Atomic and Molecular Clusters
During the last years some interesting experimental results have been reported for experiments in N20, N0 , N0 dimer , H2 , Toluene and BaFCH3 cluster. The main result consists in the observation of molecular beam depletion when the…
We explore a new fashion, named energy-resolved population image (EPI), to represent on an equal footing the temporary electronic transition and nuclear motion during laser-molecular interaction. By using the EPI we have intuitively…
Clusters excited by intense laser pulses are a unique source of warm dense matter, that has been the subject of intensive experimental studies. The majority of those investigations concerns atomic clusters, whereas the evolution of…
The chemical and physical properties of molecular clusters can heavily depend on their size, which makes them very attractive for the design of new materials with tailored properties. Deriving the structure and dynamics of clusters is…
A nonadiabatic scheme for the description of the coupled electron and nuclear motions in the ozone molecule was proposed recently. An initial coherent nonstationary state was prepared as a superposition of the ground state and the excited…
Particle-dimer scattering below and above the three-body threshold is studied using Faddeev differential equations. Correllations between the observables are shown and some analogies between three-nucleon and three-atom systems are…
A dispersion-corrected density functional theory study of the photosensitizer [Ir(ppy)$_2$(bpy)]$^+$ and its derivatives bound to silver clusters Ag$_n$ ($n$=2-20, 92) is performed. The goal is to provide a new system-specific set of…
By means of non-adiabatic quantum molecular dynamics it is shown, that the amount of energy deposited into $\text{C}_{60}$ by a short laser field strongly depends on the molecular orientation with respect to the laser polarization…
The optical properties of a weak probe field in a duplicated two-level system are investigated in multiphoton resonance (MPR) condition and beyond it. It is shown that, by changing the relative phase of applied fields, the absorption…
Using both quantum and semi-classical methods, we calculate the rates for radiative association and charge transfer in cold collisions of Yb+ with Ca.
We investigate from a practitioner's point of view the computation of the ionization potential (IP) within density functional theory (DFT). DFT with (semi-)local energy-density functionals is plagued by a self-interaction error which…
We propose and demonstrate a momentum filter for atomic gas based on a designed Talbot-Lau interferometer. It consists in two identical optical standing wave pulses separated by a delay equal to odd multiples of the half Talbot time. The…
The non-relativistic three-body Schr\"odinger equation of the heteronuclear molecular ion HD$^+$ is solved in perimetric coordinates using the Lagrange-mesh method. Energies and wave functions of the four lowest vibrational bound or…
A coherent superposition of two electronic states of ozone (ground and Hartley B) is prepared with a UV pump pulse. Using the multiconfiguration time-dependent Hartree approach, we calculate the subsequent time evolution of the two…
The ionization dynamics of pure He nanodroplets irradiated by EUV radiation is studied using Velocity-Map Imaging PhotoElectron-PhotoIon COincidence (VMI-PEPICO) spectroscopy. We present photoelectron energy spectra and angular…
In a closed quantum system of N coupled spins with magnetic quantum number I, there are about (2I + 1)^N constants of motion. However, the possibility of observing such quasi-invariant (QI) states in solid-like spin systems in Nuclear…
The dynamic polarizabilities of the 4s, 3d and 4p states of Ca$^+$, are calculated using a relativistic structure model. The wavelengths at which the Stark shifts between different pairs of transitions are zero are computed. Experimental…
The present study shows that the positrophilic electrons of a molecule dock into the positron attractive potential region in the annihilation process under the plane-wave approximation. The positron-electron annihilation processes of both…
We use time-dependent density functional theory to calculate the energy loss of an antiproton colliding with a small Al cluster previously excited. The velocity of the antiproton is such that non-linear effects in the electronic response of…
High order harmonic generation from clusters is a controversial topic: conflicting theories exist, with different explanations for similar experimental observations. From an experimental point of view, separating the contributions from…