Intramolecular vibrational energy redistribution (IVR) impacts the dynamics of reactions in a
profound way. Theoretical and experimental studies are increasingly indicating that …

Chaotic transport in Hamiltonian systems is often restricted due to the presence of partial
barriers, leading to a limited flux between different regions in phase space. Typically, the …

Recent progress towards understanding the mechanism of dynamical tunneling in
Hamiltonian systems with three or more degrees of freedom (DoF) is reviewed. In contrast to …

Isoxazoles are an important class of organic compounds widely employed in synthesis and
drug design. Fragmentation chemistry of the parent isoxazole molecule and its substituents …

This is a study, certainly not the first one, about the phenomenon of intramolecular
vibrational energy redistribution (IVR)—its mechanism and impact on the reaction rate …

The adiabatic separation of large-amplitude torsional motion from small-amplitude vibrations
is applied as an aid in interpreting the results of fully coupled quantum calculations on a …

Chemical dynamics simulations, based on both an analytic potential energy surface (PES)
and direct dynamics, were used to investigate the intrinsic non-RRKM dynamics of the Cl …

We show that reliable control of dynamical localization (DL) in the context of generic
Hamiltonians subjected to periodic fields can be achieved by solely reshaping the field …