reaction dynamics. Chemical reactions in the gas phase are …

Advances in experimental vacuum technology allow the generation of molecular beams
containing oriented molecules. We will focus our review on the so-called collisional …

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 …

Integral cross sections and rate constants for the prototypical chemical reactions of the
fluorine atom with molecular hydrogen and deuterium have been calculated over a wide …

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 …

We develop a theoretical method for solving the quantum mechanical reactive scattering
problem in the presence of external fields based on a hyperspherical coordinate description …

The target of the present paper is the study of chirality effects in molecular dynamics from
both a theoretical and an experimental point of view under the hypothesis of a molecular …

We propose a new method for the direct and efficient evaluation of the Felix Smith's lifetime
Q matrix for reactive scattering problems. Simultaneous propagation of the solution to a set …

We employ coupled three-dimensional (3D) time dependent wave packet formalism in
hyperspherical coordinates for reactive scattering problem on the newly constructed ab initio …

Fundamental entanglement related challenges have prevented quantum-interference-based
control (ie, coherent control) of collisional cross sections from being implemented in the …