10,099 research outputs found

    Modeling the momentum distributions of annihilating electron-positron pairs in solids

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    Measuring the Doppler broadening of the positron annihilation radiation or the angular correlation between the two annihilation gamma quanta reflects the momentum distribution of electrons seen by positrons in the material.Vacancy-type defects in solids localize positrons and the measured spectra are sensitive to the detailed chemical and geometric environments of the defects. However, the measured information is indirect and when using it in defect identification comparisons with theoretically predicted spectra is indispensable. In this article we present a computational scheme for calculating momentum distributions of electron-positron pairs annihilating in solids. Valence electron states and their interaction with ion cores are described using the all-electron projector augmented-wave method, and atomic orbitals are used to describe the core states. We apply our numerical scheme to selected systems and compare three different enhancement (electron-positron correlation) schemes previously used in the calculation of momentum distributions of annihilating electron-positron pairs within the density-functional theory. We show that the use of a state-dependent enhancement scheme leads to better results than a position-dependent enhancement factor in the case of ratios of Doppler spectra between different systems. Further, we demonstrate the applicability of our scheme for studying vacancy-type defects in metals and semiconductors. Especially we study the effect of forces due to a positron localized at a vacancy-type defect on the ionic relaxations.Comment: Submitted to Physical Review B on September 1 2005. Revised manuscript submitted on November 14 200

    Physics issues in simulations with dynamical overlap fermions

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    We discuss the impact of various improvements on simulations of dynamical overlap fermions using the Hybrid Monte Carlo algorithm. We focus on the usage of fat links and multiple pseudo-fermion fields.Comment: 14 pages, 10 figure

    Abstract delta modelling

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    Article / Letter to editorLeiden Inst Advanced Computer Science

    Avaliação da presença do vírus influenza em suínos no sul do Brasil.

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    bitstream/item/57440/1/CUsersPiazzonDocumentsColecao-DigitalBoletim-de-Pesquisa-10.pdfProjeto/Plano de Ação: 16.00.300.04-00

    Energetics of positron states trapped at vacancies in solids

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    We report a computational first-principles study of positron trapping at vacancy defects in metals and semiconductors. The main emphasis is on the energetics of the trapping process including the interplay between the positron state and the defect's ionic structure and on the ensuing annihilation characteristics of the trapped state. For vacancies in covalent semiconductors the ion relaxation is a crucial part of the positron trapping process enabling the localization of the positron state. However, positron trapping does not strongly affect the characteristic features of the electronic structure, e.g., the ionization levels change only moderately. Also in the case of metal vacancies the positron-induced ion relaxation has a noticeable effect on the calculated positron lifetime and momentum distribution of annihilating electron-positron pairs.Comment: Submitted to Physical Review B on 17 April 2007. Revised version submitted on 6 July 200

    Single-step method for β-galactosidase assays in Escherichia coli using a 96-well microplate reader

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    AbstractHistorically, the lacZ gene is one of the most universally used reporters of gene expression in molecular biology. Its activity can be quantified using an artificial substrate, o-nitrophenyl-ß-d-galactopyranoside (ONPG). However, the traditional method for measuring LacZ activity (first described by J. H. Miller in 1972) can be challenging for a large number of samples, is prone to variability, and involves hazardous compounds for lysis (e.g., chloroform, toluene).Here we describe a single-step assay using a 96-well microplate reader with a proven alternative cell permeabilization method. This modified protocol reduces handling time by 90%

    UV excess measures of accretion onto young very low-mass stars and brown dwarfs

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    Low-resolution spectra from 3000-9000 AA of young low-mass stars and brown dwarfs were obtained with LRIS on Keck I. The excess UV and optical emission arising in the Balmer and Paschen continua yields mass accretion rates ranging from 2e-12 to 1e-8 Mo/yr. These results are compared with {\it HST}/STIS spectra of roughly solar-mass accretors with accretion rates that range from 2e-10 to 5e-8 Mo/yr. The weak photospheric emission from M-dwarfs at <4000 A leads to a higher contrast between the accretion and photospheric emission relative to higher-mass counterparts. The mass accretion rates measured here are systematically 4-7 times larger than those from H-alpha emission line profiles, with a difference that is consistent with but unlikely to be explained by the uncertainty in both methods. The accretion luminosity correlates well with many line luminosities, including high Balmer and many He I lines. Correlations of the accretion rate with H-alpha 10% width and line fluxes show a large amount of scatter. Our results and previous accretion rate measurements suggest that accretion rate is proportional to M^(1.87+/-0.26) for accretors in the Taurus Molecular Cloud.Comment: 13 pages text, 15 tables, 14 figures. Accepted by Ap
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