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At least 685 records · Page 38

Continuous and Smooth Envelopes of Topological Algebras. Part 2

Since the first optical instruments were invented, the idea that the visible image of an object under observation depends on tools of observation became commonly assumed in physics. A way of formalizing this idea in mathematics is the construction that assigns to an arbitrary object A in a category K its envelope Env{sub Φ}{sup Ω} A in a given class of morphisms (a class of representations) Ω with respect to a given class of morphisms (a class of observation tools) Φ. It turns out that if we take a sufficiently wide category of topological algebras as K, then each choice of the classes Ω and Φ defines a “projection of functional analysis into geometry,” and the standard “geometric disciplines,” like complex geometry, differential geometry, and topology, become special cases of this construction. This gives a formal scheme of “categorical construction of geometries” with many interesting applications, in particular, “geometric generalizations of the Pontryagin duality” (to the classes of noncommutative groups). In this paper we describe this scheme in topology and in differential geometry.

97 MATHEMATICS AND COMPUTING↗

Information-theoretic aspects of Werner states

Highlights: • The rich structures of Werner states are reviewed. • Werner states are characterized in terms of quantum uncertainty. • Information-theoretic aspects of Werner states are revealed. In a seminal study of quantum states with Einstein–Podolsky–Rosen correlations (entanglement) admitting a hidden-variable model (Werner, 1989), Werner introduced the dichotomy of entanglement/separability and devised a family of highly symmetric states, now termed the Werner states, some of which exhibit entanglement but no Bell nonlocality. It turns out that the Werner states have a rich structure of correlations and constitute a paradigm which has played an innovative role in both theoretical and experimental explorations of quantum information. Given the theoretical significance and wide applications of the Werner states, here we first give a concise review of information contents of the Werner states, and then present an information-theoretic characterization of them in terms of the Wigner–Yanase skew information: The Werner states are identified as the states with the minimum quantum uncertainty with respect to a natural family of observables (i.e., the generators of the diagonal unitary group). For this purpose, we introduce a measure of quantum uncertainty which is of independent interest in studying asymmetry, coherence, and uncertainty, and reveal its fundamental properties. We further identify the Bell triplet states as the opposite states of the Werner states in the sense that they have the maximal amount of quantum uncertainty. Analogously, we provide a similar characterization of the isotropic states as the minimum quantum uncertainty states with respect to a closely related family of operators.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Characterization of solid particle candidates for application in thermal energy storage and concentrating solar power systems

Thermal energy storage (TES) enables concentrating solar power to remain competitive in the renewable energy mix by firming up intermittent solar resource and providing grid services such as load shifting. Free from siting constraints, stand-alone TES systems show promise as a low-cost alternative to traditional pumped-storage hydropower or compressed air energy storage. At the core of all TES technologies is a storage medium, the selection of which governs many aspects of system design and operation. Although the majority of commercial installations utilize molten salts, solid particles can demonstrate stability over wider temperature ranges. This amounts to increased energy storage densities and corresponding reductions in system cost which is essential in achieving low-cost energy storage. In this work, eight solid particle candidates are systematically identified and screened for application in a specific particle-TES system. The five most promising candidates (CARBO CP and HSP, calcined flint clay (CFC), brown fused alumina (BFA), and silica sand) are further characterized by size and morphology for fluidization suitability, flowability for particle transport, and thermal stability. Calcined flint clay and brown fused alumina are eventually down-selected due to thermal instability at the target operational temperature of 1200 °C. Although the physical characteristics of CARBO outperform silica sand in all categories examined, the marginal performance gains are considered insufficient to justify the additional media cost so silica sand is selected as the leading candidate. Within the silica sand (α-quartz) space, the high end of Geldart Group B particles is identified to satisfy the target fluidization regime for the application of interest without compromising particle flowability. Here, in focused testing, Silica 460 is shown to exhibit sufficient stability through long-duration (500-hour) thermal and cyclic testing (1200 °C), 10-hour testing at 1400 °C, and in contact with candidate refractory containment materials. Finally, an average heat capacity of 1.1 J/g∙ °C is measured over 300-1200 °C with a quartz inversion enthalpy (ΔH α-β ) of 10.7J/g.

14 SOLAR ENERGY↗

Comparative Study of Neutral and Cationic Sn 2 H 2 : Toward Laboratory Detection of the Cation

Group 14 M 2 H 2 isomers (M = Si, Ge, Sn, and Pb) have attracted interest due to their radically differing electronic structures from acetylene. To better understand the Sn–H interactions of the neutral and cationic Sn 2 H 2 structures, we present the most rigorous study of these systems to date. CCSD(T)/cc-pwCVTZ harmonic frequencies are presented as the first predictions for the neutral and cationic species to date. CCSDT(Q)/CBS relative energies are reported using the focal point approach, confirming the butterfly isomer as the global minimum on the potential energy surface for both the neutral and cationic species. In all, there exist 7 minima and 15 transition states. NBO analysis is also performed to elucidate the changes in bond order going from neutral to cation across all isomers of Sn 2 H 2 . Our results provide insights into the important Sn–H interaction and provide guidance for future work that may detect Sn 2 H$^{+}_{2}$ in the laboratory for the first time.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Secondary Amine Functional Disiloxanes as CO2 Sorbents

A series of two different types of secondary amine functional disiloxanes were prepared and screened as CO2 capture solvents. The first group of materials contained RNHCH2CH2CH2 side chains where the R groups were C1-6 alkyls. When R was a primary alkyl group, these materials exhibited CO2 uptake values slightly in excess of theoretical. As the alkyl groups were changed to more sterically hindered secondary or tertiary alkyls, the uptake was less efficient. Heats of absorption values for these materials were generally in the range 2000-2200 kJ/kg of CO2, values significantly lower than those obtained for primary amine functional disiloxanes (2500-2700 kJ/kg of CO2). Also explored were a series of secondary amine functional disiloxanes with X-CH2CH2NH-CH2CH2CH2 - substituents. When X was an electron-donating group (RO-, R2N-, RO-CH2-) the CO2 uptake was also in excess of theoretical. Interestingly, these compounds were generally found to produce carbamate salts that were flowable, low-viscosity oils. Furthermore, the heat of absorption values determined for these materials were even lower. Most compounds gave values below 2000 kJ/kg of CO2. Overall the most promising results were obtained with a methoxyethylaminopropyl derivative, an ethoxyethylaminopropyl-containing material, and a dimethylaminoethylaminopropyl-based compound. These materials showed excellent CO2 uptake, had low heats of absorption, and produced carbamate salts that were flowable liquids even at room temperature.

O'Brien, MJ↗

Regio- and Enantioselective Bromocyclization of Difluoroalkenes as a Strategy to Access Tetrasubstituted Difluoromethylene-Containing Stereocenters

Difluoromethylene-containing compounds have attracted substantial research interest over the past decades for their ability to mimic biological functions of traditional functional groups while providing a wide variety of pharmacological benefits bestowed by the C–F bond. Here, we report a novel strategy to access RCF 2 Br-containing heterocycles by regio- and enantioselective bromocyclization of difluoroalkenes enabled by chiral anion phase-transfer catalysis. The utility of this methodology was highlighted through a synthesis of an analogue of efavirenz, a drug used for treating HIV. Additionally, the synthetic versatility of the CF 2 Br intermediates was showcased through functionalization to a variety of enantioenriched α,α-difluoromethylene-containing products.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Substituted thiadiazoles as energy-rich anolytes for nonaqueous redox flow cells

Understanding structure–property relationships is essential for designing energy-rich redox active organic molecules (ROMs) for all-organic redox flow batteries. In this paper we examine thiadiazole ROMs for storage of negative charge in the flow cells. These versatile molecules have excellent solubility and low redox potentials, allowing high energy density to be achieved. By systematically incorporating groups with varying electron accepting/withdrawing ability, we have examined substituent effects on their properties of interest, including redox potentials, calendar lives of charged ROMs in electrolyte, and the flow cell cycling performance. Finally, while the calendar life of energized fluids can be tuned in a predictable fashion over a wide range, the improvements in the calendar life do not automatically translate into the enhanced cycling performance, indicating that in addition to the slow reactions of charged species in the solvent bulk, there are other parasitic reactions that occur only during the electrochemical cycling of the cell and can dramatically affect the cycling lifetime.

25 ENERGY STORAGE↗

Tracing back the birth environments of Type Ia supernova progenitor stars: a pilot study based on 44 early-type host galaxies

The environmental dependence of Type Ia supernova (SN Ia) luminosities is well established, and efforts are being made to find its origin. Previous studies typically use the currently observed status of the host galaxy. However, given the delay time between the birth of the progenitor star and the SN Ia explosion, the currently observed status may differ from the birth environment of the SN Ia progenitor star. In this paper, employing the chemical evolution and accurately determined stellar population properties of 44 early-type host galaxies, we, for the first time, estimate the SN Ia progenitor star birth environment, specifically [Fe/H] Birth and [α/Fe] Birth . We show that [α/Fe] Birth has a $30.4^{\text{+10.6}}_{-10.1}{{\ \rm per\ cent}}$ wider range than the currently observed [α/Fe] Current , while the range of [Fe/H] Birth is not statistically different ($17.9^{\text{+26.0}}_{-27.1}{{\ \rm per\ cent}}$) to that of [Fe/H] Current . The birth and current environments of [Fe/H] and [α/Fe] are sampled from different populations (p-values of the Kolmogorov–Smirnov test <0.01). We find that light-curve fit parameters are insensitive to [Fe/H] Birth (<0.9σ for the non-zero slope), while a linear trend is observed with Hubble residuals (HRs) at the 2.4σ significance level. With [α/Fe] Birth , no linear trends (<1.1σ) are observed. Interestingly, we find that [α/Fe] Birth clearly splits the SN Ia sample into two groups: SN Ia exploded in [α/Fe] Birth -rich or [α/Fe ]Birth -poor environments. SNe Ia exploded in different [α/Fe] Birth groups have different weighted-means of light-curve shape parameters: 0.81 ± 0.33 (2.5σ). They are thought to be drawn from different populations (p-value = 0.01). Regarding SN Ia colour and HRs, there is no difference (<1.0σ) in the weighted-means and distribution (p-value > 0.27) of each [α/Fe] Birth group.

79 ASTRONOMY AND ASTROPHYSICS↗

A Consistent Phylogenetic Backbone for the Fungi

The kingdom of fungi provides model organisms for biotechnology, cell biology, genetics, and life sciences in general. Only when their phylogenetic relationships are stably resolved, can individual results from fungal research be integrated into a holistic picture of biology. However, and despite recent progress, many deep relationships within the fungi remain unclear. Here, we present the first phylogenomic study of an entire eukaryotic kingdom that uses a consistency criterion to strengthen phylogenetic conclusions. We reason that branches (splits) recovered with independent data and different tree reconstruction methods are likely to reflect true evolutionary relationships. Two complementary phylogenomic data sets based on 99 fungal genomes and 109 fungal expressed sequence tag (EST) sets analyzed with four different tree reconstruction methods shed light from different angles on the fungal tree of life. Eleven additional data sets address specifically the phylogenetic position of Blastocladiomycota, Ustilaginomycotina, and Dothideomycetes, respectively. The combined evidence from the resulting trees supports the deep-level stability of the fungal groups toward a comprehensive natural system of the fungi. In addition, our analysis reveals methodologically interesting aspects. Enrichment for EST encoded data—a common practice in phylogenomic analyses—introduces a strong bias toward slowly evolving and functionally correlated genes. Consequently, the generalization of phylogenomic data sets as collections of randomly selected genes cannot be taken for granted. A thorough characterization of the data to assess possible influences on the tree reconstruction should therefore become a standard in phylogenomic analyses.

59 BASIC BIOLOGICAL SCIENCES↗

A Molecular Biology Tool Kit for the Phototrophic Firmicute Heliobacterium modesticaldum

The heliobacteria are members of the bacterial order Clostridiales and form the only group of phototrophs in the phylum Firmicutes . Several physiological and metabolic characteristics make them an interesting subject of investigation, including their minimalist photosynthetic system, nitrogen fixation abilities, and ability to reduce toxic metals. Although the species Heliobacterium modesticaldum is an excellent candidate as a model system for the family Heliobacteriaceae , since an annotated genome and transcriptomes are available, studies in this organism have been hampered by the lack of genetic tools. We adapted techniques for genetic manipulation of related clostridial species for use with H. modesticaldum . Five heliobacterial DNA methyltransferase genes were expressed in an Escherichia coli strain engineered as a conjugative plasmid donor for broad-host-range plasmids. Premethylation of the shuttle vectors before conjugation into H. modesticaldum is absolutely required for production of transconjugant colonies. The introduced shuttle vectors are maintained stably and can be recovered using a modified minipreparation procedure developed to inhibit endogenous DNase activity. Moreover, we describe the formulation of various growth media, including a defined medium for metabolic studies and isolation of auxotrophic mutants. Heliobacteria are anoxygenic phototrophic bacteria with the simplest known photosynthetic apparatus. They are unique in using bacteriochlorophyll g as their main pigment and lacking a peripheral antenna system. Until now, research on this organism has been hampered by the lack of a genetic transformation system. Without such a system, gene knockouts, site-directed mutations, and gene expression studies cannot be performed to help us further understand or manipulate the organism. Here we report the genetic transformation of a heliobacterium, which should enable future genetic studies in this unique phototrophic organism.

59 BASIC BIOLOGICAL SCIENCES↗

Discovery of Quark-Gluon Plasma: Strangeness Diaries

Abstract We look from a theoretical perspective at the new phase of matter, quark-gluon plasma (QGP), the new form of nuclear matter created at high temperature and pressure. Here I retrace the path to QGP discovery and its exploration in terms of strangeness production and strange particle signatures. We will see the theoretical arguments that have been advanced to create interest in this determining signature of QGP. We explore the procedure used by several experimental groups making strangeness production an important tool in the search and discovery of this primordial state of matter present in the Universe before matter in its present form was formed. We close by looking at both the ongoing research that increases the reach of this observable to LHC energy scale pp collisions, and propose an interpretation of these unexpected results.

Physics↗

High quality draft genome sequences of Pseudomonas fulva DSM 17717 T , Pseudomonas parafulva DSM 17004 T and Pseudomonas cremoricolorata DSM 17059 T type strains

Pseudomonas has the highest number of species out of any genus of Gram-negative bacteria and is phylogenetically divided into several groups. The Pseudomonas putida phylogenetic branch includes at least 13 species of environmental and industrial interest, plant-associated bacteria, insect pathogens, and even some members that have been found in clinical specimens. In the context of the Genomic Encyclopedia of Bacteria and Archaea project, we present the permanent, high-quality draft genomes of the type strains of 3 taxonomically and ecologically closely related species in the Pseudomonas putida phylogenetic branch: Pseudomonas fulva DSM 17717 T , Pseudomonas parafulva DSM 17004 T and Pseudomonas cremoricolorata DSM 17059T. All three genomes are comparable in size (4.6-4.9Mb), with 4,119-4,459 protein-coding genes. Average nucleotide identity based on BLAST comparisons and digital genome-to-genome distance calculations are in good agreement with experimental DNA-DNA hybridization results. The genome sequences presented here will be very helpful in elucidating the taxonomy, phylogeny and evolution of the Pseudomonas putida species complex.

59 BASIC BIOLOGICAL SCIENCES↗

International Shock-Wave Database Project: Report of the Requirements Workshop

We report on the requirements workshop for a new project, the International Shock-Wave database (ISWdb), which was held October 31 - November 2, 2011, at GSI, Darmstadt, Germany. Participants considered the idea of this database, its structure, technical requirements, content, and principles of operation. This report presents the consensus conclusions from the workshop, key discussion points, and the goals and plan for near-term and intermediate-term development of the ISWdb. The main points of consensus from the workshop were: (1) This international database is of interest and of practical use for the shock-wave and high pressure physics communities; (2) Intermediate state information and off-Hugoniot information is important and should be included in ISWdb; (3) Other relevant high pressure and auxiliary data should be included to the database, in the future; (4) Information on the ISWdb needs to be communicated, broadly, to the research community; and (5) Operating structure will consist of an Advisory Board, subject-matter expert Moderators to vet submitted data, and the database Project Team. This brief report is intended to inform the shock-wave research community and interested funding agencies about the project, as its success, ultimately, depends on both of these groups finding sufficient value in the database to use it, contribute to it, and support it.

99 GENERAL AND MISCELLANEOUS↗

Engagement opportunities in OECD NEA benchmark development

A myriad of opportunities is available to collaborate via international benchmark exercises and experimental data preservation activities. Many such opportunities abound under the auspices of the Nuclear Science Committee of the Organisation for Economic Co-operation and Development Nuclear Energy Agency (NEA). Key projects and activities of relevance to the development of advanced reactors design include the International Criticality Safety Benchmark Evaluation Project (ICSBEP), the International Reactor Physics Experiment Evaluation Project (IRPhEP), the International Assay Data of Spent Nuclear Fuel Database (SFCOMPO), the Shielding Integral Benchmark and Archive Database (SINBAD), and The International Experimental Thermal HYdraulicS Database (TIETHYS), and various cooperative benchmark exercises. Interested participants are encouraged to contact the leadership and secretariat of the various Technical Working Groups and Working Parties to become more engaged. This paper provides a summary of the current benchmark exercises and experimental databases available for international participation.

96 KNOWLEDGE MANAGEMENT AND PRESERVATION↗

The Curious Case of PDS 11: A Nearby, >10 Myr Old, Classical T Tauri Binary System

We present results of our study of the PDS 11 binary system, which belongs to a rare class of isolated, high Galactic latitude T Tauri stars. Our spectroscopic analysis reveals that PDS 11 is an M2–M2 binary system with both components showing similar H α emission strengths. Both the components appear to be accreting and are classical T Tauri stars. The lithium doublet Li i λ 6708, a signature of youth, is present in the spectrum of PDS 11A, but not in PDS 11B. From the application of lithium depletion boundary age-dating method and a comparison with the Li i λ 6708 equivalent width distribution of moving groups, we estimated an age of 10–15 Myr for PDS 11A. Comparison with pre-main sequence evolutionary models indicates that PDS 11A is a 0.4 M {sub ⊙} T Tauri star at a distance of 114–131 pc. PDS 11 system does not appear to be associated with any known star-forming regions or moving groups. PDS 11 is a new addition, after TWA 30 and LDS 5606, to the interesting class of old, dusty, wide binary classical T Tauri systems in which both components are actively accreting.

79 ASTRONOMY AND ASTROPHYSICS↗

Rotary balances: A selected, annotated bibliography

This bibliography on rotary balances contains 102 entries. It is part of NASA's support of the AGARD Fluid Dynamics Panel Working Group 11 on Rotary Balances. This bibliography includes works that might be useful to anyone interested in building or using rotor balances. Emphasis is on the rotary balance rigs and testing techniques rather than the aerodynamic data. Also included are some publications of historical interest which relate to key events in the development and use of rotary balances. The arrangement is chronological by date of publication in the case of reports and by presentation in the case of papers.

Tuttle, Marie H.↗

Dynamic airfoil stall investigations

Experimental and computational investigations of the dynamic stall phenomenon continue to attract the attention of various research groups in the major aeronautical research laboratories. There are two reasons for this continued research interest. First, the occurrence of dynamic stall on the retreating blade of helicopters imposes a severe performance limitation and thus suggests to search for ways to delay the onset of dynamic stall. Second, the lift enhancement prior to dynamic stall presents an opportunity to achieve enhanced maneuverability of fighter aircraft. A description of the major parameters affecting dynamic stall and lift and an evaluation of research efforts prior to 1988 has been given by Carr. In this paper the authors' recent progress in the development of experimental and computational methods to analyze the dynamic stall phenomena occurring on NACA 0112 airfoils is reviewed. First, the major experimental and computational approaches and results are summarized. This is followed by an assessment of our results and an outlook toward the future.

Platzer, M. F.↗

Providing Satellite-Assisted Particulate Matter (SAPM) Estimates for the Models, In situ, and Remote sensing of Aerosols (MIRA) Working Group

The Models, In situ, and Remote sensing of Aerosols (MIRA) Working Group is an international forum that promotes collaboration amongst researchers of these three atmospheric aerosol communities. MIRA currently consists of a collection of five interdisciplinary and independently funded Topic groups with focused goals and generally involve requests for additional scientific datasets. Participants of the MIRA Satellite-Assisted Particulate Matter (SAPM) Topic group study particulate matter with diameters smaller than 2.5 microns (PM2.5), because of its substantial role in air pollution and the resulting negative impacts on human health. SAPM seeks to provide intercomparisons of different methods and techniques for obtaining surface PM2.5 proxies using spaceborne passive and active remote sensors, aerosol models, and in situ observations. The ultimate motivation of SAPM is to provide greater PM2.5 coverage than in situ ground stations, which are limited in some areas of the contiguous United States and large regions throughout the globe. In this poster presentation, we provide an overview of the PM2.5 estimation techniques applied by current SAPM team members, as well as the strengths and limitations of each technique. These approaches include spaceborne lidar (Cloud-Aerosol Lidar with Orthogonal Polarization) only, combined spaceborne lidar (Cloud Aerosol Transport System) and a model (Goddard Earth Observing System), and using aerosol optical depth (AOD) from a spaceborne passive remote sensor (Moderate Resolution Imaging Spectroradiometer) to explore city trends in AOD and relate those to city trends in PM2.5. Also in this poster presentation, we highlight results of our SAPM study of India, a country characterized by high levels of PM2.5 concentrations. We show the temporal and spatial variability of PM2.5 over India derived using various approaches and validation with ground-based in situ PM2.5 observations. The SAPM Topic group actively seeks additional collaborators, including those working with in situ aerosol measurements, and is interested in aerosol datasets to improve and/or validate the PM2.5 estimates.

Travis D Toth↗