Franck-Condon Factors as Spectral Probes of Polaron Structure

We apply the Merrifield variational method to the Holstein molecular crystal model in D dimensions to compute non-adiabatic polaron band energies and Franck-Condon factors at general crystal momenta. We analyze these observable properties to extract characteristic features related to polaron self-trapping and potential experimental signatures. These results are combined with others obtained by the Global-Local variational method in 1D to construct a polaron phase diagram encompassing all degrees of adiabaticity and all electron-phonon coupling strengths. The polaron phase diagram so constructed includes disjoint regimes occupied by "small" polarons, "large" polarons, and a newly-defined class of "compact" polarons, all mutually separated by an intermediate regime occupied by transitional structures

The incidence of the host galaxy in microvariability observations of quasars

The incidence of a host galaxy in aperture photometry of active galactic nuclei is studied by means of actual and simulated CCD observations. Our goal is to evaluate the importance of spurious variations, introduced by seeing fluctuations during the observations, in the differential light curves used to study optical microvariability. Repeated CCD observations during two consecutive nights were used to obtain time-resolved aperture photometry for the BL Lac object PKS 2316-423, which is located at the center of a conspicuous elliptical galaxy, and for several field stars. The blazar seems to be variable according to standard variability criteria; however we show that the observed differential magnitude variations are strongly correlated with seeing fluctuations during the nights. Moreover, another galaxy within the same CCD field shows nearly identical variations, clearly indicating that such variations are artifacts of the aperture photometry. Simulated observations of quasars within host galaxies of different morphologies and spanning a wide range of luminosities were also used to evaluate the effects of changing seeing conditions. The results show that spurious differential magnitude variations due to seeing fluctuations are larger for active nuclei within brighter hosts, particularly when small photometric apertures (about the seeing FWHM in radius) are used. According to our results, several recommendations are given to future observers.Fil: Cellone, Sergio Aldo. Universidad Nacional de la Plata. Facultad de Ciencias Astronómicas y Geofísicas; ArgentinaFil: Combi, Jorge Ariel. Universidad Nacional de la Plata. Facultad de Ciencias Astronómicas y Geofísicas; Argentina. Provincia de Buenos Aires. Gobernación. Comisión de Investigaciones Científicas. Instituto Argentino de Radioastronomía. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto Argentino de Radioastronomía; ArgentinaFil: Romero, Gustavo Esteban. Universidad Nacional de la Plata. Facultad de Ciencias Astronómicas y Geofísicas; Argentina. Provincia de Buenos Aires. Gobernación. Comisión de Investigaciones Científicas. Instituto Argentino de Radioastronomía. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto Argentino de Radioastronomía; Argentin

Rearrangement collisions between gold clusters

Collision processes between two gold clusters are investigated using classical molecular dynamics in combination with embedded atom (EA) potentials, after checking the reliability of EA results by contrasting them with first principles calculations. The Au projectiles considered are both single atoms (N=1) and clusters of N=2, 12, 13 and 14 atoms. The targets contain N= 12, 13 and 14 gold atoms. The initial projectile energy E is in the range 0 < E < 1.5 eV/atom. The results of the collision processes are described and analyzed in detail.Comment: LATeX file, 8 figures, uses svjour.cl

On the Generalized Kramers Problem with Oscillatory Memory Friction

The time-dependent transmission coefficient for the Kramers problem exhibits different behaviors in different parameter regimes. In the high friction regime it decays monotonically ("non-adiabatic"), and in the low friction regime it decays in an oscillatory fashion ("energy-diffusion-limited"). The generalized Kramers problem with an exponential memory friction exhibits an additional oscillatory behavior in the high friction regime ("caging"). In this paper we consider an oscillatory memory kernel, which can be associated with a model in which the reaction coordinate is linearly coupled to a nonreactive coordinate, which is in turn coupled to a heat bath. We recover the non-adiabatic and energy-diffusion-limited behaviors of the transmission coefficient in appropriate parameter regimes, and find that caging is not observed with an oscillatory memory kernel. Most interestingly, we identify a new regime in which the time-dependent transmission coefficient decays via a series of rather sharp steps followed by plateaus ("stair-like"). We explain this regime and its dependence on the various parameters of the system

Proximity-induced topological transition and strain-induced charge transfer in graphene/MoS2 bilayer heterostructures

Graphene/MoS2 heterostructures are formed by combining the nanosheets of graphene and monolayer MoS2. The electronic features of both constituent monolayers are rather well-preserved in the resultant heterostructure due to the weak van der Waals interaction between the layers. However, the proximity of MoS2 induces strong spin orbit coupling effect of strength ~1 meV in graphene, which is nearly three orders of magnitude larger than the intrinsic spin orbit coupling of pristine graphene. This opens a bandgap in graphene and further causes anticrossings of the spin-nondegenerate bands near the Dirac point. Lattice incommensurate graphene/MoS2 heterostructure exhibits interesting moire' patterns which have been observed in experiments. The electronic bandstructure of heterostructure is very sensitive to biaxial strain and interlayer twist. Although the Dirac cone of graphene remains intact and no charge-transfer between graphene and MoS2 layers occurs at ambient conditions, a strain-induced charge-transfer can be realized in graphene/MoS2 heterostructure. Application of a gate voltage reveals the occurrence of a topological phase transition in graphene/MoS2 heterostructure. In this chapter, we discuss the crystal structure, interlayer effects, electronic structure, spin states, and effects due to strain and substrate proximity on the electronic properties of graphene/MoS2 heterostructure. We further present an overview of the distinct topological quantum phases of graphene/MoS2 heterostructure and review the recent advancements in this field.Comment: 31 pages, 12 figure

El cambio político en México: del presidencialismo autoritario al pacto por México (1926-2012)

El presente trabajo de investigación tiene como objetivo el documentar los principales elementos característicos del cambio político en nuestro país a partir de la etapa del presidencialismo hegemónico del PRI y hasta la implementación del “Pacto por México” así como las primeras reformas derivadas de este, comprendiendo de 1929 a 2012. Para la elaboración del presente texto, se empleó una metodología de carácter documental, la cual permitió el puntualizar de manera concisa los acontecimientos que de manera directa influyeron en una nueva configuración del sistema político mexicano, que pasó de ser un sistema político caracterizado por el dominio hegemónico de un solo partido político, el PRI, a ser un sistema político caracterizado por una pluralidad política y competitividad electoral, como consecuencia de una serie de reformas políticas y electorales que permitieron una alternancia en el poder ejecutivo de México. Las reformas electorales y al sistema de partidos en México, a su vez permitieron que el Congreso de la Unión ya no estuviese sumido al poder ejecutivo por la pluralidad partidista presente, por lo que la actividad legislativa, a partir de 1997 entró en una etapa en donde alcanzar acuerdos para realizar modificaciones constitucionales de suma importancia para el país se tornaba complicado debido a los distintos intereses e ideologías de los partidos presentes en las Cámaras del Congreso. En el presente trabajo se parte del supuesto de que el “Pacto por México” surge como la alternativa que ha permitido encontrar coincidencias para realizar reformas necesarias para el país