Search results for " Clusters"
showing 10 items of 1091 documents
STABILITY AND SPECTRA OF SMALL 3He-4He CLUSTERS
2005
Diffusion Monte Carlo calculations have been systematically performed to analyze the stability of small mixed 3 He -4 He clusters, as well as their excitation spectra. The picture that emerges is that of systems with strong shell effects whose binding and excitation energies are essentially determined by the monopole properties of an effective Hamiltonian.
Hyperfine transitions in the first overtone mode of hydrogen deuteride
2020
Beyond the metrology and computational challenges associated with molecular hydrogen, key data are expected to assess the physics of simple molecular systems, and even the new physics beyond the standard model. To assist the deciphering of Doppler-free spectra obtained at very high accuracy ($\ensuremath{\sim}{10}^{\ensuremath{-}9})$, we report on hyperfine transitions of HD in the lowest vibrational levels of the ground electronic state. Using the spin-rotation, nuclear spin-spin, and quadrupolar hyperfine couplings determined by means of high-level quantum-chemical calculations, the hyperfine energy levels and the associated line intensity have been obtained by using tensorial momentum al…
Rotational echoes as a tool for investigating ultrafast collisional dynamics of molecules
2019
We show that recently discovered rotational echoes of molecules provide an efficient tool for studying collisional molecular dynamics in high-pressure gases. Our study demonstrates that rotational echoes enable the observation of extremely fast collisional dissipation, at timescales of the order of a few picoseconds, and possibly shorter. The decay of the rotational alignment echoes in ${\mathrm{CO}}_{2}$ gas and ${\mathrm{CO}}_{2}\text{\ensuremath{-}}\mathrm{He}$ mixture up to 50 bar was studied experimentally, delivering collision rates that are in good agreement with the theoretical expectations. The suggested measurement protocol may be used in other high-density media, and potentially …
Ultrafast hybrid plasmonics
2008
Abstract We review our recent studies of electromagnetic coupling and associated temporal dynamics of molecular excitations with plasmonic resonances supported by either localized or extended planar geometries. We focus on coherent interactions between plasmon resonances and molecular excitations, which are experimentally challenging due to the very short (∼10–100 fs) coherence times of plasmons. Recent experimental results and theoretical analysis for observing and controlling coherences between molecular excitations and plasmonic polarizations are shown. Advances will explore new directions in ultrafast coherent control of molecular excited states and energy dissipation processes, as well…
Piecewise static Hamiltonian for an atom in strong laser field
2009
We show that it is possible to use a piecewise constant Hamiltonian to describe the main features of the dynamics of an atom interacting with a laser field. In particular we show that using this approximation we are able to give a good description of the ionization signal, of the HHG spectra and of the attosecond pulses generated by the radiating electron. Finally, we give an explicit formula to evaluate the ionization rate in the time dependent laser field. This formula, which is a generalization of the Landau formula for the ionization rate of an atom in a static electric field, fairly well reproduces the numerical ionization rates for a broad range of laser frequency and intensity. The m…
The Gaia-ESO Survey: Catalogue of Hα emission stars
2015
We discuss the properties of Hα emission stars across the sample of 22035 spectra from the Gaia-ESO Survey internal data release, observed with the GIRAFFE instrument and largely belonging to stars in young open clusters. Automated fits using two independent Gaussian profiles and a third component that accounts for the nebular emission allow us to discern distinct morphological types of Hα line profiles with the introduction of a simplified classification scheme. All in all, we find 3765 stars with intrinsic emission and sort their spectra into eight distinct morphological categories: single-component emission, emission blend, sharp emission peaks, double emission, P-Cygni, inverted P-Cygni…
Polarizabilities of small annulenes from Cholesky CC2 linear response theory
2004
Using recently developed algorithms based on Cholesky decomposition of two-electron integrals to compute response properties at the correlated level, the static and dynamic (at 589 nm) polarizabilities of [4n + 2]-annulenes (n = 1, 2, 3, 4) have been calculated. The results show that the perpendicular component increases along the series linearly with the number of double bonds. The in-plane static polarizability is also increasing linearly with the area of the aromatic ring in the case of the delocalized species. However, linearity is lost for the localized conformations and for the dynamic polarizability. (C) 2004 Elsevier B.V. All rights reserved.
Rotational States of the Helium Trimer in the Symmetry-Adapted Hyperradial-Adiabatic Approach
2003
We have searched for bound rotationally excited states of the helium trimer using the symmetry-adapted hyperradial adiabatic approach. Since the calculated J p = 2+ and J p = 1− potential curves are both completely repulsive, we infer that there are no bound rotational states of 4He3. A recent adiabatic calculation [1] based on the direct solution of the Coriolis-coupled Schrodinger equation agrees with this conclusion.
The virial theorem and the dark matter problem in hybrid metric-Palatini gravity
2012
Hybrid metric-Palatini gravity is a recently proposed theory, consisting of the superposition of the metric Einstein-Hilbert Lagrangian with an f(R) term constructed a la Palatini. The theory predicts the existence of a long-range scalar field, which passes the Solar System observational constraints, even if the scalar field is very light, and modifies the cosmological and galactic dynamics. Thus, the theory opens new possibilities to approach, in the same theoretical framework, the problems of both dark energy and dark matter. In this work, we consider the generalized virial theorem in the scalar-tensor representation of the hybrid metric-Palatini gravity. More specifically, taking into ac…
Ionization of Rydberg atoms by blackbody radiation
2008
We have studied an ionization of alkali-metal Rydberg atoms by blackbody radiation (BBR). The results of the theoretical calculations of ionization rates of Li, Na, K, Rb and Cs Rydberg atoms are presented. Calculations have been performed for nS, nP and nD states which are commonly used in a variety of experiments, at principal quantum numbers n=8-65 and at the three ambient temperatures of 77, 300 and 600 K. A peculiarity of our calculations is that we take into account the contributions of BBR-induced redistribution of population between Rydberg states prior to photoionization and field ionization by extraction electric field pulses. The obtained results show that these phenomena affect …