16,177 research outputs found

    The Amorphous-Crystal Interface in Silicon: a Tight-Binding Simulation

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    The structural features of the interface between the cystalline and amorphous phases of Si solid are studied in simulations based on a combination of empirical interatomic potentials and a nonorthogonal tight-binding model. The tight-binding Hamiltonian was created and tested for the types of structures and distortions anticipated to occur at this interface. The simulations indicate the presence of a number of interesting features near the interface. The features that may lead to crystallization upon heating include chains with some defects, most prominently dimers similar to those on the Si(001) 2x1 reconstructed free surface. Within the amorphous region order is lost over very short distances. By examining six different samples with two interfaces each, we find the energy of the amorphous-crystal interface to be 0.49 +/- 0.05 J/m^2Comment: Submitted to Phys. Rev.

    Electroweak interactions in a relativistic Fermi gas

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    We present a relativistic model for computing the neutrino mean free path in neutron matter. Thereby, neutron matter is described as a non-interacting Fermi gas in beta-equilibrium. We present results for the neutrino mean free path for temperatures from 0 up to 50 MeV and a broad range of neutrino energies. We show that relativistic effects cause a considerable enhancement of neutrino-scattering cross-sections in neutron matter. The influence of the Q2Q^2-dependence in the electroweak form factors and the inclusion of a weak magnetic term in the hadron current is discussed. The weak-magnetic term in the hadron current is at the origin of some selective spin dependence for the nucleons which are subject to neutrino interactions.Comment: 11 pages, 7 figures, accepted to Phys. Rev. C, minor changes and updates of the figures are mad

    High resolution spectroscopy of single NV defects coupled with nearby 13^{13}C nuclear spins in diamond

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    We report a systematic study of the hyperfine interaction between the electron spin of a single nitrogen-vacancy (NV) defect in diamond and nearby 13^{13}C nuclear spins, by using pulsed electron spin resonance spectroscopy. We isolate a set of discrete values of the hyperfine coupling strength ranging from 14 MHz to 400 kHz and corresponding to 13^{13}C nuclear spins placed at different lattice sites of the diamond matrix. For each lattice site, the hyperfine interaction is further investigated through nuclear spin polarization measurements and by studying the magnetic field dependence of the hyperfine splitting. This work provides informations that are relevant for the development of nuclear-spin based quantum register in diamond.Comment: 8 pages, 5 figure

    Transformation laws of the components of classical and quantum fields and Heisenberg relations

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    The paper recalls and point to the origin of the transformation laws of the components of classical and quantum fields. They are considered from the "standard" and fibre bundle point of view. The results are applied to the derivation of the Heisenberg relations in quite general setting, in particular, in the fibre bundle approach. All conclusions are illustrated in a case of transformations induced by the Poincar\'e group.Comment: 22 LaTeX pages. The packages AMS-LaTeX and amsfonts are required. For other papers on the same topic, view http://theo.inrne.bas.bg/~bozho/ . arXiv admin note: significant text overlap with arXiv:0809.017

    From Electrons to Finite Elements: A Concurrent Multiscale Approach for Metals

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    We present a multiscale modeling approach that concurrently couples quantum mechanical, classical atomistic and continuum mechanics simulations in a unified fashion for metals. This approach is particular useful for systems where chemical interactions in a small region can affect the macroscopic properties of a material. We discuss how the coupling across different scales can be accomplished efficiently, and we apply the method to multiscale simulations of an edge dislocation in aluminum in the absence and presence of H impurities.Comment: 4 page

    Tight-binding study of structure and vibrations of amorphous silicon

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    We present a tight-binding calculation that, for the first time, accurately describes the structural, vibrational and elastic properties of amorphous silicon. We compute the interatomic force constants and find an unphysical feature of the Stillinger-Weber empirical potential that correlates with a much noted error in the radial distribution function associated with that potential. We also find that the intrinsic first peak of the radial distribution function is asymmetric, contrary to usual assumptions made in the analysis of diffraction data. We use our results for the normal mode frequencies and polarization vectors to obtain the zero-point broadening effect on the radial distribution function, enabling us to directly compare theory and a high resolution x-ray diffraction experiment
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