283 research outputs found

    Gaspar data-centric framework

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    This paper presents the Gaspar data-centric framework to develop high performance parallel applications in Java. Our approach is based on data iterators and on the map pattern of computation. The framework provides an efficient data Application Programming Inter-face(API) that supports flexible data layout and data tiling. Data layout and tiling enable the improvement of data locality, which is essential to foster application scalability in modern multi-core systems. The paper presents the framework data-centric concepts and shows that the performance is comparable to pure Java code.(undefined)info:eu-repo/semantics/publishedVersio

    Turbocharged molecular discovery of OLED emitters: from high-throughput quantum simulation to highly efficient TADF devices

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    Discovering new OLED emitters requires many experiments to synthesize candidates and test performance in devices. Large scale computer simulation can greatly speed this search process but the problem remains challenging enough that brute force application of massive computing power is not enough to successfully identify novel structures. We report a successful High Throughput Virtual Screening study that leveraged a range of methods to optimize the search process. The generation of candidate structures was constrained to contain combinatorial explosion. Simulations were tuned to the specific problem and calibrated with experimental results. Experimentalists and theorists actively collaborated such that experimental feedback was regularly utilized to update and shape the computational search. Supervised machine learning methods prioritized candidate structures prior to quantum chemistry simulation to prevent wasting compute on likely poor performers. With this combination of techniques, each multiplying the strength of the search, this effort managed to navigate an area of molecular space and identify hundreds of promising OLED candidate structures. An experimentally validated selection of this set shows emitters with external quantum efficiencies as high as 22%

    Reusability of filtering facepiece respirators after decontamination through drying and germicidal UV irradiation.

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    During pandemics, such as the SARS-CoV-2, filtering facepiece respirators plays an essential role in protecting healthcare personnel. The recycling of respirators is possible in case of critical shortage, but it raises the question of the effectiveness of decontamination as well as the performance of the reused respirators. Disposable respirators were subjected to ultraviolet germicidal irradiation (UVGI) treatment at single or successive doses of 60 mJ/cm <sup>2</sup> after a short drying cycle (30 min, 70°C). The germicidal efficacy of this treatment was tested by spiking respirators with two staphylococcal bacteriophages (vB_HSa_2002 and P66 phages). The respirator performance was investigated by the following parameters: particle penetration (NaCl aerosol, 10-300 nm), scanning electron microscopy (SEM), Fourier-transform infrared spectroscopy (FTIR), differential scanning calorimetry and mechanical tensile tests. No viable phage particles were recovered from any of the respirators after decontamination (log reduction in virus titre >3), and no reduction in chemical or physical properties (SEM, particle penetrations <5%-6%) were observed. Increasing the UVGI dose 10-fold led to chemical alterations of the respirator filtration media (FTIR) but did not affect the physical properties (particle penetration), which was unaltered even at 3000 mJ/cm <sup>2</sup> (50 cycles). When respirators had been used by healthcare workers and undergone decontamination, they had particle penetration significantly greater than never donned respirators. This decontamination procedure is an attractive method for respirators in case of shortages during a SARS pandemic. A successful implementation requires a careful design and particle penetration performance control tests over the successive reuse cycles

    Soil protist function varies with elevation in the Swiss Alps

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    Protists are abundant and play key trophic functions in soil. Documenting how their trophic contributions vary across large environmental gradients is essential to understand and predict how biogeochemical cycles will be impacted by global changes. Here, using amplicon sequencing of environmental DNA in open habitat soil from 161 locations spanning 2600 m of elevation in the Swiss Alps (from 400 to 3000 m), we found that, over the whole study area, soils are dominated by consumers, followed by parasites and phototrophs. In contrast, the proportion of these groups in local communities shows large variations in relation to elevation. While there is, on average, three times more consumers than parasites at low elevation (400-1000 m), this ratio increases to 12 at high elevation (2000-3000 m). This suggests that the decrease in protist host biomass and diversity toward mountains tops impact protist functional composition. Furthermore, the taxonomic composition of protists that infect animals was related to elevation while that of protists that infect plants or of protist consumers was related to soil pH. This study provides a first step to document and understand how soil protist functions vary along the elevational gradient.Peer reviewe

    Research Progress Reports, 1962. Fruit and Vegetable Processing and Technology Division, Department of Horticulture.

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    Tomato variety evaluation for processing, 1962 / W. A. Gould, J. R. Geisman and Wade Schulte -- Evaluation of snap bean varieties for processing, 1962 / Wilbur A. Gould -- Handling and holding studies of mechanically harvested tomatoes. 1. Processed product quality / W. A. Gould, W. D. Bash, J. R. Geisman, D. E. Yingst, G. A. Marlowe and W. N. Brown -- Handling and holding studies of mechanically harvested tomatoes. 2. Spore counts / Winston D. Bash and W. A. Gould -- Handling and holding studies of mechanically harvested tomatoes. 3. pH / Winston D. Bash and W. A. Gould -- Handling and holding studies of mechanically harvested tomatoes. 4. Chlorine residuals / Donald E. Yingst and W. A. Gould -- Removal of insects and residues from sweet corn by washing techniques / J. R. Geisman and W. A. Gould -- Removal of pesticides and radioactive fallout from fruits and vegetables / J. R. Geisman, R. P. Blackmore, R. W. Hirzel and W. S. Stinson -- The effect of apple variety and browning prevention treatments during preparation on the quality of frozen apple pies / D. Robert Davis and James F. Gallander -- Effect of three tomato peeling methods on efficiency and product quality / Wade A. Schulte and W. A. Gould -- Effects of cooling rates on vacuum of canned pumpkin / Winston D. Bash -- New flavors for sauerkraut / J. R. Geisman and Robert Reyda -- Flavor of tomato juice / Wilbur A. Gould, Natholyn Dalton and John Hal Johnson -- Fruit juice blends offer a promising new field for apple cider / D. Robert Davi
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