221 research outputs found

    Dating late Cenozoic erosional surfaces in Victoria Land, Antarctica, with cosmogenic neon in pyroxenes

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    We present 21Ne exposure ages of erosional glaciogenic rock surfaces on nunataks in northern Victoria Land, Antarctica: i) in the Prince Albert Mountains and ii) near Mesa Range. These nunataks are located directly at the margin of the polar plateau and therefore provide an immediate record of ice volume changes of the East Antarctic Ice Sheet, not biased by ice shelf grounding or narrow valley sections downstream the outlet glaciers. The sampling locations overlook the present ice surface by less than 200 m, but were last covered by ice 3.5 Ma bp (minimum age, not corrected for erosion). This strongly indicates that the ice sheet has not been substantially thicker than today since at least the early Pliocene, which supports the hypothesis of a stable East Antarctic Ice Sheet. First absolute ages are reported for the alpine topography above the erosive trimline that typically marks the upper limit of glacial activity in northern Victoria Land. Unexpectedly low nuclide concentrations suggest that erosion rates on the alpine topography are considerably higher due to the steep slopes than those affecting flat erosional surfaces carrying Antarctic tor

    Holocene regional gradients of dust provenance and flux between Talos Dome and Dome C, East Antarctica.

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    Aeolian sequences from Central East Antarctic ice cores provide climate and environmental information of hemispheric significance. Close to the margins of the ice sheet, high-elevation ice-free terrains protruding above the ice sheet surface can provide an additional input of fine dust particles to the atmosphere, making peripheral locations particularly interesting for the study of the regional climate evolution. In the Talos Dome area of East Antarctica, entrainment and transport of local mineral particles is merely influenced by local wind direction and strength, which in turn is tuned by regional climate changes. We investigate the spatial variability of modern and Holocene dust flux, grain size and isotopic (Sr-Nd) composition along a hypothetic transect from Talos Dome all through the interior of the ice sheet (Dome C/Vostok area), and compare the geochemical fingerprint of dust extracted from firn and ice cores to the equivalent size fraction of regolith and glacial deposits from high altitude Victoria Land sources. This study aims to better understand the environmental gradients of dust flux and provenance from the marginal Talos Dome site to the higher Dome C drainage area, with implications for the regional atmospheric circulation, while documenting the isotopic composition of local exposed sediments

    A Self-Consistent First-Principles Technique Having Linear Scaling

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    An algorithm for first-principles electronic structure calculations having a computational cost which scales linearly with the system size is presented. Our method exploits the real-space localization of the density matrix, and in this respect it is related to the technique of Li, Nunes and Vanderbilt. The density matrix is expressed in terms of localized support functions, and a matrix of variational parameters, L, having a finite spatial range. The total energy is minimized with respect to both the support functions and the elements of the L matrix. The method is variational, and becomes exact as the ranges of the support functions and the L matrix are increased. We have tested the method on crystalline silicon systems containing up to 216 atoms, and we discuss some of these results.Comment: 12 pages, REVTeX, 2 figure

    Basis Functions for Linear-Scaling First-Principles Calculations

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    In the framework of a recently reported linear-scaling method for density-functional-pseudopotential calculations, we investigate the use of localized basis functions for such work. We propose a basis set in which each local orbital is represented in terms of an array of `blip functions'' on the points of a grid. We analyze the relation between blip-function basis sets and the plane-wave basis used in standard pseudopotential methods, derive criteria for the approximate equivalence of the two, and describe practical tests of these criteria. Techniques are presented for using blip-function basis sets in linear-scaling calculations, and numerical tests of these techniques are reported for Si crystal using both local and non-local pseudopotentials. We find rapid convergence of the total energy to the values given by standard plane-wave calculations as the radius of the linear-scaling localized orbitals is increased.Comment: revtex file, with two encapsulated postscript figures, uses epsf.sty, submitted to Phys. Rev.

    Structural and dielectric properties of Sr2_{2}TiO4_{4} from first principles

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    We have investigated the structural and dielectric properties of Sr2_{2}TiO4_{4},the first member of the Srn+1_{n+1}Tin_{n}O3n+1_{3n+1} Ruddlesden-Popper series, within density functional theory. Motivated by recent work in which thin films of Sr2_{2}TiO4_{4} were grown by molecular beam epitaxy (MBE) on SrTiO3_{3} substrates, the in-plane lattice parameter was fixed to the theoretically optimized lattice constant of cubic SrTiO3_{3} (n=\infty), while the out-of-plane lattice parameter and the internal structural parameters were relaxed. The fully relaxed structure was also investigated. Density functional perturbation theory was used to calculate the zone-center phonon frequencies, Born effective charges, and the electronic dielectric permittivity tensor. A detailed study of the contribution of individual infrared-active modes to the static dielectric permittivity tensor was performed. The calculated Raman and infrared phonon frequencies were found to be in agreement with experiment where available. Comparisons of the calculated static dielectric permittivity with experiments on both ceramic powders and epitaxial thin films are discussed.Comment: 11 pages, 1 figure, 8 tables, submitted to Phys. Rev.

    Towards a Linear-Scaling DFT Technique: The Density Matrix Approach

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    A recently proposed linear-scaling scheme for density-functional pseudopotential calculations is described in detail. The method is based on a formulation of density functional theory in which the ground state energy is determined by minimization with respect to the density matrix, subject to the condition that the eigenvalues of the latter lie in the range [0,1]. Linear-scaling behavior is achieved by requiring that the density matrix should vanish when the separation of its arguments exceeds a chosen cutoff. The limitation on the eigenvalue range is imposed by the method of Li, Nunes and Vanderbilt. The scheme is implemented by calculating all terms in the energy on a uniform real-space grid, and minimization is performed using the conjugate-gradient method. Tests on a 512-atom Si system show that the total energy converges rapidly as the range of the density matrix is increased. A discussion of the relation between the present method and other linear-scaling methods is given, and some problems that still require solution are indicated.Comment: REVTeX file, 27 pages with 4 uuencoded postscript figure

    Density-functional embedding using a plane-wave basis

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    The constrained electron density method of embedding a Kohn-Sham system in a substrate system (first described by P. Cortona, Phys. Rev. B {\bf 44}, 8454 (1991) and T.A. Wesolowski and A. Warshel, J. Phys. Chem {\bf 97}, 8050 (1993)) is applied with a plane-wave basis and both local and non-local pseudopotentials. This method divides the electron density of the system into substrate and embedded electron densities, the sum of which is the electron density of the system of interest. Coupling between the substrate and embedded systems is achieved via approximate kinetic energy functionals. Bulk aluminium is examined as a test case for which there is a strong interaction between the substrate and embedded systems. A number of approximations to the kinetic-energy functional, both semi-local and non-local, are investigated. It is found that Kohn-Sham results can be well reproduced using a non-local kinetic energy functional, with the total energy accurate to better than 0.1 eV per atom and good agreement between the electron densities.Comment: 11 pages, 4 figure

    Isolation, characterization and microincapsulation of neonatal porcine Sertoli cells obtained from a specific pathogen free (SPF) herd

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    Porcine Sertoli cells (pSC) have been successfully employed as cell therapy in pre-clinical studies of several immune-based and chronic degenerative diseases. In order to prevent any transmission of infectious adventitious agents to the cells graft recipients, we have set up, according to our previously described method (Luca et al., 2007) pSC monolayers obtained from specific pathogen free (SPF) certified neonatal pigs, born in the unique SPF colony in Italy. pSC were assessed and characterized as far as viability, by ethidium bromide and fluorescein diacetate (EB/FD), Müllerian inhibiting substance (AMH), and insulin-like 3 (INSL3), alpha-smooth muscle actin (ASMI) both by immunofluorescence (IF) and cytofluorimetric analysis (CA) were concerned. pSC were encapsulated in alginate microcapsules (MCpSC), with MCp- SC functional competence and biocompatibility being determined both in vitro, by AMH, inhibin B, TGF-beta, IGF-I secretion and in vivo in experimental animal models, respectively. Results demonstrated the high purity of our pSC monolayers (95% of AMH+cells), with negligible contamination by Leydig (2%) and peritubular cells (3%). Microencapsulation did not alter pSC viability and even after 4 months postimplantation, all the retrieved microcapsules retained morphology and function. In conclusion, we have uniquely obtained, from a SPF herd, highly purified, viable and functional pSC that might poten-tially apply to humans

    The Italian arm of the PREPARE study: an international project to evaluate and license a maternal vaccine against group B streptococcus.

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    BACKGROUND: Group B streptococcus (GBS) is a leading cause of sepsis, pneumonia and meningitis in infants, with long term neurodevelopmental sequelae. GBS may be associated with poor pregnancy outcomes, including spontaneous abortion, stillbirth and preterm birth. Intrapartum antibiotic prophylaxis (IAP) is currently the only way to prevent early-onset disease (presenting at 0 to 6 days of life), although it has no impact on the disease presenting over 6 days of life and its implementation is challenging in resource poor countries. A maternal vaccine against GBS could reduce all GBS manifestations as well as improve pregnancy outcomes, even in low-income countries. MAIN BODY: The term "PREPARE" designates an international project aimed at developing a maternal vaccination platform to test vaccines against neonatal GBS infections by maternal immunization. It is a non-profit, multi-center, interventional and experimental study (promoted by the St George University of London. [UK]) with the aim of developing a maternal vaccination platform, determining pregnancy outcomes, and defining the extent of GBS infections in children and mothers in Africa. PREPARE also aims to estimate the protective serocorrelates against the main GBS serotypes that cause diseases in Europe and Africa and to conduct two trials on candidate GBS vaccines. PREPARE consists of 6 work packages. In four European countries (Italy, UK, Netherlands, France) the recruitment of cases and controls will start in 2020 and will end in 2022. The Italian PREPARE network includes 41 centers. The Italian network aims to collect: GBS isolates from infants with invasive disease, maternal and neonatal sera (cases); cord sera and GBS strains from colonized mothers whose infants do not develop GBS infection (controls). SHORT CONCLUSION: PREPARE will contribute information on protective serocorrelates against the main GBS serotypes that cause diseases in Europe and Africa. The vaccine that will be tested by the PREPARE study could be an effective strategy to prevent GBS disease
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