Photoexcitation of NO embedded in rare gas matrices triggers a shock-wave like radial
perturbation of the surrounding rare gas atoms. In this Letter, we present quantum dynamical …

Molecular dynamics with quantum transitions approach is employed to simulate the
spectroscopic characteristics of the 1P1↔ 1S0 transitions in atomic zinc and cadmium in …

The ultrafast geometrical rearrangement dynamics of NO doped cryogenic Ne matrices after
femtosecond laser pulse excitation is studied using a quantum dynamical approach based …

We perform a theoretical study on the electronic spectroscopy of dilute NO impurity
embedded in parahydrogen (pH 2)⁠. Absorption and emission lineshapes for the A Σ 2+← X …

The energetics of the optical excitation of the lowest Rydberg state of a nitric oxide molecule
embedded in a neon matrix and the subsequent rearrangement of the solid host are …

A high-dimensional quantum wave packet approach based on Gaussian wave packets in
Cartesian coordinates is presented. In this method, the high-dimensional wave packet is …

A molecular dynamics deposition model has been used to simulate the growth of rare gas
matrices doped with atoms of the group 12 elements zinc, cadmium and mercury. This study …

A hopping-surface algorithm has been used to simulate the dynamics induced in rare gas
matrices due to the photoexcitation (1S0→ 3P1) of atomic mercury embedded in them …

Molecular dynamics simulations of NO-doped Ar solid upon Rydberg photoexcitation of the
impurity have been carried out taking into account angular dependent potential energy …

The local relaxation of solid neon subsequent to the impulsive excitation of the NO
chromophore to its A (3sσ) Ryberg state is investigated using molecular dynamics …