Search results for "Coupling"
showing 10 items of 1862 documents
Mixed-valence molecular four-dot unit for quantum cellular automata: Vibronic self-trapping and cell-cell response
2015
Our interest in this article is prompted by the vibronic problem of charge polarized states in the four-dot molecular quantum cellular automata (mQCA), a paradigm for nanoelectronics, in which binary information is encoded in charge configuration of the mQCA cell. Here, we report the evaluation of the electronic levels and adiabatic potentials of mixed-valence (MV) tetra-ruthenium (2Ru(ii) + 2Ru(iii)) derivatives (assembled as two coupled Creutz-Taube complexes) for which molecular implementations of quantum cellular automata (QCA) was proposed. The cell based on this molecule includes two holes shared among four spinless sites and correspondingly we employ the model which takes into accoun…
A Symmetry Adapted Approach to the Dynamic Jahn-Teller Problem
2011
In this article we present a symmetry-adapted approach aimed to the accurate solution of the dynamic Jahn-Teller (JT) problem. The algorithm for the solution of the eigen-problem takes full advantage of the point symmetry arguments. The system under consideration is supposed to consist of a set of electronic levels \({\Gamma }_{1},{\Gamma }_{2}\ldots {\Gamma }_{n}\) labeled by the irreducible representations (irreps) of the actual point group, mixed by the active JT and pseudo JT vibrational modes \({\Gamma }_{1},{\Gamma }_{2}\ldots {\Gamma }_{f}\) (vibrational irreps). The bosonic creation operators b +(Γγ) are transformed as components γ of the vibrational irrep Γ. The first excited vibra…
Spinorial formulation of the GW-BSE equations and spin properties of excitons in two-dimensional transition metal dichalcogenides
2021
In many paradigmatic materials, such as transition metal dichalcogenides, the role played by the spin degrees of freedom is as important as the one played by the electron-electron interaction. Thus an accurate treatment of the two effects and of their interaction is necessary for an accurate and predictive study of the optical and electronic properties of these materials. Despite the fact that the GW-BSE approach correctly accounts for electronic correlations, the spin-orbit coupling effect is often neglected or treated perturbatively. Recently, spinorial formulations of GW-BSE have become available in different flavors in material-science codes. However, an accurate validation and comparis…
Spatiotemporal light-beam compression from nonlinear mode coupling
2017
We experimentally demonstrate simultaneous spatial and temporal compression in the propagation of light pulses in multimode nonlinear optical fibers. We reveal that the spatial beam self-cleaning recently discovered in graded-index multimode fibers is accompanied by significant temporal reshaping and up to four-fold shortening of the injected sub-nanosecond laser pulses. Since the nonlinear coupling among the modes strongly depends on the instantaneous power, we explore the entire range of the nonlinear dynamics with a single optical pulse, where the optical power is continuously varied across the pulse profile.
Mode-coupling crossover in viscous toluene revealed by neutron and light scattering
1998
The dynamics of supercooled toluene, studied in a GHz-THz range by incoherent neutron and depolarized light scattering, is found to be in full accord with mode coupling predictions. Around the susceptibility minimum, neutron spectra are wavenumber independent and proportional to light scattering data; the fast β-relaxation scaling law applies; amplitude and frequency diverge with power laws that extrapolate towards a crossover temperature Tc K.
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.
Coherent Light Harvesting through Strong Coupling to Confined Light
2018
When photoactive molecules interact strongly with confined light modes, new hybrid light–matter states may form: the polaritons. These polaritons are coherent superpositions of excitations of the molecules and of the cavity photon. Recently, polaritons were shown to mediate energy transfer between chromophores at distances beyond the Forster limit. Here we explore the potential of strong coupling for light-harvesting applications by means of atomistic molecular dynamics simulations of mixtures of photoreactive and non-photo-reactive molecules strongly coupled to a single confined light mode. These molecules are spatially separated and present at different concentrations. Our simulations sug…
Quasi-elastic reactions: an interplay of reaction dynamics and nuclear structure
2011
Multinucleon transfer reactions have been investigated in 40Ar+208Pb with the Prisma+Clara set-up. The experimental differential cross sections of different neutron transfer channels have been obtained at three different angular settings taking into account the transmission through the spectrometer. The experimental yields of the excited states have been determined via particle-γ coincidences. In odd Ar isotopes, we reported a signif cant population of 11/2− states, reached via neutron transfer. Their structure matches a stretched conf guration of the valence neutron coupled to vibration quanta.
Magnetoelectric effects in superconductors due to spin-orbit scattering : Nonlinear σ-model description
2021
We suggest a generalization of the nonlinear σ model for diffusive superconducting systems to account for magnetoelectric effects due to spin-orbit scattering. In the leading orders of spin-orbit strength and gradient expansion, it includes two additional terms responsible for the spin-Hall effect and the spin-current swapping. First, assuming a delta-correlated disorder, we derive the terms from the Keldysh path integral representation of the generating functional. Then we argue phenomenologically that they exhaust all invariants allowed in the effective action to the leading order in the spin-orbit coupling (SOC). Finally, the results are confirmed by a direct derivation of the saddle-poi…
Event-Driven Simulation of the Dynamics of Hard Ellipsoids
2008
We introduce a novel algorithm to perform event-driven simulations of hard rigid bodies of arbitrary shape, that relies on the evaluation of the geometric distance. In the case of a monodisperse system of uniaxial hard ellipsoids,we perform molecular dynamics simulations varying the aspect-ratio X0 and the packing fraction phi. We evaluate the translational Dtrans and the rotational Drot diffusion coefficient and the associated isodiffusivity lines in the phi-X0 plane. We observe a decoupling of the translational and rotational dynamics which generates an almost perpendicular crossing of the Dtrans and Drot isodiffusivity lines. While the self intermediate scattering function exhibits stret…