203 research outputs found

    Localization and entanglement of two interacting electrons in a quantum-dot molecule

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    The localization of two interacting electrons in a coupled-quantum-dots semiconductor structure is demonstrated through numerical calculations of the time evolution of the two-electron wave function including the Coulomb interaction between the electrons. The transition from the ground state to a localized state is induced by an external, time-dependent, uniform electric field. It is found that while an appropriate constant field can localize both electrons in one of the wells, oscillatory fields can induce roughly equal probabilities for both electrons to be localized in either well, generating an interesting type of localized and entangled state. We also show that shifting the field suddenly to an appropriate constant value can maintain in time both types of localization.Comment: 4 pages, 4 figure

    The interaction of oxygen with small gold clusters

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    Presented in this work are the results of a quantum chemical study of oxygen adsorption on small Aun and Au−n (n=2,3) clusters. Density functional theory(DFT), second order perturbation theory (MP2), and singles and doubles coupled clustertheory with perturbative triples [CCSD(T)] methods have been used to determine the geometry and the binding energy of oxygen to Aun. The multireference character of the wave functions has been studied using the complete active space self-consistent field method. There is considerable disagreement between the oxygen binding energies provided by CCSD(T) calculations and those obtained with DFT. The disagreement is often qualitative, with DFT predicting strong bonds where CCSD(T) predicts no bonds or structures that are bonded but have energies that exceed those of the separated components. The CCSD(T) results are consistent with experimental measurements, while DFT calculations show, at best, a qualitative agreement. Finally, the lack of a regular pattern in the size and the sign of the errors [as compared to CCSD(T)] is a disappointing feature of the DFT results for the present system: it is not possible to give a simple rule for correcting the DFT predictions (e.g., a useful rule would be that DFT predicts stronger binding of O2 by about 0.3 eV). It is likely that the errors in DFT appear not because of gold, but because oxygen binding to a metal cluster is a particularly difficult problem.This work was supported by AFOSR through a DURINT grant

    On the possibility of using differential cross section measurements for the electronic excitation of adsorbates by an electron beam, to determine the adsorbate orientation

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    We show, by detailed electron–molecule scattering calculations, that the angular dependence of electron energy loss spectra in which an adsorbate is electronically excited can be used to identify the orientation of the molecule with respect to the surface and the nature of the final states. The calculations are exploratory and were carried out for an H2 molecule. The transition amplitude for electron–molecule scattering is calculated by using the Schwinger variational principle with two open channels. The effects of the surface were introduced through a semiquantitative model which treats the surface as a partly reflecting, flat mirror

    Level Set Approach to Reversible Epitaxial Growth

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    We generalize the level set approach to model epitaxial growth to include thermal detachment of atoms from island edges. This means that islands do not always grow and island dissociation can occur. We make no assumptions about a critical nucleus. Excellent quantitative agreement is obtained with kinetic Monte Carlo simulations for island densities and island size distributions in the submonolayer regime.Comment: 7 pages, 9 figure

    Casimir effect: running Newton constant or cosmological term

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    We argue that the instability of Euclidean Einstein gravity is an indication that the vacuum is non perturbative and contains a condensate of the metric tensor in a manner reminiscent of Yang-Mills theories. As a simple step toward the characterization of such a vacuum the value of the one-loop effective action is computed for Euclidean de Sitter spaces as a function of the curvature when the unstable conformal modes are held fixed. Two phases are found, one where the curvature is large and gravitons should be confined and another one which appears to be weakly coupled and tends to be flat. The induced cosmological constant is positive or negative in the strongly or weakly curved phase, respectively. The relevance of the Casimir effect in understanding the UV sensitivity of gravity is pointed out.Comment: Final, slightly extended version, to appear in Classical and Quantum Gravit

    Polarization state of the optical near-field

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    The polarization state of the optical electromagnetic field lying several nanometers above complex dielectric structures reveals the intricate light-matter interaction that occurs in this near-field zone. This information can only be extracted from an analysis of the polarization state of the detected light in the near-field. These polarization states can be calculated by different numerical methods well-suited to near--field optics. In this paper, we apply two different techniques (Localized Green Function Method and Differential Theory of Gratings) to separate each polarisation component associated with both electric and magnetic optical near-fields produced by nanometer sized objects. The analysis is carried out in two stages: in the first stage, we use a simple dipolar model to achieve insight into the physical origin of the near-field polarization state. In the second stage, we calculate accurate numerical field maps, simulating experimental near-field light detection, to supplement the data produced by analytical models. We conclude this study by demonstrating the role played by the near-field polarization in the formation of the local density of states.Comment: 9 pages, 11 figures, accepted for publication in Phys. Rev.

    Quantum Diffusion of H/Ni(111) through the Monte Carlo Wave Function Formalism

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    We consider a quantum system coupled to a dissipative background with many degrees of freedom using the Monte Carlo Wave Function method. Instead of dealing with a density matrix which can be very high-dimensional, the method consists of integrating a stochastic Schrodinger equation with a non-hermitian damping term in the evolution operator, and with random quantum jumps. The method is applied to the diffusion of hydrogen on the Ni(111) surface below 100 K. We show that the recent experimental diffusion data for this system can be understood through an interband activation process, followed by quantum tunnelling.Comment: In press at Phys.Rev.Let

    Modified f(R) gravity from scalar-tensor theory and inhomogeneous EoS dark energy

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    The reconstruction of f(R)-gravity is showed by using an auxiliary scalar field in the context of cosmological evolution, this development provide a way of reconstruct the form of the function f (R) for a given evolution of the Hubble parameter. In analogy, f(R)-gravity may be expressed by a perfect fluid with an inhomogeneous equation of state that depends on the Hubble parameter and its derivatives. This mathematical equivalence that may confuse about the origin of the mechanism that produces the current acceleration, and possibly the whole evolution of the Hubble parameter, is shown here.Comment: 8 page
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