WorldWideScience

Sample records for stable core structure

  1. Core-shell structural nanodiamond@TiN supported Pt nanoparticles as a highly efficient and stable electrocatalyst for direct methanol fuel cells

    International Nuclear Information System (INIS)

    Zhao, Yuling; Wang, Yanhui; Dong, Liang; Zhang, Yan; Huang, Junjie; Zang, Jianbing; Lu, Jing; Xu, Xipeng

    2014-01-01

    Highlights: • Core-shell structural nanodiamond@TiN was used as a novel support for Pt catalysts. • The ND@TiN support possessed a high electrochemical stability than carbon black. • The Pt/ND@TiN showed a higher catalytic activity for MOR and ORR than the Pt/C. • The Pt/ND@TiN demonstrated a much better durability compared with the Pt/C. - Abstract: A novel core-shell support material was designed with nanodiamond (ND) as core possessed excellent stability and TiN as shell improved the conductivity of support. The nano-TiN shell was decorated on the surface of ND by annealing TiO 2 in nitrogen atmosphere, and the obtained ND@TiN was employed to support Pt nanoparticles (NPs). The ND@TiN support and Pt/ND@TiN electrocatalyst were characterized by X-ray diffraction and transmission electron microscopy. ND particles were coated uniformly by the TiN layer and Pt NPs with a mean size of 4.2 nm were highly dispersed on the surface of ND@TiN. The electrochemical results confirmed that the ND@TiN support possessed a much more stability than the carbon black and exhibited a bigger background current density than the ND. The Pt/ND@TiN catalyst showed higher catalytic activity and better stability in methanol oxidation and oxygen reduction reactions compared with the Pt/C and Pt/ND

  2. Nuclear pore structure: warming up the core.

    Science.gov (United States)

    Harel, Amnon; Gruenbaum, Yosef

    2011-07-22

    Structural determination of the nuclear pore complex has been limited by the complexity and size of this cellular megalith. By taking advantage of exceptionally stable nucleoporins from the thermophilic fungus Chaetomium thermophilum, Amlacher et al. (2011) provide new insight into a core element of the nuclear pore scaffold. Copyright © 2011 Elsevier Inc. All rights reserved.

  3. Dual Core-Shell Structured Si@SiOx@C Nanocomposite Synthesized via a One-Step Pyrolysis Method as a Highly Stable Anode Material for Lithium-Ion Batteries.

    Science.gov (United States)

    Jiang, Bolun; Zeng, Shi; Wang, Hui; Liu, Daotan; Qian, Jiangfeng; Cao, Yuliang; Yang, Hanxi; Ai, Xinping

    2016-11-23

    Silicon (Si) has been regarded as a promising high-capacity anode material for developing advanced lithium-ion batteries (LIBs), but the practical application of Si anodes is still unsuccessful mainly due to the insufficient cyclability. To deal with this issue, we propose a new route to construct a dual core-shell structured Si@SiO x @C nanocomposite by direct pyrolysis of poly(methyl methacrylate) (PMMA) polymer on the surface of Si nanoparticles. Since the PMMA polymers can be chemically bonded on the nano-Si surface through the interaction between ester group and Si surface group, and thermally decomposed in the subsequent pyrolysis process with their alkyl chains converted to carbon and the residue oxygen recombining with Si to form SiO x , the dual core-shell structure can be conveniently formed in a one-step procedure. Benefiting from the strong buffering effect of the SiO x interlayer and the efficient blocking action of dense outer carbon layer in preventing electrolyte permeation, the obtained nanocomposite demonstrates a high capacity of 1972 mA h g -1 , a stable cycling performance with a capacity retention of >1030 mA h g -1 over 500 cycles, and particularly a superiorly high Coulombic efficiency of >99.5% upon extended cycling, exhibiting a great promise for practical uses. More importantly, the synthetic method proposed in this work is facile and low cost, making it more suitable for large-scale production of high capacity anode for advanced LIBs.

  4. Structure of acid-stable carmine.

    Science.gov (United States)

    Sugimoto, Naoki; Kawasaki, Yoko; Sato, Kyoko; Aoki, Hiromitsu; Ichi, Takahito; Koda, Takatoshi; Yamazaki, Takeshi; Maitani, Tamio

    2002-02-01

    Acid-stable carmine has recently been distributed in the U.S. market because of its good acid stability, but it is not permitted in Japan. We analyzed and determined the structure of the major pigment in acid-stable carmine, in order to establish an analytical method for it. Carminic acid was transformed into a different type of pigment, named acid-stable carmine, through amination when heated in ammonia solution. The features of the structure were clarified using a model compound, purpurin, in which the orientation of hydroxyl groups on the A ring of the anthraquinone skeleton is the same as that of carminic acid. By spectroscopic means and the synthesis of acid-stable carmine and purpurin derivatives, the structure of the major pigment in acid-stable carmine was established as 4-aminocarminic acid, a novel compound.

  5. Sub-structure formation in starless cores

    Science.gov (United States)

    Toci, C.; Galli, D.; Verdini, A.; Del Zanna, L.; Landi, S.

    2018-02-01

    Motivated by recent observational searches of sub-structure in starless molecular cloud cores, we investigate the evolution of density perturbations on scales smaller than the Jeans length embedded in contracting isothermal clouds, adopting the same formalism developed for the expanding Universe and the solar wind. We find that initially small amplitude, Jeans-stable perturbations (propagating as sound waves in the absence of a magnetic field) are amplified adiabatically during the contraction, approximately conserving the wave action density, until they either become non-linear and steepen into shocks at a time tnl, or become gravitationally unstable when the Jeans length decreases below the scale of the perturbations at a time tgr. We evaluate analytically the time tnl at which the perturbations enter the non-linear stage using a Burgers' equation approach, and we verify numerically that this time marks the beginning of the phase of rapid dissipation of the kinetic energy of the perturbations. We then show that for typical values of the rms Mach number in molecular cloud cores, tnl is smaller than tgr, and therefore density perturbations likely dissipate before becoming gravitational unstable. Solenoidal modes grow at a faster rate than compressible modes, and may eventually promote fragmentation through the formation of vortical structures.

  6. Engineered Magnetic Core-Shell Structures.

    Science.gov (United States)

    Alavi Nikje, Mir Mohammad; Vakili, Maryam

    2015-01-01

    In recent years, engineered magnetic core-shell structures are playing an important role in the wide range of various applications. These magnetic core-shell structures have attracted considerable attention because of their unique properties and various applications. Also, the synthesis of engineered magnetic core-shell structures has attracted practical interest because of potential applications in areas such as ferrofluids, medical imaging, drug targeting and delivery, cancer therapy, separations, and catalysis. So far a large number of engineered magnetic core-shell structures have been successfully synthesized. This review article focuses on the recent progress in synthesis and characterization of engineered magnetic core-shell structures. Also, this review gives a brief description of the various application of these structures. It is hoped that this review will play some small part in helping future developments in important field.

  7. Characterizing Facesheet/Core Disbonding in Honeycomb Core Sandwich Structure

    Science.gov (United States)

    Rinker, Martin; Ratcliffe, James G.; Adams, Daniel O.; Krueger, Ronald

    2013-01-01

    Results are presented from an experimental investigation into facesheet core disbonding in carbon fiber reinforced plastic/Nomex honeycomb sandwich structures using a Single Cantilever Beam test. Specimens with three, six and twelve-ply facesheets were tested. Specimens with different honeycomb cores consisting of four different cell sizes were also tested, in addition to specimens with three different widths. Three different data reduction methods were employed for computing apparent fracture toughness values from the test data, namely an area method, a compliance calibration technique and a modified beam theory method. The compliance calibration and modified beam theory approaches yielded comparable apparent fracture toughness values, which were generally lower than those computed using the area method. Disbonding in the three-ply facesheet specimens took place at the facesheet/core interface and yielded the lowest apparent fracture toughness values. Disbonding in the six and twelve-ply facesheet specimens took place within the core, near to the facesheet/core interface. Specimen width was not found to have a significant effect on apparent fracture toughness. The amount of scatter in the apparent fracture toughness data was found to increase with honeycomb core cell size.

  8. Seismic Study of TMSR Graphite Core Structure

    International Nuclear Information System (INIS)

    Tsang, Derek; Huang Chao Chao

    2014-01-01

    Graphite plays an important role in the thorium based molten salt reactor (TMSR) nuclear energy system. The graphite core acts as reflector, moderator and structural material in the TMSR core. The graphite core assembly has hundreds of graphite bricks interconnected with graphite keys and dowels. In other words, the graphite core is a kind of discrete stack structure with highly nonlinear dynamic behaviour, and it will show totally different dynamics responses comparing with welded structure or bolted structure when subjected to the seismic loading. Hence it is important to investigate the dynamics characteristics of the TMSR graphite core assembly and to meet the seismic design requirement. The most popular way to investigate the nonlinearity of graphite core is to do finite element analyses. Due to the large number of nonlinear behaviour caused by contacts, collisions and impacts between the graphite bricks and keys, the computational costs on seismic analysis of the whole core would be very high. Many methods have been developed in the past 20 years to conquer this difficulty. In this work substructure method and finite element method have been used to study the dynamic behaviour of a stack of graphite bricks under seismic loading. The numerical results of these two methods will be compared. The results show that the super element method is an efficient method for graphite core seismic analyses. (author)

  9. How structurally stable are global socioeconomic systems?

    Science.gov (United States)

    Saavedra, Serguei; Rohr, Rudolf P; Gilarranz, Luis J; Bascompte, Jordi

    2014-11-06

    The stability analysis of socioeconomic systems has been centred on answering whether small perturbations when a system is in a given quantitative state will push the system permanently to a different quantitative state. However, typically the quantitative state of socioeconomic systems is subject to constant change. Therefore, a key stability question that has been under-investigated is how strongly the conditions of a system itself can change before the system moves to a qualitatively different behaviour, i.e. how structurally stable the systems is. Here, we introduce a framework to investigate the structural stability of socioeconomic systems formed by a network of interactions among agents competing for resources. We measure the structural stability of the system as the range of conditions in the distribution and availability of resources compatible with the qualitative behaviour in which all the constituent agents can be self-sustained across time. To illustrate our framework, we study an empirical representation of the global socioeconomic system formed by countries sharing and competing for multinational companies used as proxy for resources. We demonstrate that the structural stability of the system is inversely associated with the level of competition and the level of heterogeneity in the distribution of resources. Importantly, we show that the qualitative behaviour of the observed global socioeconomic system is highly sensitive to changes in the distribution of resources. We believe that this work provides a methodological basis to develop sustainable strategies for socioeconomic systems subject to constantly changing conditions. © 2014 The Author(s) Published by the Royal Society. All rights reserved.

  10. Stable spatial and spatiotemporal optical soliton in the core of an optical vortex.

    Science.gov (United States)

    Adhikari, S K

    2015-10-01

    We demonstrate a robust, stable, mobile, two-dimensional (2D) spatial and three-dimensional (3D) spatiotemporal optical soliton in the core of an optical vortex, while all nonlinearities are of the cubic (Kerr) type. The 3D soliton can propagate with a constant velocity along the vortex core without any deformation. Stability of the soliton under a small perturbation is established numerically. Two such solitons moving along the vortex core can undergo a quasielastic collision at medium velocities. Possibilities of forming such a 2D spatial soliton in the core of a vortical beam are discussed.

  11. Highly stable supercapacitors with conducting polymer core-shell electrodes for energy storage applications

    KAUST Repository

    Xia, Chuan

    2015-01-14

    Conducting polymers such as polyaniline (PAni) show a great potential as pseudocapacitor materials for electrochemical energy storage applications. Yet, the cycling instability of PAni resulting from structural alteration is a major hurdle to its commercial application. Here, the development of nanostructured PAni-RuO2 core-shell arrays as electrodes for highly stable pseudocapacitors with excellent energy storage performance is reported. A thin layer of RuO2 grown by atomic layer deposition (ALD) on PAni nanofibers plays a crucial role in stabilizing the PAni pseudocapacitors and improving their energy density. The pseudocapacitors, which are based on optimized PAni-RuO2 core-shell nanostructured electrodes, exhibit very high specific capacitance (710 F g-1 at 5 mV s-1) and power density (42.2 kW kg-1) at an energy density of 10 Wh kg-1. Furthermore, they exhibit remarkable capacitance retention of ≈88% after 10 000 cycles at very high current density of 20 A g-1, superior to that of pristine PAni-based pseudocapacitors. This prominently enhanced electrochemical stability successfully demonstrates the buffering effect of ALD coating on PAni, which provides a new approach for the preparation of metal-oxide/conducting polymer hybrid electrodes with excellent electrochemical performance.

  12. The Formation of a Core Periphery Structure in Heterogeneous Financial Networks

    OpenAIRE

    Marco van der Leij; Daan in 't Veld; Cars Hommes

    2014-01-01

    Recent empirical evidence suggests that financial networks exhibit a core periphery network structure. This paper aims at giving an economic explanation for the emergence of such a structure using network formation theory. Focusing on intermediation benefits, we find that a core periphery network cannot be unilaterally stable when agents are homogeneous. The best-response dynamics converge to a unique unilaterally stable outcome ranging from an empty to denser networks as the costs of linking...

  13. DFT computations of the lattice constant, stable atomic structure and ...

    African Journals Online (AJOL)

    This paper presents the most stable atomic structure and lattice constant of Fullerenes (C60). FHI-aims DFT code was used to predict the stable structure and the computational lattice constant of C60. These were compared with known experimental structures and lattice constants of C60. The results obtained showed that ...

  14. One-pot synthesis of stable water soluble Mn:ZnSe/ZnS core/shell quantum dots

    Energy Technology Data Exchange (ETDEWEB)

    Zhang Hao; Gao Xue; Liu Siyu; Su Xingguang, E-mail: suxg@jlu.edu.cn [College of Chemistry, Jilin University, Department of Analytical Chemistry (China)

    2013-06-15

    In this paper, Mn:ZnSe/ZnS core/shell-doped quantum dots (d-dots) with 3-mercaptopropionic acid as the stabilizer are successfully synthesized through a simple one-pot synthesis procedure in aqueous solution. The average diameter of Mn:ZnSe/ZnS core/shell d-dots is about 2.9 nm, which is lager than that of Mn:ZnSe cores (about 1.9 nm). The optical features and structure of the obtained Mn:ZnSe/ZnS core/shell quantum dots have been characterized by UV-Vis and fluorescence spectroscopy, X-ray diffraction, transmission electron microscopy, and X-ray photoelectron spectroscopy. The photostability against UV irradiation and chemical stability against H{sub 2}O{sub 2} etching have been studied, and the results showed that the prepared Mn:ZnSe/ZnS core/shell d-dots are more stable than CdTe quantum dots prepared in aqueous solution. Finally, the resulting core/shell quantum dots are used as fluorescent label in human osteoblast-like HepG2 cell imaging.

  15. Influence of precipitating light elements on stable stratification below the core/mantle boundary

    Science.gov (United States)

    O'Rourke, J. G.; Stevenson, D. J.

    2017-12-01

    Stable stratification below the core/mantle boundary is often invoked to explain anomalously low seismic velocities in this region. Diffusion of light elements like oxygen or, more slowly, silicon could create a stabilizing chemical gradient in the outermost core. Heat flow less than that conducted along the adiabatic gradient may also produce thermal stratification. However, reconciling either origin with the apparent longevity (>3.45 billion years) of Earth's magnetic field remains difficult. Sub-isentropic heat flow would not drive a dynamo by thermal convection before the nucleation of the inner core, which likely occurred less than one billion years ago and did not instantly change the heat flow. Moreover, an oxygen-enriched layer below the core/mantle boundary—the source of thermal buoyancy—could establish double-diffusive convection where motion in the bulk fluid is suppressed below a slowly advancing interface. Here we present new models that explain both stable stratification and a long-lived dynamo by considering ongoing precipitation of magnesium oxide and/or silicon dioxide from the core. Lithophile elements may partition into iron alloys under extreme pressure and temperature during Earth's formation, especially after giant impacts. Modest core/mantle heat flow then drives compositional convection—regardless of thermal conductivity—since their solubility is strongly temperature-dependent. Our models begin with bulk abundances for the mantle and core determined by the redox conditions during accretion. We then track equilibration between the core and a primordial basal magma ocean followed by downward diffusion of light elements. Precipitation begins at a depth that is most sensitive to temperature and oxygen abundance and then creates feedbacks with the radial thermal and chemical profiles. Successful models feature a stable layer with low seismic velocity (which mandates multi-component evolution since a single light element typically

  16. Full-length RNA structure prediction of the HIV-1 genome reveals a conserved core domain

    DEFF Research Database (Denmark)

    Sükösd, Zsuzsanna; Andersen, Ebbe Sloth; Seemann, Ernst Stefan

    2015-01-01

    of the HIV-1 genome is highly variable in most regions, with a limited number of stable and conserved RNA secondary structures. Most interesting, a set of long distance interactions form a core organizing structure (COS) that organize the genome into three major structural domains. Despite overlapping...

  17. Characterizing core-periphery structure of complex network by h-core and fingerprint curve

    Science.gov (United States)

    Li, Simon S.; Ye, Adam Y.; Qi, Eric P.; Stanley, H. Eugene; Ye, Fred Y.

    2018-02-01

    It is proposed that the core-periphery structure of complex networks can be simulated by h-cores and fingerprint curves. While the features of core structure are characterized by h-core, the features of periphery structure are visualized by rose or spiral curve as the fingerprint curve linking to entire-network parameters. It is suggested that a complex network can be approached by h-core and rose curves as the first-order Fourier-approach, where the core-periphery structure is characterized by five parameters: network h-index, network radius, degree power, network density and average clustering coefficient. The simulation looks Fourier-like analysis.

  18. Structure of a Stable G-Hairpin

    Czech Academy of Sciences Publication Activity Database

    Gajarský, M.; Zivkovic, M.L.; Stadlbauer, Petr; Pagano, B.; Fiala, R.; Amato, J.; Tomáška, L´.; Šponer, Jiří; Plavec, J.; Trantírek, L.

    2017-01-01

    Roč. 139, č. 10 (2017), s. 3591-3594 ISSN 0002-7863 R&D Projects: GA ČR GA13-28310S; GA ČR(CZ) GA16-13721S Institutional support: RVO:68081707 Keywords : g-quadruplex structures * human telomeric dna * single-stranded- dna * g-triplex Subject RIV: CE - Biochemistry OBOR OECD: Biochemistry and molecular biology Impact factor: 13.858, year: 2016

  19. Structural and magnetic properties of core-shell iron-iron oxide nanoparticles

    DEFF Research Database (Denmark)

    Kuhn, Luise Theil; Bojesen, A.; Timmermann, L.

    2002-01-01

    We present studies of the structural and magnetic properties of core-shell iron-iron oxide nanoparticles. alpha-Fe nanoparticles were fabricated by sputtering and subsequently covered with a protective nanocrystalline oxide shell consisting of either maghaemite (gamma-Fe2O3) or partially oxidized...... magnetite (Fe3O4). We observed that the nanoparticles were stable against further oxidation, and Mossbauer spectroscopy at high applied magnetic fields and low temperatures revealed a stable form of partly oxidized magnetite. The nanocrystalline structure of the oxide shell results in strong canting...... of the spin structure in the oxide shell, which thereby modifies the magnetic properties of the core-shell nanoparticles....

  20. High precision and stable structures for particle detectors

    CERN Document Server

    Da Mota Silva, S; Hauviller, Claude

    1999-01-01

    The central detectors used in High Energy Physics Experiments require the use of light and stable structures capable of supporting delicate and precise radiation detection elements. These structures need to be highly stable under environmental conditions where external vibrations, high radiation levels, temperature and humidity gradients should be taken into account. Their main design drivers are high dimension and dynamic stability, high stiffness to mass ratio and large radiation length. For most applications, these constraints lead us to choose Carbon Fiber Reinforced Plastics ( CFRP) as structural element. The construction of light and stable structures with CFRP for these applications can be achieved by careful design engineering and further confirmation at the prototyping phase. However, the experimental environment can influence their characteristics and behavior. In this case, theuse of adaptive structures could become a solution for this problem. We are studying structures in CFRP with bonded piezoel...

  1. Preparation and characterization of highly stable lipid nanoparticles with amorphous core of tuneable viscosity.

    Science.gov (United States)

    Delmas, Thomas; Couffin, Anne-Claude; Bayle, Pierre Alain; de Crécy, François; Neumann, Emmanuelle; Vinet, Françoise; Bardet, Michel; Bibette, Jérôme; Texier, Isabelle

    2011-08-15

    Lipid nanoparticles (LNP) have been designed based on low cost and human-use approved excipients, and manufactured by an easy, robust, and up-scalable process. Fluid colloidal dispersions or gel viscous formulations of highly stable nanoparticles (more than 12 month stability is achieved for some formulations) can be obtained. Their physicochemical properties are studied by Dynamic Light Scattering, Differential Scanning Calorimetry, and NMR. The results picture nanoparticles with a non-crystalline core, which viscosity can be finely tuned by the lipid composition and the temperature. A design of experiments has been used to investigate the limits of the system colloidal stability. The impact of core and surfactant weight fractions have been explored both experimentally and using the design of experiments. The versatility of this physicochemical system could open the way to a wide range of future pharmaceutical applications. Copyright © 2011 Elsevier Inc. All rights reserved.

  2. Dynamics and control of twisting bi-stable structures

    Science.gov (United States)

    Arrieta, Andres F.; van Gemmeren, Valentin; Anderson, Aaron J.; Weaver, Paul M.

    2018-02-01

    Compliance-based morphing structures have the potential to offer large shape adaptation, high stiffness and low weight, while reducing complexity, friction, and scalability problems of mechanism based systems. A promising class of structure that enables these characteristics are multi-stable structures given their ability to exhibit large deflections and rotations without the expensive need for continuous actuation, with the latter only required intermittently. Furthermore, multi-stable structures exhibit inherently fast response due to the snap-through instability governing changes between stable states, enabling rapid configuration switching between the discrete number of programmed shapes of the structure. In this paper, the design and utilisation of the inherent nonlinear dynamics of bi-stable twisting I-beam structures for actuation with low strain piezoelectric materials is presented. The I-beam structure consists of three compliant components assembled into a monolithic single element, free of moving parts, and showing large deflections between two stable states. Finite element analysis is utilised to uncover the distribution of strain across the width of the flange, guiding the choice of positioning for piezoelectric actuators. In addition, the actuation authority is maximised by calculating the generalised coupling coefficient for different positions of the piezoelectric actuators. The results obtained are employed to tailor and test I-beam designs exhibiting desired large deflection between stable states, while still enabling the activation of snap-through with the low strain piezoelectric actuators. To this end, the dynamic response of the I-beams to piezoelectric excitation is investigated, revealing that resonant excitations are insufficient to dynamically trigger snap-through. A novel bang-bang control strategy, which exploits the nonlinear dynamics of the structure successfully triggers both single and constant snap-through between the stable states

  3. Clipperton Atoll Core 3C Stable Isotope (delta 13C, delta 18O) Data for 1893 to 1994

    Data.gov (United States)

    National Oceanic and Atmospheric Administration, Department of Commerce — 101 year stable isotope record from P. lobata, core 4B, Clipperton Atoll, eastern Pacific. Sampling at annual and 12/year resolution, files clipperton.4B.iso.txt and...

  4. Clipperton Atoll Core 2B Stable Isotope (delta 13C, delta 18O) Data for 1893 to 1994

    Data.gov (United States)

    National Oceanic and Atmospheric Administration, Department of Commerce — 101 year stable isotope record from P. lobata, core 4B, Clipperton Atoll, eastern Pacific. Sampling at annual and 12/year resolution, files clipperton.4B.iso.txt and...

  5. Clipperton Atoll Core 4B Stable Isotope (delta 13C, delta 18O) Data for 1893 to 1994

    Data.gov (United States)

    National Oceanic and Atmospheric Administration, Department of Commerce — 101 year stable isotope record from P. lobata, core 4B, Clipperton Atoll, eastern Pacific. Sampling at annual and 12/year resolution, files clipperton.4B.iso.txt and...

  6. Convergence of calculated dislocation core structures in hexagonal close packed titanium

    Science.gov (United States)

    Poschmann, Max; Asta, Mark; Chrzan, D. C.

    2018-01-01

    The core structure of -type screw dislocations in hexagonal close packed titanium is investigated computationally using periodic supercells with quadrupolar configurations in combination with density functional theory (DFT) and a modified embedded atom method (MEAM) classical potential. Two arrangements of the quadrupolar supercell configurations are examined, and within each arrangement two initial dislocation positions are compared. (Meta)stable pyramidal and prismatic dislocation core structures exist within both DFT and MEAM methods, and the relaxed structure from a given configuration resulting from our anisotropic elasticity theory solution depends only on the assumed initial dislocation positions. Within DFT we find the ground state core structure to be spread on the pyramidal plane. We find that it is necessary to include the semi-core 3p electrons as valence states in the DFT calculations in order to converge the ground state dislocation core configuration and difference in energy between structures. In terms of k-point sampling, it is found that at least a 1× 1× 15 k-point mesh is necessary to converge the dislocation core structure for a supercell one Burgers vector deep. Use of higher k-point densities or inclusion of additional semi-core electronic states as valence electrons results in the same core structure. With the MEAM potential considered in this work, we find the ground state core configuration to be spread predominantly on the prismatic plane, in contrast with the DFT results.

  7. Development of Structural Core Components for Breeder Reactors

    International Nuclear Information System (INIS)

    Saibaba, N.

    2013-01-01

    Core structural materials: • The desire is to have only fuel in the core, structural material form 25% of the total core: – To support and to retain the fuel in position; – Provide necessary ducts to make coolant flow through & transfer/remove heat. • For 500 MWe FBR with Oxide fuel (Peak Linear Power 450 W/cm), total fuel pins required in the core are of the order 39277 pins (both inner & outer core Fuel SA); • Considering 217 pins/Fuel SA there are 181 Fuel SA wrapper tubes • These structural materials see hostile core with max temperature and neutron flux

  8. Preliminary Structural Evaluation of the SMFR Core Support Structure

    International Nuclear Information System (INIS)

    Park, Chang-Gyu; Koo, Gyeong-Hoi

    2008-01-01

    The advanced reactor concepts are needed to meet the waste management, further enhanced safety, nonproliferation, and resource challenges that must accompany the deployment of increasing numbers of nuclear power plants. The SMFR(Small Modular Fast Reactor) was developed jointly by an international collaborative effort to achieve technical consensus. The SMFR has the design features of a pool-type arrangement, sodium coolant, 60 years plant life, 30 years core life, top reactor support and so on. In this study, the preliminary structural integrity for the SMFR core support structure including the inlet plenum and reactor vessel(RV) bottom head is investigated by using the ASME-NG rules for a normal operating condition

  9. Stable isotopes and their relationship to temperature and precipitation as recorded in low latitude ice cores

    International Nuclear Information System (INIS)

    Thompson, L.G.; Davis, M.E.; Pin-Nan, Lin

    2002-01-01

    The potential of stable isotopic ratios ( 18 O/ 16 O and 2 H/ 1 H) in mid to low latitude glaciers as modern tools for paleoclimate reconstruction is reviewed. The isotopic composition of precipitation should be viewed not only as a powerful proxy indicator of climate, but also as an additional parameter for understanding climate-induced changes in the water cycle, on both regional and global scales. To interpret quantitatively the ice core isotopic records, the response of the isotopic composition of precipitation to long-term fluctuations of key climatic parameters (temperature, precipitation amount, relative humidity) over a given area should be known. Furthermore, it is important to establish the transfer functions that relate the climate-induced changes of the isotopic composition of precipitation to the isotope record preserved in the glacier. The factors that govern the values of stable isotopes in snowfall are enigmatic and as yet no satisfactory model has been developed to link them directly with any one meteorological or oceanographic factor. This is particularly problematic in the high altitude glaciers in the tropics, where complications are present due not only to continental effects, but also to altitude effects and convective air mass instability, particularly in the monsoon climates of the tropics. This paper presents long and short-term perspectives of isotopic composition variations in ice cores spanning the last 25,000 years from the mid- to low-latitude glaciers. The isotopic records will also be examined as a function of the altitude of the individual coring sites which ranges from 5325 meters to 7200 meters. On the short, term isotopic records from ice cores from the Andes of South America, the Tibetan Plateau and Kilimanjaro in Africa through the year 2000 will be presented. All the tropical glaciers for which data exist are disappearing, and these sites show isotopic enrichment in the 20th century that suggests that large scale low latitude

  10. An Ocean Sediment Core-Top Calibration of Foraminiferal (Cibicides) Stable Carbon Isotope Ratios

    Science.gov (United States)

    Schmittner, A.; Mix, A. C.; Lisiecki, L. E.; Peterson, C.; Mackensen, A.; Cartapanis, O. A.

    2015-12-01

    Stable carbon isotope ratios (δ13C) measured on calcium carbonate shells of benthic foraminifera (cibicides) from late Holocene sediments (δ13CCib) are compiled and compared with newly updated datasets of contemporary water-column δ13C observations of dissolved inorganic carbon (δ13CDIC) as the initial core-top calibration of the international Ocean Circulation and CarbonCycling (OC3) project. Using selection criteria based on the spatial distance between samples we find high correlation between δ13CCib and natural (pre-industrial) δ13CDIC, confirming earlier work. However, our analysis reveals systematic differences such as higher (lower) δ13CCib values in the Atlantic (Indian and Pacific) oceans. Regression analyses are impacted by anthropogenic carbon and suggest significant carbonate ion, temperature, and pressure effects, consistent with lab experiments with planktonic foraminifera and theory. The estimated standard error of core-top sediment data is generally σ ~= 0.25 ‰, whereas modern foram data from the South Atlantic indicate larger errors (σ ~= 0.4 ‰).

  11. Network nestedness as generalized core-periphery structures

    OpenAIRE

    Lee, Sang Hoon

    2016-01-01

    The concept of nestedness, in particular for ecological and economical networks, has been introduced as a structural characteristic of real interacting systems. We suggest that the nestedness is in fact another way to express a mesoscale network property called the core-periphery structure. With real ecological mutualistic networks and synthetic model networks, we reveal the strong correlation between the nestedness and core-periphery-ness (likeness to the core-periphery structure), by defini...

  12. Network nestedness as generalized core-periphery structures.

    Science.gov (United States)

    Lee, Sang Hoon

    2016-02-01

    The concept of nestedness, in particular for ecological and economical networks, has been introduced as a structural characteristic of real interacting systems. We suggest that the nestedness is in fact another way to express a mesoscale network property called the core-periphery structure. With real ecological mutualistic networks and synthetic model networks, we reveal the strong correlation between the nestedness and core-periphery-ness (likeness to the core-periphery structure), by defining the network-level measures for nestedness and core-periphery-ness in the case of weighted and bipartite networks. However, at the same time, via more sophisticated null-model analysis, we also discover that the degree (the number of connected neighbors of a node) distribution poses quite severe restrictions on the possible nestedness and core-periphery parameter space. Therefore, there must exist structurally interwoven properties in more fundamental levels of network formation, behind this seemingly obvious relation between nestedness and core-periphery structures.

  13. New Polymorph of Fe3O4 Stable at Core-Mantle Boundary Conditions

    Science.gov (United States)

    Greenberg, E.; Prakapenka, V. B.

    2017-12-01

    Magnetite Fe3O4 (and its high-pressure polymorphs) is one of the most studied iron bearing minerals. One reason for the interest in magnetite is that it contains both Fe2+ and Fe3+, which is especially important for understanding the physical and chemical properties of Earth's deep interior. Early studies on magnetite debated the nature of the structural phase transition at 35 GPa [1-4]. This high-pressure structure was shown to be of the CaTi2O4-type [5], but with Fe3+ occupying multiple sites. Furthermore, at pressures above 65 GPa a second structural transition to a Pmma space group was shown to take place [5], similar to that in Fe3-xTixO4 solid solution [6]. Other studies have focused on the P-T stability of Fe3O4. Early studies by Lazor et al. [7] predicted that Fe3O4 might disproportionate into FeO and h-Fe2O3 at 50 GPa. Other studies suggested that the high-pressure phase should be stable up to 100 GPa [3]. A more recent experimental study by Ricolleau and Fei [8] revealed that Fe3O4 is stable at least up to 103 GPa. Thus far, structural studies of Fe3O4 have been limited to pressures below 105 GPa. We have studied Fe3O4 up to pressures of 175 GPa and temperatures above 4000K, using diamond anvil cells in combination with synchrotron x-ray diffraction and an online pulsed laser-heating system to study the stability of Fe3O4 at relevant pressure-temperature conditions. Our results show that Fe3O4 is stable up to at least 176 GPa and 4200 K. We have discovered a new polymorph of Fe3O4 at these high P-T conditions. This new phase is stable in the pressure range of at least 100Review B 70, 174106 (2004). [5] Greenberg et al. Physical Review B 95, 195150 (2017). [6] Yamanaka et al. American Mineralogist 98, 736 (2013). [7] Lazor et al. Journal of Geophysical Research 109, B05201 (2004). [8] Ricolleau and Fei. American Mineralogist 101, 719 (2016).

  14. Recent developments in low cost stable structures for space

    International Nuclear Information System (INIS)

    Thompson, T.C.; Grastataro, C.; Smith, B.G.

    1994-01-01

    The Los Alamos National Laboratory (LANL) in partnership with Composite Optics Incorporated (COI) is advancing the development of low cost, lightweight, composite technology for use in spacecraft and stable structures. The use of advanced composites is well developed, but the application of an all-composite tracker structure has never been achieved. This paper investigates the application of composite technology to the design and fabrication of an all-composite spacecraft bus for small satellites, using technology directly applicable to central tracking in a high luminosity environment. The satellite program Fast On-Orbit Recording of Transient Events (FORTE) is the second in a series of satellites to be launched into orbit for the US Department of Energy (DOE). This paper will discuss recent developments in the area of low cost composites, used for either spacecraft or ultra stable applications in high energy physics (HEP) detectors. The use of advanced composites is a relatively new development in the area of HEP. The Superconducting Super Collider (SSC) spawned a new generation of Trackers which made extensive use of graphite fiber reinforced plastic (GFRP) composite systems. LANL has designed a structure employing new fabrication technology. This concept will lower the cost of composite structures to a point that they may now compete with conventional materials. This paper will discuss the design, analysis and proposed fabrication of a small satellite structure. Central tracking structures using advanced materials capable of operating in an adverse environment typical of that found in a high luminosity collider could use identical concepts

  15. Structural Performance of Eco-Core Sandwich Panels

    Science.gov (United States)

    Shivakumar, Kunigal; Chen, Huanchun

    Eco-Core, a fire resistant core material for sandwich composite structures developed under the US Navy (ONR) program, was used to study its performance as a sandwich beam with glass/vinyl ester face sheet. Performance of Eco-Core was compared with balsa and PVC core sandwich panels. Test specimens were designed to simulate shear, flexural, and edgewise compression loadings. These tests were conducted on Eco-Core as well as balsa and PVC sandwich composite specimens. Failure loads and modes were compared with each other and the analytical prediction. Both Eco-Core and balsa cored sandwich beams had similar failure modes in all three test conditions. In the case of transversely loaded (four-point) beams Eco-Core specimens failed by core shear for span/depth (S/d) ratio less than 4 and the failure mode changed to core tension for S/d >4. This is attributed to weak tensile strength of the core material. An expression for core tension failure load based on beam theory was derived. On the other hand, ductile materials like PVC failed by core indentation. Under edgewise compression, face sheet microbuckling and general buckling are the two potential failure modes for Eco-Core and balsa core sandwich composites. For specimen length/depth ratio L/d buckling, and for L/d >13 the failure is by general buckling. Predictions from the existing equations agreed well with the experiment for both core materials. For PVC core, wrinkling/shear buckling and general buckling are the potential failure modes. For L/d ≤8.5 the failure is wrinkling and for L/d >8.5 the failure is general buckling.

  16. Profiling core-periphery network structure by random walkers

    Science.gov (United States)

    Rossa, Fabio Della; Dercole, Fabio; Piccardi, Carlo

    2013-01-01

    Disclosing the main features of the structure of a network is crucial to understand a number of static and dynamic properties, such as robustness to failures, spreading dynamics, or collective behaviours. Among the possible characterizations, the core-periphery paradigm models the network as the union of a dense core with a sparsely connected periphery, highlighting the role of each node on the basis of its topological position. Here we show that the core-periphery structure can effectively be profiled by elaborating the behaviour of a random walker. A curve—the core-periphery profile—and a numerical indicator are derived, providing a global topological portrait. Simultaneously, a coreness value is attributed to each node, qualifying its position and role. The application to social, technological, economical, and biological networks reveals the power of this technique in disclosing the overall network structure and the peculiar role of some specific nodes. PMID:23507984

  17. Finding the core : Network structure in interbank markets

    NARCIS (Netherlands)

    in 't Veld, Daan; van Lelyveld, Iman

    2014-01-01

    This paper investigates the network structure of interbank markets. Using a dataset of interbank exposures in the Netherlands, we corroborate the recent hypothesis that the core periphery model is a 'stylised fact' of interbank markets. We find a core of highly connected banks intermediating between

  18. Finding the core: network structure in interbank markets

    NARCIS (Netherlands)

    in 't Veld, D.; van Lelyveld, I.

    2014-01-01

    This paper investigates the network structure of interbank markets. Using a dataset of interbank exposures in the Netherlands, we corroborate the recent hypothesis that the core periphery model is a ‘stylised fact’ of interbank markets. We find a core of highly connected banks intermediating between

  19. Hurricane Inner-Core Structure as Revealed by GPS Dropwindsondes

    National Research Council Canada - National Science Library

    Leejoice, Robert

    2000-01-01

    New high-resolution information of the vertical thermodynamic and kinematic structure of the hurricane inner-core is now available from aircraft released Global Positioning System (GPS) dropwindsondes...

  20. A structural VAR approach to core inflation in Canada

    OpenAIRE

    Martel, Sylvain

    2008-01-01

    The author constructs a measure of core inflation using a structural vector autoregression containing oil-price growth, output growth, and inflation. This macro-founded measure of inflation forecasts total inflation at least as well as other, atheoretical measures.

  1. Process to make core-shell structured nanoparticles

    Science.gov (United States)

    Luhrs, Claudia; Phillips, Jonathan; Richard, Monique N

    2014-01-07

    Disclosed is a process for making a composite material that contains core-shell structured nanoparticles. The process includes providing a precursor in the form of a powder a liquid and/or a vapor of a liquid that contains a core material and a shell material, and suspending the precursor in an aerosol gas to produce an aerosol containing the precursor. In addition, the process includes providing a plasma that has a hot zone and passing the aerosol through the hot zone of the plasma. As the aerosol passes through the hot zone of the plasma, at least part of the core material and at least part of the shell material in the aerosol is vaporized. Vapor that contains the core material and the shell material that has been vaporized is removed from the hot zone of the plasma and allowed to condense into core-shell structured nanoparticles.

  2. Highly stable thin film transistors using multilayer channel structure

    KAUST Repository

    Nayak, Pradipta K.

    2015-03-09

    We report highly stable gate-bias stress performance of thin film transistors (TFTs) using zinc oxide (ZnO)/hafnium oxide (HfO2) multilayer structure as the channel layer. Positive and negative gate-bias stress stability of the TFTs was measured at room temperature and at 60°C. A tremendous improvement in gate-bias stress stability was obtained in case of the TFT with multiple layers of ZnO embedded between HfO2 layers compared to the TFT with a single layer of ZnO as the semiconductor. The ultra-thin HfO2 layers act as passivation layers, which prevent the adsorption of oxygen and water molecules in the ZnO layer and hence significantly improve the gate-bias stress stability of ZnO TFTs.

  3. Structure of stable degeneration of K3 surfaces into pairs of rational elliptic surfaces

    OpenAIRE

    Kimura, Yusuke

    2018-01-01

    F-theory/heterotic duality is formulated in the stable degeneration limit of a K3 fibration on the F-theory side. In this note, we analyze the structure of the stable degeneration limit. We discuss whether stable degeneration exists for pairs of rational elliptic surfaces. We demonstrate that, when two rational elliptic surfaces have an identical complex structure, stable degeneration always exists. We provide an equation that systematically describes the stable degeneration of a K3 surface i...

  4. Energetics and structures of charged helium clusters: comparing stabilities of dimer and trimer cationic cores.

    Science.gov (United States)

    Marinetti, Fabio; Bodo, Enrico; Gianturco, Franco A; Yurtsever, Ersin

    2008-12-01

    We present accurate ab initio calculations of the most stable structures of He(n)(+) clusters in order to determine the more likely ionic core arrangements existing after reaching structural equilibrium of the clusters. Two potential energy surfaces are presented: one for the He(2)(+) and the other with the He(3)(+) linear ion, both interacting with one He atom. The two computed potentials are in turn employed within a classical structure optimization where the overall interaction forces are obtained within the sum-of-potentials approximation described in the main text. Because of the presence of many-body effects within the ionic core, we find that the arrangements with He(3)(+) as a core turn out to be energetically preferred, leading to the formation of He(3)(+)(He)(n-3) stable aggregates. Nanoscopic considerations about the relative stability of clusters with the two different cores are shown to give us new information on the dynamical processes observed in the impact ionization experiments of pure helium clusters and the importance of pre-equilibrium evaporation of the ionic dimers in the ionized clusters.

  5. The electronic structure of core states under extreme compressions

    International Nuclear Information System (INIS)

    Straub, G.K.

    1992-01-01

    At normal density and for modest compressions, the electronic structure of a metal can be accurately described by treating the conduction electrons and their interactions with the usual methods of band theory. The core electrons remain essentially the same as for an isolated free atom and do not participate in the bonding forces responsible for creating a condensed phase. As the density increases, the core electrons begin to ''see'' one another as the overlap of the tails of wave functions can no longer be neglected. The electronic structure of the core electrons is responsible for an effective repulsive interaction that eventually becomes free-electron-like at very high compressions. The electronic structure of the interacting core electrons may be treated in a simple manner using the Atomic Surface Method (ASM). The ASM is a first-principles treatment of the electronic structure involving a rigorous integration of the Schroedinger equation within the atomic-sphere approximation. Solid phase wave functions are constructed from isolated atom wave functions and the band width W l and the center of gravity of the band C l are obtained from simple formulas. The ASM can also utilize analytic forms of the atomic wave functions and thus provide direct functional dependence of various aspects of the electronic structure. Of particular use in understanding the behavior of the core electrons, the ASM provides the ability to analytically determine the density dependence of the band widths and positions. The process whereby core states interact with one another is best viewed as the formation of narrow electron bands formed from atomic states. As the core-core overlap increases, the bands increase in width and mean energy. In Sec.3 this picture is further developed and from the ASM one obtains the analytic dependence on density of the relative motion of the different bands. Also in Sec. 3 is a discussion of the transition to free electron bands

  6. Stable structural color patterns displayed on transparent insect wings.

    Science.gov (United States)

    Shevtsova, Ekaterina; Hansson, Christer; Janzen, Daniel H; Kjærandsen, Jostein

    2011-01-11

    Color patterns play central roles in the behavior of insects, and are important traits for taxonomic studies. Here we report striking and stable structural color patterns--wing interference patterns (WIPs)--in the transparent wings of small Hymenoptera and Diptera, patterns that have been largely overlooked by biologists. These extremely thin wings reflect vivid color patterns caused by thin film interference. The visibility of these patterns is affected by the way the insects display their wings against various backgrounds with different light properties. The specific color sequence displayed lacks pure red and matches the color vision of most insects, strongly suggesting that the biological significance of WIPs lies in visual signaling. Taxon-specific color patterns are formed by uneven membrane thickness, pigmentation, venation, and hair placement. The optically refracted pattern is also stabilized by microstructures of the wing such as membrane corrugations and spherical cell structures that reinforce the pattern and make it essentially noniridescent over a large range of light incidences. WIPs can be applied to map the micromorphology of wings through direct observation and are useful in several fields of biology. We demonstrate their usefulness as identification patterns to solve cases of cryptic species complexes in tiny parasitic wasps, and indicate their potentials for research on the genetic control of wing development through direct links between the transregulatory wing landscape and interference patterns we observe in Drosophila model species. Some species display sexually dimorphic WIPs, suggesting sexual selection as one of the driving forces for their evolution.

  7. Biochemical and stable carbon isotope records of mangrove derived organic matter in the sediment cores

    Digital Repository Service at National Institute of Oceanography (India)

    Manju, M.N.; Resmi, P.; RatheeshKumar, C.S.; Gireeshkumar, T.R.; Chandramohanakumar, N.; Joseph, M.M.

    Core sediments from five mangrove ecosystems along northern Kerala Coast were collected to evaluate the nature and sources of organic matter in these ecosystems. General sedimentary parameters (pH, Eh, grain size and total organic carbon...

  8. Flexural Behavior of Aluminum Honeycomb Core Sandwich Structure

    Science.gov (United States)

    Matta, Vidyasagar; Kumar, J. Suresh; Venkataraviteja, Duddu; Reddy, Guggulla Bharath Kumar

    2017-05-01

    This project is concerned with the fabrication and flexural testing of aluminium honey comb sandwich structure which is a special case of composite materials that is fabricated by attaching two thin but stiff skins to a light weight but thick core. The core material is normally low density material but its high thickness provide the sandwich composite with high bonding stiffness. Honeycomb core are classified into two types based on the materials and structures. Hexagonal shape has a unique properties i.e has more bonding strength and less formation time based on the cell size and sheet thickness. Sandwich structure exhibit different properties such as high load bearing capacity at low weight and has excellent thermal insulation. By considering the above properties it has tendency to minimize the structural problem. So honey comb sandwich structure is choosed. The core structure has a different applications such as aircraft, ship interiors, construction industries. As there is no proper research on strength characteristics of sandwich structure. So, we use light weight material to desire the strength. There are different parameters involved in this structure i.e cell size, sheet thickness and core height. In this project we considered 3 level of comparison among the 3 different parameters cell size of 4, 6 and 8 mm, sheet thickness of 0.3, 0.5 and 0.7 mm, and core height of 20,25 and 30 mm. In order to reduce the number of experiment we use taguchi design of experiment, and we select the L8 orthogonal array is the best array for this type of situation, which clearly identifies the parameters by independent of material weight to support this we add the minitab software, to identify the main effective plots and regression equation which involves the individual response and corresponding parameters. Aluminium material is used for the fabrication of Honeycomb sandwich structure among the various grades of aluminium we consider the AL6061 which is light weight material

  9. A unified method of detecting core-periphery structure and community structure in networks.

    Science.gov (United States)

    Xiang, Bing-Bing; Bao, Zhong-Kui; Ma, Chuang; Zhang, Xingyi; Chen, Han-Shuang; Zhang, Hai-Feng

    2018-01-01

    The core-periphery structure and the community structure are two typical meso-scale structures in complex networks. Although community detection has been extensively investigated from different perspectives, the definition and the detection of the core-periphery structure have not received much attention. Furthermore, the detection problems of the core-periphery and community structure were separately investigated. In this paper, we develop a unified framework to simultaneously detect the core-periphery structure and community structure in complex networks. Moreover, there are several extra advantages of our algorithm: our method can detect not only single but also multiple pairs of core-periphery structures; the overlapping nodes belonging to different communities can be identified; different scales of core-periphery structures can be detected by adjusting the size of the core. The good performance of the method has been validated on synthetic and real complex networks. So, we provide a basic framework to detect the two typical meso-scale structures: the core-periphery structure and the community structure.

  10. A unified method of detecting core-periphery structure and community structure in networks

    Science.gov (United States)

    Xiang, Bing-Bing; Bao, Zhong-Kui; Ma, Chuang; Zhang, Xingyi; Chen, Han-Shuang; Zhang, Hai-Feng

    2018-01-01

    The core-periphery structure and the community structure are two typical meso-scale structures in complex networks. Although community detection has been extensively investigated from different perspectives, the definition and the detection of the core-periphery structure have not received much attention. Furthermore, the detection problems of the core-periphery and community structure were separately investigated. In this paper, we develop a unified framework to simultaneously detect the core-periphery structure and community structure in complex networks. Moreover, there are several extra advantages of our algorithm: our method can detect not only single but also multiple pairs of core-periphery structures; the overlapping nodes belonging to different communities can be identified; different scales of core-periphery structures can be detected by adjusting the size of the core. The good performance of the method has been validated on synthetic and real complex networks. So, we provide a basic framework to detect the two typical meso-scale structures: the core-periphery structure and the community structure.

  11. Disentangling bipartite and core-periphery structure in financial networks

    OpenAIRE

    Barucca, Paolo; Lillo, Fabrizio

    2015-01-01

    A growing number of systems are represented as networks whose architecture conveys significant information and determines many of their properties. Examples of network architecture include modular, bipartite, and core-periphery structures. However inferring the network structure is a non trivial task and can depend sometimes on the chosen null model. Here we propose a method for classifying network structures and ranking its nodes in a statistically well-grounded fashion. The method is based ...

  12. Surface and Core Electronic Structure of Oxidized Silicon Nanocrystals

    Directory of Open Access Journals (Sweden)

    Noor A. Nama

    2010-01-01

    Full Text Available Ab initio restricted Hartree-Fock method within the framework of large unit cell formalism is used to simulate silicon nanocrystals between 216 and 1000 atoms (1.6–2.65 nm in diameter that include Bravais and primitive cell multiples. The investigated properties include core and oxidized surface properties. Results revealed that electronic properties converge to some limit as the size of the nanocrystal increases. Increasing the size of the core of a nanocrystal resulted in an increase of the energy gap, valence band width, and cohesive energy. The lattice constant of the core and oxidized surface parts shows a decreasing trend as the nanocrystal increases in a size that converges to 5.28 Ǻ in a good agreement with the experiment. Surface and core convergence to the same lattice constant reflects good adherence of oxide layer at the surface. The core density of states shows highly degenerate states that split at the oxygenated (001-(1×1 surface due to symmetry breaking. The nanocrystal surface shows smaller gap and higher valence and conduction bands when compared to the core part, due to oxygen surface atoms and reduced structural symmetry. The smaller surface energy gap shows that energy gap of the nanocrystal is controlled by the surface part. Unlike the core part, the surface part shows a descending energy gap that proves its obedience to quantum confinement effects. Nanocrystal geometry proved to have some influence on all electronic properties including the energy gap.

  13. The Core Gut Microbiome of the American Cockroach, Periplaneta americana, Is Stable and Resilient to Dietary Shifts.

    Science.gov (United States)

    Tinker, Kara A; Ottesen, Elizabeth A

    2016-11-15

    The omnivorous cockroach Periplaneta americana hosts a diverse hindgut microbiota encompassing hundreds of microbial species. In this study, we used 16S rRNA gene sequencing to examine the effect of diet on the composition of the P. americana hindgut microbial community. Results show that the hindgut microbiota of P. americana exhibit a highly stable core microbial community with low variance in compositions between individuals and minimal community change in response to dietary shifts. This core hindgut microbiome is shared between laboratory-hosted and wild-caught individuals, although wild-caught specimens exhibited a higher diversity of low-abundance microbes that were lost following extended cultivation under laboratory conditions. This taxonomic stability strongly contrasts with observations of the gut microbiota of mammals, which have been shown to be highly responsive to dietary change. A comparison of P. americana hindgut samples with human fecal samples indicated that the cockroach hindgut community exhibited higher alpha diversity but a substantially lower beta diversity than the human gut microbiome. This suggests that cockroaches have evolved unique mechanisms for establishing and maintaining a diverse and stable core microbiome. The gut microbiome plays an important role in the overall health of its host. A healthy gut microbiota typically assists with defense against pathogens and the digestion and absorption of nutrients from food, while dysbiosis of the gut microbiota has been associated with reduced health. In this study, we examined the composition and stability of the gut microbiota from the omnivorous cockroach Periplaneta americana. We found that P. americana hosts a diverse core gut microbiome that remains stable after drastic long-term changes in diet. While other insects, notably ant and bee species, have evolved mechanisms for maintaining a stable association with specific gut microbiota, these insects typically host low-diversity gut

  14. Magnetization processes in core/shell exchange-spring structures.

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, J. S.

    2015-03-27

    The magnetization reversal processes in cylindrical and spherical soft core/hard shell exchange-spring structures are investigated via the analytical nucleation theory, and are verified with numerical micromagnetic simulations. At small core sizes, the nucleation of magnetic reversal proceeds via the modified bulging mode, where the transverse component of the magnetization is only semi-coherent in direction and the nucleation field contains a contribution from self-demagnetization. For large core sizes, the modified curling mode, where the magnetization configuration is vortex-like, is favored at nucleation. The preference for the modified curling mode is beneficial in that the fluxclosure allows cylindrical and spherical core/shell exchange-spring elements to be densely packed into bulk permanent magnets without affecting the nucleation field, thereby offering the potential for high energy product.

  15. Full-length RNA structure prediction of the HIV-1 genome reveals a conserved core domain.

    Science.gov (United States)

    Sükösd, Zsuzsanna; Andersen, Ebbe S; Seemann, Stefan E; Jensen, Mads Krogh; Hansen, Mathias; Gorodkin, Jan; Kjems, Jørgen

    2015-12-02

    A distance constrained secondary structural model of the ≈10 kb RNA genome of the HIV-1 has been predicted but higher-order structures, involving long distance interactions, are currently unknown. We present the first global RNA secondary structure model for the HIV-1 genome, which integrates both comparative structure analysis and information from experimental data in a full-length prediction without distance constraints. Besides recovering known structural elements, we predict several novel structural elements that are conserved in HIV-1 evolution. Our results also indicate that the structure of the HIV-1 genome is highly variable in most regions, with a limited number of stable and conserved RNA secondary structures. Most interesting, a set of long distance interactions form a core organizing structure (COS) that organize the genome into three major structural domains. Despite overlapping protein-coding regions the COS is supported by a particular high frequency of compensatory base changes, suggesting functional importance for this element. This new structural element potentially organizes the whole genome into three major domains protruding from a conserved core structure with potential roles in replication and evolution for the virus. © The Author(s) 2015. Published by Oxford University Press on behalf of Nucleic Acids Research.

  16. Identification of core-periphery structure in networks.

    Science.gov (United States)

    Zhang, Xiao; Martin, Travis; Newman, M E J

    2015-03-01

    Many networks can be usefully decomposed into a dense core plus an outlying, loosely connected periphery. Here we propose an algorithm for performing such a decomposition on empirical network data using methods of statistical inference. Our method fits a generative model of core-periphery structure to observed data using a combination of an expectation-maximization algorithm for calculating the parameters of the model and a belief propagation algorithm for calculating the decomposition itself. We find the method to be efficient, scaling easily to networks with a million or more nodes, and we test it on a range of networks, including real-world examples as well as computer-generated benchmarks, for which it successfully identifies known core-periphery structure with low error rate. We also demonstrate that the method is immune to the detectability transition observed in the related community detection problem, which prevents the detection of community structure when that structure is too weak. There is no such transition for core-periphery structure, which is detectable, albeit with some statistical error, no matter how weak it is.

  17. Improved methodologies for continuous-flow analysis of stable water isotopes in ice cores

    Science.gov (United States)

    Jones, Tyler R.; White, James W. C.; Steig, Eric J.; Vaughn, Bruce H.; Morris, Valerie; Gkinis, Vasileios; Markle, Bradley R.; Schoenemann, Spruce W.

    2017-02-01

    Water isotopes in ice cores are used as a climate proxy for local temperature and regional atmospheric circulation as well as evaporative conditions in moisture source regions. Traditional measurements of water isotopes have been achieved using magnetic sector isotope ratio mass spectrometry (IRMS). However, a number of recent studies have shown that laser absorption spectrometry (LAS) performs as well or better than IRMS. The new LAS technology has been combined with continuous-flow analysis (CFA) to improve data density and sample throughput in numerous prior ice coring projects. Here, we present a comparable semi-automated LAS-CFA system for measuring high-resolution water isotopes of ice cores. We outline new methods for partitioning both system precision and mixing length into liquid and vapor components - useful measures for defining and improving the overall performance of the system. Critically, these methods take into account the uncertainty of depth registration that is not present in IRMS nor fully accounted for in other CFA studies. These analyses are achieved using samples from a South Pole firn core, a Greenland ice core, and the West Antarctic Ice Sheet (WAIS) Divide ice core. The measurement system utilizes a 16-position carousel contained in a freezer to consecutively deliver ˜ 1 m × 1.3 cm2 ice sticks to a temperature-controlled melt head, where the ice is converted to a continuous liquid stream and eventually vaporized using a concentric nebulizer for isotopic analysis. An integrated delivery system for water isotope standards is used for calibration to the Vienna Standard Mean Ocean Water (VSMOW) scale, and depth registration is achieved using a precise overhead laser distance device with an uncertainty of ±0.2 mm. As an added check on the system, we perform inter-lab LAS comparisons using WAIS Divide ice samples, a corroboratory step not taken in prior CFA studies. The overall results are important for substantiating data obtained from LAS

  18. Polymorphism of dislocation core structures at the atomic scale.

    Science.gov (United States)

    Wang, Zhongchang; Saito, Mitsuhiro; McKenna, Keith P; Ikuhara, Yuichi

    2014-01-01

    Dislocation defects together with their associated strain fields and segregated impurities are of considerable significance in many areas of materials science. However, their atomic-scale structures have remained extremely challenging to resolve, limiting our understanding of these ubiquitous defects. Here, by developing a complex modelling approach in combination with bicrystal experiments and systematic atomic-resolution imaging, we are now able to pinpoint individual dislocation cores at the atomic scale, leading to the discovery that even simple magnesium oxide can exhibit polymorphism of core structures for a given dislocation species. These polymorphic cores are associated with local variations in strain fields, segregation of defects, and electronic states, adding a new dimension to understanding the properties of dislocations in real materials. The findings advance our fundamental understanding of basic behaviours of dislocations and demonstrate that quantitative prediction and characterization of dislocations in real materials is possible.

  19. Hypervelocity Impact Evaluation of Metal Foam Core Sandwich Structures

    Science.gov (United States)

    Yasensky, John; Christiansen, Eric L.

    2007-01-01

    A series of hypervelocity impact (HVI) tests were conducted by the NASA Johnson Space Center (JSC) Hypervelocity Impact Technology Facility (HITF) [1], building 267 (Houston, Texas) between January 2003 and December 2005 to test the HVI performance of metal foams, as compared to the metal honeycomb panels currently in service. The HITF testing was conducted at the NASA JSC White Sands Testing Facility (WSTF) at Las Cruces, New Mexico. Eric L. Christiansen, Ph.D., and NASA Lead for Micro-Meteoroid Orbital Debris (MMOD) Protection requested these hypervelocity impact tests as part of shielding research conducted for the JSC Center Director Discretionary Fund (CDDF) project. The structure tested is a metal foam sandwich structure; a metal foam core between two metal facesheets. Aluminum and Titanium metals were tested for foam sandwich and honeycomb sandwich structures. Aluminum honeycomb core material is currently used in Orbiter Vehicle (OV) radiator panels and in other places in space structures. It has many desirable characteristics and performs well by many measures, especially when normalized by density. Aluminum honeycomb does not perform well in Hypervelocity Impact (HVI) Testing. This is a concern, as honeycomb panels are often exposed to space environments, and take on the role of Micrometeoroid / Orbital Debris (MMOD) shielding. Therefore, information on possible replacement core materials which perform adequately in all necessary functions of the material would be useful. In this report, HVI data is gathered for these two core materials in certain configurations and compared to gain understanding of the metal foam HVI performance.

  20. How Does Amino Acid Ligand Modulate Au Core Structure and Characteristics in Peptide Coated Au Nanocluster?

    Science.gov (United States)

    Li, Nan; Li, Xu; Zhao, Hongkang; Zhao, Lina

    2018-03-01

    The atomic structures and the corresponding physicochemical properties of peptide coated Au nanoclusters determine their distinctive biological targeting applications. To learn the modulation of amino acid ligand on the atomic structure and electronic characteristics of coated Au core is the fundamental knowledge for peptide coated Au nanocluster design and construction. Based on our recent coated Au nanocluster configuration study (Nanoscale, 2016, 8, 11454), we built the typically simplified Au13(Cys-Au-Cys) system to more clearly learn the basic modulation information of amino acid ligand on Au core by the density functional theory (DFT) calculations. There are two isomers as ligand adjacent bonding (Iso1) and diagonal bonding (Iso2) to Au13 cores. The geometry optimizations indicate the adjacent bonding Iso1 is more stable than Iso2. More important, the Au13 core of Iso1 distorts much more significantly than that of Iso2 by Cys-Au-Cys bonding through the root-mean-square deviation (RMSD) analysis, which modulate their electronic characteristics in different ways. In addition, the frontier molecular orbital results of Au13(Cys-Au-Cys) isomers confirm that the Au cores mainly determine the blue shifts of Au13(Cys-Au-Cys) systems versus the original Au13 core in their UV-visible absorption spectrum studies. The configuration of Au13 core performs deformation under Cys-Au-Cys ligand modulation to reach new stability with distinct atomic structure and electronic properties, which could be the theory basis for peptide coated AuNCs design and construction.

  1. Hydro mechanical investigation on different PWR upper plenum core structures

    International Nuclear Information System (INIS)

    Shen Xiuzhong; Yu Ping'an; Yang Guanyue

    1997-01-01

    The development of Nuclear Industry relys on the safe and reliable operation of nuclear power station. Whether or not control rods moving upward and downward freedly and dropping rapidly in emergency case by order directly dominates the nuclear power regulation and emergency shut-down. So to clarify the factors which exert great influences on the drop of control rods is very important for making certain that PWR is operated safety and relialy. Among the factors, the hydraulic load on the control rods plays an important role during the operation of reactor. However because of complication in turbulent flow and concentration of the control rod guide bundles in the upper plenum, the flow field has not been thoroughly studied up to now. In order to understand the flow field in upper plenum fully a 1/4 scale transparent model of the upper plenum of a active 300 MWe PWR is designed and installed in line with similarity theory. The velocity distributions (including horizontal and axial velocity) in the upper plenum are obtained by using N-J type Dynamic Resistance Strain Foil Velocimetry (N-J type DRSFV) and Laser Doppler Velocimetry (LDV). For the sake of alleviating the hydraulic load on the control rods and making certain that the control rods and making certain that the control rods are moving upward and downward freely and drop rapidly in emergency case by order, the core structure in the upper plenum of the active 300 MWe PWR is improved as in the following 2 cases: 1 Some protective sleeves are added to the control rod guide bundles near the upper plenum outlet nozzles (symmetric 4 bundles: 02-26, 03-25, 11-29, 12-28). The rest of the core structure is same as that of the core structure in the active 300 MWe PWR. 2. The active upper plenum core structure with 37 control rod guide bundles is replaced by the core structure with 33 protective-sleeved control rod guide bundles. The results of the simulated experiments with the 2 cases are compared with that of the

  2. Structural performance of metallic sandwich beams with hollow truss cores

    International Nuclear Information System (INIS)

    Rathbun, H.J.; Zok, F.W.; Waltner, S.A.; Mercer, C.; Evans, A.G.; Queheillalt, D.T.; Wadley, H.N.G.

    2006-01-01

    The article focuses on the structural performance of sandwich beams with hollow truss lattice cores made from a ductile stainless steel. The trusses are arranged in an orthogonal (cross-ply) configuration, in either ±45 o (diamond) or 0 o /90 o (square) orientations with respect to the face sheets. The responses in shear, tension and compression, as well as simply supported and fully clamped bending, are measured for specimens with both core orientations. While the two cores perform equally well in compression, the diamond orientation exhibits higher shear strength but lower stretch resistance. For bend-dominated loadings of the sandwich beams, the core in the diamond orientation is preferred because of its higher shear strength. For stretch-dominated loadings encountered in large-displacement, fully clamped bending, the square orientation is superior. Models of core and beam yielding are used to rationalize these observations. Optimizations are then performed to identify strong lightweight designs and to enable performance comparisons with other sandwich structures

  3. Core Promoter Structure in the Oomycete Phytophthora infestans

    Science.gov (United States)

    McLeod, Adele; Smart, Christine D.; Fry, William E.

    2004-01-01

    We have investigated the core promoter structure of the oomycete Phytophthora infestans. The transcriptional start sites (TSS) of three previously characterized P. infestans genes, Piexo1, Piexo3, and Piendo1, were determined by primer extension analyses. The TSS regions were homologous to a previously identified 16-nucleotide (nt) core sequence that overlaps the TSS in most oomycete genes. The core promoter regions of Piexo1 and Piendo1 were investigated by using a transient protoplast expression assay and the reporter gene β-glucuronidase. Mutational analyses of the promoters of Piexo1 and Piendo1 showed that there is a putative core promoter element encompassing the TSS (−2 to + 5) that has high sequence and functional homology to a known core promoter element present in other eukaryotes, the initiator element (Inr). Downstream and flanking the Inr is a highly conserved oomycete promoter region (+7 to + 15), hereafter referred to as FPR (flanking promoter region), which is also important for promoter function. The importance of the 19-nt core promoter region (Inr and FPR) in Piexo1 and Piendo1 was further investigated through electrophoretic mobility shift assays (EMSA). The EMSA studies showed that (i) both core promoters were able to specifically bind a protein or protein complex in a P. infestans whole-cell protein extract and (ii) the same mutations that reduced binding of the EMSA complex also reduced β-glucuronidase (GUS) levels in transient expression assays. The consistency of results obtained using two different assays (GUS transient assays [in vivo] and EMSA studies [in vitro]) supports a convergence of inference about the relative importance of specific nucleotides within the 19-nt core promoter region. PMID:14871940

  4. Thermally-Stable High Strain Deployable Structures, Phase I

    Data.gov (United States)

    National Aeronautics and Space Administration — The proposed innovation is for the development of a thermally-stable composite made of carbon fibers and elastomeric resin. This combination of materials will allow...

  5. The structure of protostellar dense cores: a millimeter continuum study

    International Nuclear Information System (INIS)

    Motte, Frederique

    1998-01-01

    A comprehensive theoretical scenario explains low-mass star formation and describes the gravitational collapse of an isolated 'ideal' dense core. The major aim of this thesis is to check the standard model predictions on the structure of protostellar dense cores (or envelopes). The earliest stages of star formation remain poorly known because the protostars are still deeply embedded in massive, opaque circumstellar cocoons. On the one hand, sensitive bolometer arrays very recently allow us to measure the millimeter continuum emission arising from dense cores. Such observations are a powerful tool to constrain the density structure of proto-stellar dense cores (on large length scale). In particular, we studied the structure of isolated proto-stellar envelopes in Taurus and protostars in the ρ Ophiuchi cluster. In order to accurately derive their envelope density power law, we simulated the observation of several envelope models. Then we show that most of the Taurus protostars present a density structure consistent with the standard model predictions. In contrast, dense cores in ρ Ophiuchi main cloud are highly fragmented and protostellar envelope have finite size. Moreover fragmentation appears to be essential in determining the final stellar mass of ρ Oph forming stars. In clusters, fragmentation may thus be at the origin of the stellar initial mass function (IMF). On the other hand, our interferometric millimeter continuum observations are tracing (with higher angular resolution) the inner part of protostellar envelopes. Our study show that disks during protostellar stages are not yet massive and thus do not perturb the analysis of envelope density structure. (author) [fr

  6. Disentangling bipartite and core-periphery structure in financial networks

    International Nuclear Information System (INIS)

    Barucca, Paolo; Lillo, Fabrizio

    2016-01-01

    A growing number of systems are represented as networks whose architecture conveys significant information and determines many of their properties. Examples of network architecture include modular, bipartite, and core-periphery structures. However inferring the network structure is a non trivial task and can depend sometimes on the chosen null model. Here we propose a method for classifying network structures and ranking its nodes in a statistically well-grounded fashion. The method is based on the use of Belief Propagation for learning through Entropy Maximization on both the Stochastic Block Model (SBM) and the degree-corrected Stochastic Block Model (dcSBM). As a specific application we show how the combined use of the two ensembles—SBM and dcSBM—allows to disentangle the bipartite and the core-periphery structure in the case of the e-MID interbank network. Specifically we find that, taking into account the degree, this interbank network is better described by a bipartite structure, while using the SBM the core-periphery structure emerges only when data are aggregated for more than a week.

  7. The Expanded FindCore Method for Identification of a Core Atom Set for Assessment of Protein Structure Prediction

    Science.gov (United States)

    Snyder, David A.; Grullon, Jennifer; Huang, Yuanpeng J.; Tejero, Roberto; Montelione, Gaetano T.

    2014-01-01

    Maximizing the scientific impact of NMR-based structure determination requires robust and statistically sound methods for assessing the precision of NMR-derived structures. In particular, a method to define a core atom set for calculating superimpositions and validating structure predictions is critical to the use of NMR-derived structures as targets in the CASP competition. FindCore (D.A. Snyder and G.T. Montelione PROTEINS 2005;59:673–686) is a superimposition independent method for identifying a core atom set, and partitioning that set into domains. However, as FindCore optimizes superimposition by sensitively excluding not-well-defined atoms, the FindCore core may not comprise all atoms suitable for use in certain applications of NMR structures, including the CASP assessment process. Adapting the FindCore approach to assess predicted models against experimental NMR structures in CASP10 required modification of the FindCore method. This paper describes conventions and a standard protocol to calculate an “Expanded FindCore” atom set suitable for validation and application in biological and biophysical contexts. A key application of the Expanded FindCore method is to identify a core set of atoms in the experimental NMR structure for which it makes sense to validate predicted protein structure models. We demonstrate the application of this Expanded FindCore method in characterizing well-defined regions of 18 NMR-derived CASP10 target structures. The Expanded FindCore protocol defines “expanded core atom sets” that match an expert’s intuition of which parts of the structure are sufficiently well-defined to use in assessing CASP model predictions. We also illustrate the impact of this analysis on the CASP GDT assessment scores. PMID:24327305

  8. Dislocation core structures in (0001) InGaN

    Energy Technology Data Exchange (ETDEWEB)

    Rhode, S. L.; Sahonta, S.-L.; Kappers, M. J.; McAleese, C.; Humphreys, C. J. [Department of Materials Science and Metallurgy, University of Cambridge, Charles Babbage Road, Cambridge CB3 0FS (United Kingdom); Horton, M. K. [Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom); Haigh, S. J. [School of Materials, University of Manchester, Manchester M13 9PL (United Kingdom); SuperSTEM, STFC Daresbury Laboratories, Warrington WA4 4AD (United Kingdom); Pennycook, T. J. [SuperSTEM, STFC Daresbury Laboratories, Warrington WA4 4AD (United Kingdom); Department of Materials, University of Oxford, Parks Road, Oxford OX1 3PH (United Kingdom); Dusane, R. O. [Department of Metallurgical Engineering and Materials Science, Indian Institute of Technology Bombay, Mumbai 400076 (India); Moram, M. A. [Department of Materials Science and Metallurgy, University of Cambridge, Charles Babbage Road, Cambridge CB3 0FS (United Kingdom); Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom)

    2016-03-14

    Threading dislocation core structures in c-plane GaN and In{sub x}Ga{sub 1−x}N (0.057 ≤ x ≤ 0.20) films were investigated by aberration-corrected scanning transmission electron microscopy. a-type dislocations are unaffected by alloying with indium and have a 5/7-atom ring core structure in both GaN and In{sub x}Ga{sub 1−x}N. In contrast, the dissociation lengths of (a + c)-type dislocations are reduced, and new 7/4/9-atom ring and 7/4/8/5-atom ring core structures were observed for the dissociated (a + c)-type dislocations in In{sub x}Ga{sub 1−x}N, which is associated with the segregation of indium near (a + c)-type and c-type dislocation cores in In{sub x}Ga{sub 1−x}N, consistent with predictions from atomistic Monte Carlo simulations.

  9. Preparation of porous carbon particle with shell/core structure

    Directory of Open Access Journals (Sweden)

    2007-05-01

    Full Text Available Porous carbon particles with a shell/core structure have been prepared successfully by controlled precipitation of the polymer from droplets of oil-in-water emulsion, followed by curing and carbonization. The droplets of the oil phase are composed of phenolic resin (PFR, a good solvent (ethyl acetate and porogen (Poly(methyl methacrylate, PMMA. The microstructure was characterized in detail by scanning electron microscopy (SEM, transmission electron microscopy (TEM, nitrogen adsorption, and thermo gravimetric analysis (TGA. The obtained carbon particles have a capsular structure with a microporous carbon shell and a mesoporous carbon core. The BET surface area and porous volume are calculated to be 499 m2g-1 and 0.56 cm3g-1, respectively. The effects of the amount of porogen (PMMA, co-solvent (acetone and surfactant on the resultant structure were studied in detail.

  10. Structural characterization of Mumps virus fusion protein core

    International Nuclear Information System (INIS)

    Liu Yueyong; Xu Yanhui; Lou Zhiyong; Zhu Jieqing; Hu Xuebo; Gao, George F.; Qiu Bingsheng; Rao Zihe; Tien, Po

    2006-01-01

    The fusion proteins of enveloped viruses mediating the fusion between the viral and cellular membranes comprise two discontinuous heptad repeat (HR) domains located at the ectodomain of the enveloped glycoproteins. The crystal structure of the fusion protein core of Mumps virus (MuV) was determined at 2.2 A resolution. The complex is a six-helix bundle in which three HR1 peptides form a central highly hydrophobic coiled-coil and three HR2 peptides pack against the hydrophobic grooves on the surface of central coiled-coil in an oblique antiparallel manner. Fusion core of MuV, like those of simian virus 5 and human respiratory syncytium virus, forms typical 3-4-4-4-3 spacing. The similar charecterization in HR1 regions, as well as the existence of O-X-O motif in extended regions of HR2 helix, suggests a basic rule for the formation of the fusion core of viral fusion proteins

  11. Chesapeake Bay Impact Structure Deep Drilling Project Completes Coring

    Directory of Open Access Journals (Sweden)

    the Scientific Staff of the Chesapeake Bay Impact Structure Deep Drilling Project

    2006-09-01

    Full Text Available The Chesapeake Bay Impact Structure Deep Drilling Project (CBIS Project completed its coring operations during September–December 2005 and April–May 2006. Cores were collected continuously to a total depth of 1766 m. The recovered section consists of 1322 m of impactites beneath 444 m of post-impact continental shelf sediments.The CBIS Project is a joint venture of the International Continental Scientifi c Drilling Program (ICDP and the U.S. Geological Survey (USGS. Project activities began with a planning workshop in September 2003 attended by sixtythree scientists from ten countries. Field operations began with site preparation in July 2005, and coring began in September 2005. Drilling, Observation and Sampling of theEarth’s Continental Crust (DOSECC was the general contractor for the drilling operations throughout 2005.

  12. Structure of stable binary neutron star merger remnants: Role of initial spin

    Science.gov (United States)

    Kastaun, W.; Ciolfi, R.; Endrizzi, A.; Giacomazzo, B.

    2017-08-01

    We present general relativistic numerical simulations of binary neutron star (BNS) mergers with different initial spin configurations. We focus on models with stars of mass 1.4 M⊙ each, which employ the equation of state (EOS) by Shen, Horowitz, and Teige, and which result in stable NSs as merger remnants. For comparison, we consider two irrotational equal mass (M =1.35 M⊙) and unequal mass (M =1.29 , 1.42 M⊙ ) BNS models using the APR4 EOS, which result in a supramassive merger remnant. We present visualizations of the fluid flow and temperature distribution and find a strong impact of the spin on vortex structure and nonaxisymmetric deformation. We compute the radial mass distribution and the rotation profile in the equatorial plane using recently developed measures independent of spatial gauge, revealing slowly rotating cores that can be well approximated by the cores of spherical stars. We also study the influence of the spin on the inspiral phase and the gravitational wave (GW) signal. Using a newly developed analysis method, we further show that gravitational waveforms from BNS mergers can exhibit one or more phase jumps after merger, which occur together with minima of the strain amplitude. We provide a natural explanation in terms of the remnant's quadrupole moment, and show that cancellation effects due to phase jumps can have a strong impact on the GW power spectrum. Finally, we discuss the impact of the spin on the amount of ejected matter.

  13. Effects of core strength training using stable versus unstable surfaces on physical fitness in adolescents: a randomized controlled trial.

    Science.gov (United States)

    Granacher, Urs; Schellbach, Jörg; Klein, Katja; Prieske, Olaf; Baeyens, Jean-Pierre; Muehlbauer, Thomas

    2014-01-01

    It has been demonstrated that core strength training is an effective means to enhance trunk muscle strength (TMS) and proxies of physical fitness in youth. Of note, cross-sectional studies revealed that the inclusion of unstable elements in core strengthening exercises produced increases in trunk muscle activity and thus provide potential extra training stimuli for performance enhancement. Thus, utilizing unstable surfaces during core strength training may even produce larger performance gains. However, the effects of core strength training using unstable surfaces are unresolved in youth. This randomized controlled study specifically investigated the effects of core strength training performed on stable surfaces (CSTS) compared to unstable surfaces (CSTU) on physical fitness in school-aged children. Twenty-seven (14 girls, 13 boys) healthy subjects (mean age: 14 ± 1 years, age range: 13-15 years) were randomly assigned to a CSTS (n = 13) or a CSTU (n = 14) group. Both training programs lasted 6 weeks (2 sessions/week) and included frontal, dorsal, and lateral core exercises. During CSTU, these exercises were conducted on unstable surfaces (e.g., TOGU© DYNAIR CUSSIONS, THERA-BAND© STABILITY TRAINER). Significant main effects of Time (pre vs. post) were observed for the TMS tests (8-22%, f = 0.47-0.76), the jumping sideways test (4-5%, f = 1.07), and the Y balance test (2-3%, f = 0.46-0.49). Trends towards significance were found for the standing long jump test (1-3%, f = 0.39) and the stand-and-reach test (0-2%, f = 0.39). We could not detect any significant main effects of Group. Significant Time x Group interactions were detected for the stand-and-reach test in favour of the CSTU group (2%, f = 0.54). Core strength training resulted in significant increases in proxies of physical fitness in adolescents. However, CSTU as compared to CSTS had only limited additional effects (i.e., stand-and-reach test). Consequently, if the

  14. Stable and luminescent wurtzite CdS, ZnS and CdS/ZnS core/shell quantum dots

    Energy Technology Data Exchange (ETDEWEB)

    Kumar, Hitanshu; Barman, P.B.; Singh, Ragini Raj [Jaypee University of Information Technology, Department of Physics and Materials Science, Waknaghat, Solan, HP (India); Kumar, Manoj [Jaypee Institute of Information Technology, Department of Physics and Materials Science, Noida, Uttar Pradesh (India)

    2014-11-15

    This article presents first report on the highly stable and luminescent wurtzite CdS, ZnS and CdS/ZnS quantum dots (QDs) where the role of precursor selection at room temperature is the key. X-ray diffraction (XRD), optical absorbance spectroscopy, photoluminescence spectroscopy, Fourier transform infrared spectroscopy and transmission electron microscopy have been employed in order to characterize these QDs. XRD indicates the formation of wurtzite CdS, ZnS and CdS/ZnS system. Broadening in XRD peaks revealed the reduction in particle size such as 4.2, 5.2 and 5.8 nm for CdS, ZnS and CdS/ZnS, respectively, compared to their bulk counterparts. Blue shift in absorbance has been observed in each case as particles size decreases. The photoluminescence intensity emission of CdS/ZnS core/shell was strongly superior from that observed in individual CdS and ZnS nanoparticles. We also propose that the core and shell interface leads to favourable conditions that instigate photoluminescence emission in CdS/ZnS core/shell system. One notable result of this work obtained from the photoluminescence analysis is the significant reduction in full width at half maxima, in emission peak of core/shell structure which shows the enhanced monochromaticity. We have found that OH, CH{sub 2} and C-O functional groups are present on the QDs surface and that is why these QDs can be easily attachable to biomolecules. TEM analysis has been employed for confirmation of particle size and found to be 5.3, 5.8 and 6.2 nm for CdS, ZnS and CdS/ZnS structures, respectively. (orig.)

  15. Stable and luminescent wurtzite CdS, ZnS and CdS/ZnS core/shell quantum dots

    Science.gov (United States)

    Kumar, Hitanshu; Kumar, Manoj; Barman, P. B.; Singh, Ragini Raj

    2014-06-01

    This article presents first report on the highly stable and luminescent wurtzite CdS, ZnS and CdS/ZnS quantum dots (QDs) where the role of precursor selection at room temperature is the key. X-ray diffraction (XRD), optical absorbance spectroscopy, photoluminescence spectroscopy, Fourier transform infrared spectroscopy and transmission electron microscopy have been employed in order to characterize these QDs. XRD indicates the formation of wurtzite CdS, ZnS and CdS/ZnS system. Broadening in XRD peaks revealed the reduction in particle size such as 4.2, 5.2 and 5.8 nm for CdS, ZnS and CdS/ZnS, respectively, compared to their bulk counterparts. Blue shift in absorbance has been observed in each case as particles size decreases. The photoluminescence intensity emission of CdS/ZnS core/shell was strongly superior from that observed in individual CdS and ZnS nanoparticles. We also propose that the core and shell interface leads to favourable conditions that instigate photoluminescence emission in CdS/ZnS core/shell system. One notable result of this work obtained from the photoluminescence analysis is the significant reduction in full width at half maxima, in emission peak of core/shell structure which shows the enhanced monochromaticity. We have found that OH, CH2 and C-O functional groups are present on the QDs surface and that is why these QDs can be easily attachable to biomolecules. TEM analysis has been employed for confirmation of particle size and found to be 5.3, 5.8 and 6.2 nm for CdS, ZnS and CdS/ZnS structures, respectively.

  16. Use of water stable isotopes in climatology and paleoclimatology illustrated from polar ice cores studies

    International Nuclear Information System (INIS)

    Jouzel, J.; Lorius, C.

    1994-01-01

    The isotopic content of ancient waters (deuterium and oxygen 18) gives a key access to past climatic changes. An essentially linear relationship exists between the isotopic content of a precipitation and the temperature of the site (at least for medium and high latitudes). This link between water isotope atmospheric cycle and climate is presented through various isotopic models and illustrated from the deuterium profile obtained along the Vostok ice core in East Antarctica. This 2 km record which covers a full glacial-interglacial cycle (160000 years) confirms the existence of a link between insolation changes and climate (Milankovitch theory). It shows also that the greenhouse effect has played a role in glacial-interglacial changes in amplifying this orbital forcing. (authors). 10 figs., 23 refs

  17. Structural characterization of core-bradavidin in complex with biotin.

    Directory of Open Access Journals (Sweden)

    Nitin Agrawal

    Full Text Available Bradavidin is a tetrameric biotin-binding protein similar to chicken avidin and bacterial streptavidin, and was originally cloned from the nitrogen-fixing bacteria Bradyrhizobium diazoefficiens. We have previously reported the crystal structure of the full-length, wild-type (wt bradavidin with 138 amino acids, where the C-terminal residues Gly129-Lys138 ("Brad-tag" act as an intrinsic ligand (i.e. Gly129-Lys138 bind into the biotin-binding site of an adjacent subunit within the same tetramer and has potential as an affinity tag for biotechnological purposes. Here, the X-ray structure of core-bradavidin lacking the C-terminal residues Gly114-Lys138, and hence missing the Brad-tag, was crystallized in complex with biotin at 1.60 Å resolution [PDB:4BBO]. We also report a homology model of rhodavidin, an avidin-like protein from Rhodopseudomonas palustris, and of an avidin-like protein from Bradyrhizobium sp. Ai1a-2, both of which have the Brad-tag sequence at their C-terminus. Moreover, core-bradavidin V1, an engineered variant of the original core-bradavidin, was also expressed at high levels in E. coli, as well as a double mutant (Cys39Ala and Cys69Ala of core-bradavidin (CC mutant. Our data help us to further engineer the core-bradavidin-Brad-tag pair for biotechnological assays and chemical biology applications, and provide deeper insight into the biotin-binding mode of bradavidin.

  18. Core/Shell Structured Magnetic Nanoparticles for Biological Applications

    International Nuclear Information System (INIS)

    Park, Jeong Chan; Jung, Myung Hwan

    2013-01-01

    Magnetic nanoparticles have been widely used for biomedical applications, such as magnetic resonance imaging (MRI), hyperthermia, drug delivery and cell signaling. The surface modification of the nanomaterials is required for biomedical use to give physiogical stability, surface reactivity and targeting properties. Among many approaches for the surface modification with materials, such as polymers, organic ligands and metals, one of the most attractive ways is using metals. The fabrication of metal-based, monolayer-coated magnetic nanoparticles has been intensively studied. However, the synthesis of metal-capped magnetic nanoparticles with monodispersities and controllable sizes is still challenged. Recently, gold-capped magnetic nanoparticles have been reported to increase stability and to provide biocompatibility. Magnetic nanoparticle with gold coating is an attractive system, which can be stabilized in biological conditions and readily functionalized in biological conditions and readily functionalized through well-established surface modification (Au-S) chemistry. The Au coating offers plasmonic properties to magnetic nanoparticles. This makes the magnetic/Au core/shell combinations interesting for magnetic and optical applications. Herein, the synthesis and characterization of gold capped-magnetic core structured nanomaterials with different gold sources, such as gold acetate and chloroauric acid have been reported. The core/shell nanoparticles were transferred from organic to aqueous solutions for biomedical applications. Magnetic core/shell structured nanoparticles have been prepared and transferred from organic phase to aqueous solutions. The resulting Au-coated magnetic core nanoparticles might be an attractive system for biomedical applications, which are needed both magnetic resonance imaging and optical imaging

  19. Structural characterization of core-bradavidin in complex with biotin.

    Science.gov (United States)

    Agrawal, Nitin; Määttä, Juha A E; Kulomaa, Markku S; Hytönen, Vesa P; Johnson, Mark S; Airenne, Tomi T

    2017-01-01

    Bradavidin is a tetrameric biotin-binding protein similar to chicken avidin and bacterial streptavidin, and was originally cloned from the nitrogen-fixing bacteria Bradyrhizobium diazoefficiens. We have previously reported the crystal structure of the full-length, wild-type (wt) bradavidin with 138 amino acids, where the C-terminal residues Gly129-Lys138 ("Brad-tag") act as an intrinsic ligand (i.e. Gly129-Lys138 bind into the biotin-binding site of an adjacent subunit within the same tetramer) and has potential as an affinity tag for biotechnological purposes. Here, the X-ray structure of core-bradavidin lacking the C-terminal residues Gly114-Lys138, and hence missing the Brad-tag, was crystallized in complex with biotin at 1.60 Å resolution [PDB:4BBO]. We also report a homology model of rhodavidin, an avidin-like protein from Rhodopseudomonas palustris, and of an avidin-like protein from Bradyrhizobium sp. Ai1a-2, both of which have the Brad-tag sequence at their C-terminus. Moreover, core-bradavidin V1, an engineered variant of the original core-bradavidin, was also expressed at high levels in E. coli, as well as a double mutant (Cys39Ala and Cys69Ala) of core-bradavidin (CC mutant). Our data help us to further engineer the core-bradavidin-Brad-tag pair for biotechnological assays and chemical biology applications, and provide deeper insight into the biotin-binding mode of bradavidin.

  20. Structural characterization of core-bradavidin in complex with biotin

    Science.gov (United States)

    Agrawal, Nitin; Määttä, Juha A. E.; Kulomaa, Markku S.; Hytönen, Vesa P.; Johnson, Mark S.; Airenne, Tomi T.

    2017-01-01

    Bradavidin is a tetrameric biotin-binding protein similar to chicken avidin and bacterial streptavidin, and was originally cloned from the nitrogen-fixing bacteria Bradyrhizobium diazoefficiens. We have previously reported the crystal structure of the full-length, wild-type (wt) bradavidin with 138 amino acids, where the C-terminal residues Gly129-Lys138 (“Brad-tag”) act as an intrinsic ligand (i.e. Gly129-Lys138 bind into the biotin-binding site of an adjacent subunit within the same tetramer) and has potential as an affinity tag for biotechnological purposes. Here, the X-ray structure of core-bradavidin lacking the C-terminal residues Gly114-Lys138, and hence missing the Brad-tag, was crystallized in complex with biotin at 1.60 Å resolution [PDB:4BBO]. We also report a homology model of rhodavidin, an avidin-like protein from Rhodopseudomonas palustris, and of an avidin-like protein from Bradyrhizobium sp. Ai1a-2, both of which have the Brad-tag sequence at their C-terminus. Moreover, core-bradavidin V1, an engineered variant of the original core-bradavidin, was also expressed at high levels in E. coli, as well as a double mutant (Cys39Ala and Cys69Ala) of core-bradavidin (CC mutant). Our data help us to further engineer the core-bradavidin–Brad-tag pair for biotechnological assays and chemical biology applications, and provide deeper insight into the biotin-binding mode of bradavidin. PMID:28426764

  1. Imaging the modified core structure of buried Bi nanolines

    Science.gov (United States)

    Song, Jiaming; Hudak, Bethany; Sims, Hunter; Lupini, Andrew; Snijders, Paul

    Self-assembled, one-dimensional (1D) Bi nanolines on Si(100) surfaces are formed by two rows of surface Bi atoms supported by a ``Haiku'' core of reconstructed Si. These nanolines have been proposed as templates for atomic-scale wiring in nanoelectronics, or as sources of poorly soluble Bi dopants in Si films. Both applications require overgrowth of the nanolines to protect against oxidation. To understand the structure of the buried nanolines, high-resolution techniques are required. Here we employ scanning tunneling microscope (STM) and scanning transmission electron microscope (STEM) to probe Bi nanoline structures at the surface as well as at the interface with the capping layer. STM and STS data of the nanolines are consistent with the well-known Haiku core structural model. However, using high-resolution STEM we show that after depositing a Si capping layer, a modified Si core can survive depending on capping-layer growth temperature, but the Bi atoms diffuse away from their original position. The resulting 1D Si nanostructures, buried in semiconducting Si, may offer a useful nanoelectronic platform to address dopant qubits. The combination of high resolution STM and STEM provides new opportunities to guide the design of atomic-scale functional materials. Research sponsored by the Laboratory Directed Research and Development Program of Oak Ridge National Laboratory, managed by UT-Battelle, LLC, for the U. S. Department of Energy.

  2. Novel highly dispersible, thermally stable core/shell proppants for geothermal applications

    Energy Technology Data Exchange (ETDEWEB)

    Childers, Ian M.; Endres, Mackenzie; Burns, Carolyne; Garcia, Benjamin J.; Liu, Jian; Wietsma, Thomas W.; Bonneville, Alain; Moore, Joseph; Leavy, Ian I.; Zhong, Lirong; Schaef, Herbert T.; Fu, Li; Wang, Hong-Fei; Fernandez, Carlos A.

    2017-11-01

    The use of proppants during reservoir stimulation in tight oil and gas plays requires the introduction of highly viscous fluids to transport the proppants (µm–mm) with the fracturing fluid. The highly viscous fluids required result in increased pump loads and energy costs. Furthermore, although proppant deployment with fracturing fluids is a standard practice for unconventional oil and gas stimulation operations, there are only a few examples in the US of the applying proppant technology to geothermal energy production. This is due to proppant dissolution, proppant flowback and loss of permeability associated with the extreme temperatures found in enhanced geothermal systems (EGS). This work demonstrates proof-of-concept of a novel, CO2-responsive, lightweight sintered-bauxite/polymer core/shell proppant. The polymer shell has two main roles; 1) increase the stability of the proppant dispersion in water without the addition of rheology modifiers, and 2) once at the fracture network react with CO2 to promote particle aggregation and prop fractures open. In this work, both of these roles are demonstrated together with the thermal and chemical stability of the materials showing the potential of these CO2-responsive proppants as an alternative proppant technology for geothermal and unconventional oil/gas applications.

  3. Nanocrystalline Aluminum Truss Cores for Lightweight Sandwich Structures

    Science.gov (United States)

    Schaedler, Tobias A.; Chan, Lisa J.; Clough, Eric C.; Stilke, Morgan A.; Hundley, Jacob M.; Masur, Lawrence J.

    2017-12-01

    Substitution of conventional honeycomb composite sandwich structures with lighter alternatives has the potential to reduce the mass of future vehicles. Here we demonstrate nanocrystalline aluminum-manganese truss cores that achieve 2-4 times higher strength than aluminum alloy 5056 honeycombs of the same density. The scalable fabrication approach starts with additive manufacturing of polymer templates, followed by electrodeposition of nanocrystalline Al-Mn alloy, removal of the polymer, and facesheet integration. This facilitates curved and net-shaped sandwich structures, as well as co-curing of the facesheets, which eliminates the need for extra adhesive. The nanocrystalline Al-Mn alloy thin-film material exhibits high strength and ductility and can be converted into a three-dimensional hollow truss structure with this approach. Ultra-lightweight sandwich structures are of interest for a range of applications in aerospace, such as fairings, wings, and flaps, as well as for the automotive and sports industries.

  4. Structure of stable binary neutron star merger remnants: A case study

    Science.gov (United States)

    Kastaun, W.; Ciolfi, R.; Giacomazzo, B.

    2016-08-01

    In this work, we study the merger of two neutron stars with a gravitational mass of 1.4 M⊙ each, employing the Shen-Horowitz-Teige equation of state. This equation of state is a corner case, allowing the formation of a stable neutron star with the given total baryonic mass of 3.03 M⊙. We investigate in unprecedented detail the structure of the remnant, in particular the mass distribution, the thermal structure, and the rotation profile. We also compute fluid trajectories both inside the remnant and those relevant for the formation of the disk. We find a peanut-shaped fluid flow inside the remnant following a strong m =2 perturbation. Moreover, the flow is locally compressive, causing the appearance of dynamic hot spots. Further, we introduce new diagnostic measures that are easy to implement in numeric simulations and that allow one to quantify mass and compactness of merger remnants in a well-defined way. As in previous studies of supra- and hypermassive stars, we find a remnant with a slowly rotating core and an outer envelope rotating at nearly Keplerian velocity. We compute a Tolman-Oppenheimer-Volkoff star model which agrees well with that of the remnant in the core, while the latter possesses extensive outer layers rotating close to Kepler velocity. Finally, we extract the gravitational wave signal and discuss the detectability with modern observatories. This study has implications for the interpretation of gravitational wave detections from the postmerger phase and is relevant for short gamma-ray burst models.

  5. Structure of air shower disc near the core

    International Nuclear Information System (INIS)

    Inoue, N.; Kawamoto, M.; Misaki, Y.; Maeda, T.; Takeuchi, T.; Toyoda, Y.

    1985-01-01

    The longitudinal structure of the air shower disk is studied by measuring the arrival time distributions of air shower particles for showers with electron size in the range 3.2 x 10 to the 5.5. power to 3.2 x 10 to the 7.5 power in the Akeno air-shower array (930 gcm squared atmospheric depth). The average FWHM as a parameter of thickness of air shower disk increases with core distances at less than 50m. At the present stage, dependence on electron size, zenith angle and air shower age is not apparent. The average thickness of the air shower disk within a core distance of 50m could be determined by an electromagnetic cascade starting from the lower altitude

  6. Glacial/interglacial wetland, biomass burning, and geologic methane emissions constrained by dual stable isotopic CH4ice core records.

    Science.gov (United States)

    Bock, Michael; Schmitt, Jochen; Beck, Jonas; Seth, Barbara; Chappellaz, Jérôme; Fischer, Hubertus

    2017-07-18

    Atmospheric methane (CH 4 ) records reconstructed from polar ice cores represent an integrated view on processes predominantly taking place in the terrestrial biogeosphere. Here, we present dual stable isotopic methane records [δ 13 CH 4 and δD(CH 4 )] from four Antarctic ice cores, which provide improved constraints on past changes in natural methane sources. Our isotope data show that tropical wetlands and seasonally inundated floodplains are most likely the controlling sources of atmospheric methane variations for the current and two older interglacials and their preceding glacial maxima. The changes in these sources are steered by variations in temperature, precipitation, and the water table as modulated by insolation, (local) sea level, and monsoon intensity. Based on our δD(CH 4 ) constraint, it seems that geologic emissions of methane may play a steady but only minor role in atmospheric CH 4 changes and that the glacial budget is not dominated by these sources. Superimposed on the glacial/interglacial variations is a marked difference in both isotope records, with systematically higher values during the last 25,000 y compared with older time periods. This shift cannot be explained by climatic changes. Rather, our isotopic methane budget points to a marked increase in fire activity, possibly caused by biome changes and accumulation of fuel related to the late Pleistocene megafauna extinction, which took place in the course of the last glacial.

  7. Glacial/interglacial wetland, biomass burning, and geologic methane emissions constrained by dual stable isotopic CH4 ice core records

    Science.gov (United States)

    Bock, Michael; Schmitt, Jochen; Beck, Jonas; Seth, Barbara; Chappellaz, Jérôme; Fischer, Hubertus

    2017-07-01

    Atmospheric methane (CH4) records reconstructed from polar ice cores represent an integrated view on processes predominantly taking place in the terrestrial biogeosphere. Here, we present dual stable isotopic methane records [δ13CH4 and δD(CH4)] from four Antarctic ice cores, which provide improved constraints on past changes in natural methane sources. Our isotope data show that tropical wetlands and seasonally inundated floodplains are most likely the controlling sources of atmospheric methane variations for the current and two older interglacials and their preceding glacial maxima. The changes in these sources are steered by variations in temperature, precipitation, and the water table as modulated by insolation, (local) sea level, and monsoon intensity. Based on our δD(CH4) constraint, it seems that geologic emissions of methane may play a steady but only minor role in atmospheric CH4 changes and that the glacial budget is not dominated by these sources. Superimposed on the glacial/interglacial variations is a marked difference in both isotope records, with systematically higher values during the last 25,000 y compared with older time periods. This shift cannot be explained by climatic changes. Rather, our isotopic methane budget points to a marked increase in fire activity, possibly caused by biome changes and accumulation of fuel related to the late Pleistocene megafauna extinction, which took place in the course of the last glacial.

  8. Stable water isotopes of precipitation and firn cores from the northern Antarctic Peninsula region as a proxy for climate reconstruction

    Directory of Open Access Journals (Sweden)

    F. Fernandoy

    2012-03-01

    Full Text Available In order to investigate the climate variability in the northern Antarctic Peninsula region, this paper focuses on the relationship between stable isotope content of precipitation and firn, and main meteorological variables (air temperature, relative humidity, sea surface temperature, and sea ice extent. Between 2008 and 2010, we collected precipitation samples and retrieved firn cores from several key sites in this region. We conclude that the deuterium excess oscillation represents a robust indicator of the meteorological variability on a seasonal to sub-seasonal scale. Low absolute deuterium excess values and the synchronous variation of both deuterium excess and air temperature imply that the evaporation of moisture occurs in the adjacent Southern Ocean. The δ18O-air temperature relationship is complicated and significant only at a (multiseasonal scale. Backward trajectory calculations show that air-parcels arriving at the region during precipitation events predominantly originate at the South Pacific Ocean and Bellingshausen Sea. These investigations will be used as a calibration for ongoing and future research in the area, suggesting that appropriate locations for future ice core research are located above 600 m a.s.l. We selected the Plateau Laclavere, Antarctic Peninsula as the most promising site for a deeper drilling campaign.

  9. Synthesis and Performance of Highly Stable Star-Shaped Polyaniline Electrochromic Materials with Triphenylamine Core

    Science.gov (United States)

    Xiong, Shanxin; Li, Shuaishuai; Zhang, Xiangkai; Wang, Ru; Zhang, Runlan; Wang, Xiaoqin; Wu, Bohua; Gong, Ming; Chu, Jia

    2018-02-01

    The molecular architecture of conducting polymers has a significant impact on their conjugated structure and electrochemical properties. We have investigated the influence of star-shaped structure on the electrochemical and electrochromic properties of polyaniline (PANI). Star-shaped PANI (SPANI) was prepared by copolymerization of aniline with triphenylamine (TPA) using an emulsion polymerization method. With addition of less than 4.0 mol.% TPA, the resulting SPANI exhibited good solubility in xylene with dodecylbenzenesulfonic acid (DBSA) as doping acid. The structure and thermal stability of the SPANI were characterized using Fourier-transform infrared spectroscopy, Raman spectroscopy, and thermogravimetric analysis, and the electrochemical behavior was analyzed by cyclic voltammetry (CV). The electrochromic properties of SPANI were tested using an electrochemical workstation combined with an ultraviolet-visible (UV-Vis) spectrometer. The results show that, with increasing TPA loading, the thermal stability of SPANI increased. With addition of 4.0 mol.% TPA, the weight loss of SPANI was 36.9% at 700°C, much lower than the value of 71.2% for PANI at the same temperature. The low oxidation potential and large enclosed area of the CV curves indicate that SPANI possesses higher electrochemical activity than PANI. Enhanced electrochromic properties including higher optical contrast and better electrochromic stability of SPANI were also obtained. SPANI with 1.6 mol.% TPA loading exhibited the highest optical contrast of 0.71, higher than the values of 0.58 for PANI, 0.66 for SPANI-0.4%, or 0.63 for SPANI-4.0%. Overdosing of TPA resulted in slow switching speed due to slow ion transport in short branched chains of star-shaped PANI electrochromic material. Long-term stability testing confirmed that all the SPANI-based devices exhibited better stability than the PANI-based device.

  10. Stable chromium isotopic composition of meteorites and metal-silicate experiments: Implications for fractionation during core formation

    Science.gov (United States)

    Bonnand, P.; Williams, H. M.; Parkinson, I. J.; Wood, B. J.; Halliday, A. N.

    2016-02-01

    We present new mass independent and mass dependent Cr isotope compositions for meteorites measured by double spike thermal ionisation mass spectrometry. Small differences in both mass independent 53Cr and 54Cr relative to the Bulk Silicate Earth are reported and are very similar to previously published values. Carbonaceous chondrites are characterised by an excess in 54Cr compared to ordinary and enstatite chondrites which make mass independent Cr isotopes a useful tool for distinguishing between meteoritic groups. Mass dependent stable Cr isotope compositions for the same samples are also reported. Carbonaceous and ordinary chondrites are identical within uncertainty with average δ53 Cr values of - 0.118 ± 0.040 ‰ and - 0.143 ± 0.074 ‰ respectively. The heaviest isotope compositions are recorded by an enstatite chondrite and a CO carbonaceous chondrite, both of which have relatively reduced chemical compositions implying some stable Cr isotope fractionation related to redox processes in the circumstellar disk. The average δ53 Cr values for chondrites are within error of the estimate for the Bulk Silicate Earth (BSE) also determined by double spiking. The lack of isotopic difference between chondritic material and the BSE provides evidence that Cr isotopes were not fractionated during core formation on Earth. A series of high-pressure experiments was also carried out to investigate stable Cr isotope fractionation between metal and silicate and no demonstrable fractionation was observed, consistent with our meteorites data. Mass dependent Cr isotope data for achondrites suggest that Cr isotopes are fractionated during magmatic differentiation and therefore further work is required to constrain the Cr isotopic compositions of the mantles of Vesta and Mars.

  11. Space Launch System, Core Stage, Structural Test Design and Implementation

    Science.gov (United States)

    Shaughnessy, Ray

    2017-01-01

    As part of the National Aeronautics and Space Administration's (NASA) Space Launch System (SLS) Program, engineers at NASA's Marshall Space Flight Center (MSFC) in Huntsville, Alabama are working to design, develop and implement the SLS Core Stage structural testing. The SLS will have the capability to return humans to the Moon and beyond and its first launch is scheduled for December of 2017. The SLS Core Stage consist of five major elements; Forward Skirt, Liquid Oxygen (LOX) tank, Intertank (IT), Liquid Hydrogen (LH2) tank and the Engine Section (ES). Structural Test Articles (STA) for each of these elements are being designed and produced by Boeing at Michoud Assembly Facility located in New Orleans, La. The structural test for the Core Stage STAs (LH2, LOX, IT and ES) are to be conducted by the MSFC Test Laboratory. Additionally, the MSFC Test Laboratory manages the Structural Test Equipment (STE) design and development to support the STAs. It was decided early (April 2012) in the project life that the LH2 and LOX tank STAs would require new test stands and the Engine Section and Intertank would be tested in existing facilities. This decision impacted schedules immediately because the new facilities would require Construction of Facilities (C of F) funds that require congressional approval and long lead times. The Engine Section and Intertank structural test are to be conducted in existing facilities which will limit lead times required to support the first launch of SLS. With a SLS launch date of December, 2017 Boeing had a need date for testing to be complete by September of 2017 to support flight certification requirements. The test facilities were required to be ready by October of 2016 to support test article delivery. The race was on to get the stands ready before Test Article delivery and meet the test complete date of September 2017. This paper documents the past and current design and development phases and the supporting processes, tools, and

  12. Hygro-Thermal Transient Analysis for Highly Stable Structures

    CERN Document Server

    Da Mota Silva, S; Hauviller, Claude; Kanoute, P; Ribeiro, R

    1999-01-01

    This paper presents the results obtained with the simulations of a sandwich rectangular plate made of carbon/epoxy composite when subjected to temperature and humidity cycles. Fickian diffusion process, moisture transport along the interfaces and damage caused by slipping and debonding between the components of the microscopic structure are considered. The application of the design methodology to a real structure is shown.

  13. Hepatitis C Virus E2 Envelope Glycoprotein Core Structure

    Energy Technology Data Exchange (ETDEWEB)

    Kong, Leopold; Giang, Erick; Nieusma, Travis; Kadam, Rameshwar U.; Cogburn, Kristin E.; Hua, Yuanzi; Dai, Xiaoping; Stanfield, Robyn L.; Burton, Dennis R.; Ward, Andrew B.; Wilson, Ian A.; Law, Mansun

    2014-08-26

    Hepatitis C virus (HCV), a Hepacivirus, is a major cause of viral hepatitis, liver cirrhosis, and hepatocellular carcinoma. HCV envelope glycoproteins E1 and E2 mediate fusion and entry into host cells and are the primary targets of the humoral immune response. The crystal structure of the E2 core bound to broadly neutralizing antibody AR3C at 2.65 angstroms reveals a compact architecture composed of a central immunoglobulin-fold β sandwich flanked by two additional protein layers. The CD81 receptor binding site was identified by electron microscopy and site-directed mutagenesis and overlaps with the AR3C epitope. The x-ray and electron microscopy E2 structures differ markedly from predictions of an extended, three-domain, class II fusion protein fold and therefore provide valuable information for HCV drug and vaccine design.

  14. Active structural control with stable fuzzy PID techniques

    CERN Document Server

    Yu, Wen

    2016-01-01

    This book presents a detailed discussion of intelligent techniques to measure the displacement of buildings when they are subjected to vibration. It shows how these techniques are used to control active devices that can reduce vibration 60–80% more effectively than widely used passive anti-seismic systems. After introducing various structural control devices and building-modeling and active structural control methods, the authors propose offset cancellation and high-pass filtering techniques to solve some common problems of building-displacement measurement using accelerometers. The most popular control algorithms in industrial settings, PD/PID controllers, are then analyzed and then combined with fuzzy compensation. The stability of this combination is proven with standard weight-training algorithms. These conditions provide explicit methods for selecting PD/PID controllers. Finally, fuzzy-logic and sliding-mode control are applied to the control of wind-induced vibration. The methods described are support...

  15. An Energy stable Monolithic Eulerian Fluid-Structure Numerical Scheme *

    OpenAIRE

    Pironneau , Olivier

    2017-01-01

    The conservation laws of continuum mechanic written in an Eulerian frame make no difference between fluids and solids except in the expression of the stress tensors, usually with Newton's hypothesis for the fluids and Helmholtz potentials of energy for hyperelastic solids. By taking the velocities as unknown , monolithic methods for fluid structure interactions (FSI) are built. In this article such a formulation is analyzed when the fluid is compressible and the fluid is incompressible. The i...

  16. Graphites and composites irradiations for gas cooled reactor core structures

    International Nuclear Information System (INIS)

    Van der Laan, J.G.; Vreeling, J.A.; Buckthorpe, D.E.; Reed, J.

    2008-01-01

    Full text of publication follows. Material investigations are undertaken as part of the European Commission 6. Framework Programme for helium-cooled fission reactors under development like HTR, VHTR, GCFR. The work comprises a range of activities, from (pre-)qualification to screening of newly designed materials. The High Flux Reactor at Petten is the main test bed for the irradiation test programmes of the HTRM/M1, RAPHAEL and ExtreMat Integrated Projects. These projects are supported by the European Commission 5. and 6. Framework Programmes. To a large extent they form the European contribution to the Generation-IV International Forum. NRG is also performing a Materials Test Reactor project to support British Energy in preparing extended operation of their Advanced Gas-cooled Reactors (AGR). Irradiations of commercial and developmental graphite grades for HTR core structures are undertaken in the range of 650 to 950 deg C, with a view to get data on physical and mechanical properties that enable engineering design. Various C- and SiC-based composite materials are considered for support structures or specific components like control rods. Irradiation test matrices are chosen to cover commercial materials, and to provide insight on the behaviour of various fibre and matrix types, and the effects of architecture and manufacturing process. The programme is connected with modelling activities to support data trending, and improve understanding of the material behaviour and micro-structural evolution. The irradiation programme involves products from a large variety of industrial and research partners, and there is strong interaction with other high technology areas with extreme environments like space, electronics and fusion. The project on AGR core structures graphite focuses on the effects of high dose neutron irradiation and simultaneous radiolytic oxidation in a range of 350 to 450 deg C. It is aimed to provide data on graphite properties into the parameter space

  17. Inert and stable erbium(III)-cored complexes based on metalloporphyrins bearing aryl-ether dendron for optical amplification: synthesis and emission enhancement

    International Nuclear Information System (INIS)

    Oh, Jae Buem; Kim, Yong Hee; Nah, Min Kook; Kim, Hwan Kyu

    2005-01-01

    We have developed novel inert and stable erbium (Er)(III)-cored complexes based on metalloporphyrins for optical amplification. The functionalized metalloporphyrin ligands have been designed and synthesized to provide enough coordination sites for the formation of inert and stable 9-coordinated Er(III)-cored complexes. Er 3+ ions were encapsulated by the metalloporphyrin ligands, such as Zn(II)- and Pt(II)-porphyrins. The near-infrared (IR) emission intensity of Er 3+ ion is much stronger in the Er(III)-cored complex based on Pt(II)-porphyrin than Er(III)-cored complex based on Zn(II)-porphyrin. Furthermore, we have incorporated a G2-aryl-ether functionalized dendron into the Er(III)-cored complex, yielding an Er(III)-cored dendrimer complex bearing the Pt(II)-porphyrin. The Er(III)-cored dendrimer complex shows the stronger near-IR emission intensity than the corresponding complex based on Pt(II)-porphyrin by seven times in solid state. The lifetimes of the emission band of Pt(II)-porphyrin ligands in the visible region were found to be 30 and 40 μs for the Er(III)-cored complex and the Er(III)-cored dendrimer complex based on Pt(II)-porphyrin in deoxygenated THF solution samples, respectively. Also, in both cases, the sensitized luminescence intensity is increased in deoxygenated solution. Therefore, it indicates that the energy transfer from the metalloporphyrins to Er 3+ ions takes places through the triplet state. In this paper, the synthesis and photophysical properties of novel Er(III)-cored complexes based on metalloporphyrins and Er(III)-cored dendrimer complex based on metalloporphyrin will be discussed

  18. Stable Core, Shifting Periphery?

    DEFF Research Database (Denmark)

    Gravier, Magali

    The paper discusses the usefulness of the concept of empire in the study of the European Union, the integration process and the development EU’s external relations. In order to do so, it reflects critically on the use of this concept in the broader context of contemporary polities and selected...

  19. Crystalline mesoporous zirconia catalysts having stable tetragonal pore wall structure

    Science.gov (United States)

    Sachtler, Wolfgang M. H.; Huang, Yin-Yan

    1998-01-01

    Methods for the preparation of new sulfated mesoporous zirconia materials/catalysts with crystalline pore walls of predominantly tetragonal crystal structure, characterized by nitrogen physisorption measurement, X-ray diffraction, transmission electron microscopy and catalytic tests using n-butane isomerization to iso-butane and alkylation of 1-naphthol with 4-tert-butylstyrene as probe reactions. Sulfate deposition is preferred for the transformation of a mesoporous precursor with amorphous pore walls into a material with crystalline pore walls maintaining the mesoporous characteristics.

  20. Numerically stable fluid–structure interactions between compressible flow and solid structures

    KAUST Repository

    Grétarsson, Jón Tómas

    2011-04-01

    We propose a novel method to implicitly two-way couple Eulerian compressible flow to volumetric Lagrangian solids. The method works for both deformable and rigid solids and for arbitrary equations of state. The method exploits the formulation of [11] which solves compressible fluid in a semi-implicit manner, solving for the advection part explicitly and then correcting the intermediate state to time tn+1 using an implicit pressure, obtained by solving a modified Poisson system. Similar to previous fluid-structure interaction methods, we apply pressure forces to the solid and enforce a velocity boundary condition on the fluid in order to satisfy a no-slip constraint. Unlike previous methods, however, we apply these coupled interactions implicitly by adding the constraint to the pressure system and combining it with any implicit solid forces in order to obtain a strongly coupled, symmetric indefinite system (similar to [17], which only handles incompressible flow). We also show that, under a few reasonable assumptions, this system can be made symmetric positive-definite by following the methodology of [16]. Because our method handles the fluid-structure interactions implicitly, we avoid introducing any new time step restrictions and obtain stable results even for high density-to-mass ratios, where explicit methods struggle or fail. We exactly conserve momentum and kinetic energy (thermal fluid-structure interactions are not considered) at the fluid-structure interface, and hence naturally handle highly non-linear phenomenon such as shocks, contacts and rarefactions. © 2011 Elsevier Inc.

  1. Aqueous synthesis of highly stable CdTe/ZnS Core/Shell quantum dots for bioimaging.

    Science.gov (United States)

    Saikia, D; Chakravarty, S; Sarma, N S; Bhattacharjee, S; Datta, P; Adhikary, N C

    2017-05-01

    In this work, we report the synthesis, characterization and biological application of highly stable CdTe/ZnS (cadmium tellurite/zinc sulphide) Core/Shell (CS) quantum dots (QDs) capped with mercaptosuccinic acid (MSA). The CS QDs were synthesized using a simple one-pot aqueous method. The synthesized CdTe/ZnS CS QDs were found to exhibit excellent stability even 100 days after preparation and also showed better photoluminescence quantum yield (PLQY) of about 50% compared with that of only CdTe QDs which was nearly 12%. The formation of the CdTe/ZnS CS was confirmed by high-resolution transmission electron microscopy (HR-TEM), and Fourier transform infra-red (FTIR) and X-ray diffraction (XRD) analyses. Further, on extending our study towards bioimaging of E. coli cells using the QDs samples, we found that CdTe/ZnS CS QDs showed better results compared with CdTe QDs. Copyright © 2016 John Wiley & Sons, Ltd.

  2. 3.5Å cryoEM structure of hepatitis B virus core assembled from full-length core protein.

    Directory of Open Access Journals (Sweden)

    Xuekui Yu

    Full Text Available The capsid shell of infectious hepatitis B virus (HBV is composed of 240 copies of a single protein called HBV core antigen (HBc. An atomic model of a core assembled from truncated HBc was determined previously by X-ray crystallography. In an attempt to obtain atomic structural information of HBV core in a near native, non-crystalline environment, we reconstructed a 3.5Å-resolution structure of a recombinant core assembled from full-length HBc by cryo electron microscopy (cryoEM and derived an atomic model. The structure shows that the 240 molecules of full-length HBc form a core with two layers. The outer layer, composed of the N-terminal assembly domain, is similar to the crystal structure of the truncated HBc, but has three differences. First, unlike the crystal structure, our cryoEM structure shows no disulfide bond between the Cys61 residues of the two subunits within the dimer building block, indicating such bond is not required for core formation. Second, our cryoEM structure reveals up to four more residues in the linker region (amino acids 140-149. Third, the loops in the cryoEM structures containing this linker region in subunits B and C are oriented differently (~30° and ~90° from their counterparts in the crystal structure. The inner layer, composed of the C-terminal arginine-rich domain (ARD and the ARD-bound RNAs, is partially-ordered and connected with the outer layer through linkers positioned around the two-fold axes. Weak densities emanate from the rims of positively charged channels through the icosahedral three-fold and local three-fold axes. We attribute these densities to the exposed portions of some ARDs, thus explaining ARD's accessibility by proteases and antibodies. Our data supports a role of ARD in mediating communication between inside and outside of the core during HBV maturation and envelopment.

  3. Spatial variations in food web structures with alternative stable states: evidence from stable isotope analysis in a large eutrophic lake

    Science.gov (United States)

    Li, Yunkai; Zhang, Yuying; Xu, Jun; Zhang, Shuo

    2017-05-01

    Food web structures are well known to vary widely among ecosystems. Moreover, many food web studies of lakes have generally attempted to characterize the overall food web structure and have largely ignored internal spatial and environmental variations. In this study, we hypothesize that there is a high degree of spatial heterogeneity within an ecosystem and such heterogeneity may lead to strong variations in environmental conditions and resource availability, in turn resulting in different trophic pathways. Stable carbon and nitrogen isotopes were employed for the whole food web to describe the structure of the food web in different sub-basins within Taihu Lake. This lake is a large eutrophic freshwater lake that has been intensively managed and highly influenced by human activities for more than 50 years. The results show significant isotopic differences between basins with different environmental characteristics. Such differences likely result from isotopic baseline differences combining with a shift in food web structure. Both are related to local spatial heterogeneity in nutrient loading in waters. Such variation should be explicitly considered in future food web studies and ecosystem-based management in this lake ecosystem.

  4. Atomic structure and thermal stability of Pt-Fe bimetallic nanoparticles: from alloy to core/shell architectures.

    Science.gov (United States)

    Huang, Rao; Wen, Yu-Hua; Shao, Gui-Fang; Sun, Shi-Gang

    2016-06-22

    Bimetallic nanoparticles comprising noble metal and non-noble metal have attracted intense interest over the past few decades due to their low cost and significantly enhanced catalytic performances. In this article, we have explored the atomic structure and thermal stability of Pt-Fe alloy and core-shell nanoparticles by molecular dynamics simulations. In Fe-core/Pt-shell nanoparticles, Fe with three different structures, i.e., body-centered cubic (bcc), face-centered cubic (fcc), and amorphous phases, has been considered. Our results show that Pt-Fe alloy is the most stable configuration among the four types of bimetallic nanoparticles. It has been discovered that the amorphous Fe cannot stably exist in the core and preferentially transforms into the fcc phase. The phase transition from bcc to hexagonal close packed (hcp) has also been observed in bcc-Fe-core/Pt-shell nanoparticles. In contrast, Fe with the fcc structure is the most preferred as the core component. These findings are helpful for understanding the structure-property relationships of Pt-Fe bimetallic nanoparticles, and are also of significance to the synthesis and application of noble metal based nanoparticle catalysts.

  5. Electronic structure of molecules using relativistic effective core potentials

    International Nuclear Information System (INIS)

    Hay, P.J.

    1981-01-01

    Starting with one-component Cowan-Griffin relativistic Hartree-Fock orbitals, which successfully incorporate the mass-velocity and Darwin terms present in more complicated wavefunctions such as Dirac-Hartree-Fock, one can derive relativistic effective core potentials (RECP's) to carry out molecular calculations. These potentials implicitly include the dominant relativistic terms for molecules while allowing one to use the traditional quantum chemical techniques for studying the electronic structure of molecules. The effects of spin-orbit coupling can then be included using orbitals from such calculations using an effective 1-electron, 1-center spin-orbit operator. Applications to molecular systems involving heavy atoms, show good agreement with available spectroscopic data on molecular geometries and excitation energies

  6. Finite-element method for above-core structures

    International Nuclear Information System (INIS)

    Kennedy, J.M.; Belytschko, T.B.

    1979-12-01

    Three-dimensional finite-element models for the treatment of the nonlinear, transient response of a fast breeder reactor's above-core structures are described. For purposes of treating arbitrarily large rotations, node orientations are described by unit vectors and the deformable elements are treated by a corotational formulation in which the coordinate system is embedded in the elements. Deformable elements may be connected either to nodes directly or through rigid bodies. The time integration is carried out by the Newmark β method. These features have been incorporated to form the finite-element program SAFE/RAS (Safety Analysis by Finite Elements/Reactor Analysis and Safety Division). Computations are presented for semianalytical comparisons, simple scoping studies, and Stanford Research Institute (SRI) test comparisons

  7. Regional Comparisons of Oceanic Food Web Structure Using Stable Isotopes

    Science.gov (United States)

    Choy, A.; Drazen, J.; Popp, B. N.; Robison, B. H.

    2016-02-01

    Food chain length, or the number of trophic steps between primary producers and apex predators within an ecosystem, is a key determinant of ecosystem structure, including overall efficiency, stability, and productivity. Here, we quantitatively estimate food chain length for three pelagic ecosystems characterized by distinct biogeochemical and oceanographic regimes: the Northern California Current (NCC), the North Pacific Subtropical Gyre (NPSG), and the Gulf of California (GoC). From each region, ecologically equivalent organisms were selected from each of four successive trophic steps, including zooplankton (primary consumers), zooplanktivores (secondary consumers), piscivores (tertiary consumers), and higher order predators. Bulk tissue δ15N values of the organisms from all four trophic steps spanned ranges of approximately 9.8‰ (NCC), 1.4‰ (NPSG), and 2.1‰ (GoC). Regional variations in nitrogen biogeochemistry, however, can alter isotopic baselines and food web dynamics, ultimately complicating bulk isotope measurements across regions. Thus, we apply amino acid nitrogen isotope measurements to quantitatively measure and compare food chain length across consumers from the three regions, accounting for biogeochemical disparities in isotopic baseline. Implications for ecosystem production and efficiency are discussed, including the potential for these different ecosystems to withstand environmental change, including shifting oxygen levels and surface productivity.

  8. Density functional theory studies of screw dislocation core structures in bcc metals

    DEFF Research Database (Denmark)

    Frederiksen, Søren Lund; Jacobsen, Karsten Wedel

    2003-01-01

    The core structures of (I 11) screw dislocations in bee metals are studied using density functional theory in the local-density approximation. For Mo and Fe, direct calculations of the core structures show the cores to be symmetric with respect to 180degrees rotations around an axis perpendicular...

  9. Magnetic Core-Shell Morphology of Structurally Uniform Magnetite Nanoparticles

    Science.gov (United States)

    Krycka, Kathryn

    2011-03-01

    Magnetic nanoscale structures are intriguing, in part, because of the exotic properties that emerge compared with bulk. The reduction of magnetic moment per atom in magnetite with decreasing nanoparticle size, for example, has been hypothesized to originate from surface disordering to anisotropy-induced radial canting, which are difficult to distinguish using conventional magnetometry. Small-angle neutron scattering (SANS) is ideal for probing structure, both chemical and magnetic, from nm to microns across an ensemble of particles. Adding polarization analysis (PASANS) of the neutron spin orientation before and after interaction with the scattering particles allows the magnetic structure to be separated into its vector components. Application of this novel technique to 9 nm magnetite nanoparticles closed-packed into face-centered crystallites with order of a micron revealed that at nominal saturation the missing magnetic moments unexpectedly interacted to form well-ordered shells 1.0 to 1.5 nm thick canted perpendicular to their ferrimagnetic cores between 160 to 320 K. These shells additionally displayed intra-particle ``cross-talk'', selecting a common orientation over clusters of tens of nanoparticles. However, the shells disappeared when the external field was removed and interparticle magnetic interactions were negligible (300 K), confirming their magnetic origin. This work has been carried out in collaboration with Ryan Booth, Julie Borchers, Wangchun Chen, Liv Dedon, Thomas Gentile, Charles Hogg, Yumi Ijiri, Mark Laver, Sara Majetich, James Rhyne, and Shannon Watson.

  10. Thermally stable aromatic amine derivative with symmetrically substituted double spirobifluorene core as a hole transport material for green phosphorescent organic light-emitting diodes

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Yong Joo; Lee, Jun Yeob, E-mail: leej17@dankook.ac.kr

    2012-11-01

    A thermally stable aromatic amine derivative with a symmetrically substituted double spirobifluorene core was synthesized as a hole transport material for green phosphorescent organic light-emitting diodes. A high glass transition temperature of 142 Degree-Sign C was obtained and a film morphology of the hole transport material was kept stable up to 120 Degree-Sign C. The hole transport material showed a high triplet energy of 2.53 eV and a quantum efficiency of 17.4% in green phosphorescent organic light-emitting diodes. - Highlights: Black-Right-Pointing-Pointer Synthesis of symmetrically substituted double spirobifluorene core Black-Right-Pointing-Pointer Stable film morphology up to 120 Degree-Sign C Black-Right-Pointing-Pointer High quantum efficiency in green phosphorescent organic light emitting diode.

  11. Thermal interaction of core melt debris with the TMI-2 baffle, core-former, and lower head structures

    International Nuclear Information System (INIS)

    Cronenberg, A.W.; Tolman, E.L.

    1987-09-01

    Recent inspection of the TMI-2 core-former baffle walls (vertical), former plates (horizontal), and lower plenum has been conducted to assess potential damage to these structures. Video observations show evidence of localized melt failure of the baffle walls, whereas fiberoptics data indicate the presence of resolidified debris on the former plates. Lower plenum inspection also confirms the presence of 20 tons or more of core debris in the lower plenum. These data indicate massive core melt relocation and the potential for melt attack on vessel structural components. This report presents analyses aimed at developing an understanding of melt relocation behavior and damage progression to TMI-2 vessel components. Thermal analysis indicates melt-through of the baffle plates, but maintenance of structural integrity of the former plates and lower head. Differences in the damage of these structures is attributed largely to differences in contact time with melt debris and pressure of water. 29 refs., 17 figs., 9 tabs

  12. High thermal stability of core-shell structures dominated by negative interface energy.

    Science.gov (United States)

    Zhu, Yong-Fu; Zhao, Ning; Jin, Bo; Zhao, Ming; Jiang, Qing

    2017-03-29

    Nanoscale core/shell structures are of interest in catalysis due to their superior catalytic properties. Here we investigated the thermal stability of the coherent core-shell structures in a thermodynamic way by considering the impact from the core with the bulk melting point T m (∞) lower or higher than the shell. When a low-T m (∞) core is adopted, core-shell melting induced by the melting depression of the core does not occur upon heating because of the superheating, although the melting depression of the core can be triggered ultimately by the preferential melting of the high-T m (∞) shell for small cores. The superheating of the core is contributed by the negative solid-solid interface energy, while the depression is originated from the positive solid-liquid interface energy. Owing to the presence of the negative interface energy, moreover, the low-T m (∞)-core structure possesses a low difference in thermal expansion between the core and the shell, high activation energy of outward atomic diffusion from the core to shell, and low heat capacity. This result is beneficial for the core-shell structure design for its application in catalysis.

  13. Fabrication of bimodal porous silicate with silicalite-1 core/mesoporous shell structures and synthesis of nonspherical carbon and silica nanocases with hollow core/mesoporous shell structures.

    Science.gov (United States)

    Yu, Jong-Sung; Yoon, Suk Bon; Lee, Yun Jo; Yoon, Kyung Byung

    2005-04-21

    In this work, an attempt has been made to modify the shape and nanostructure of core-shell materials, which have been usually generated on the basis of amorphous spherical cores. Novel core-shell silicate particles, each of which consists of a silicalite-1 zeolite crystal core and mesoporous shell (ZCMS), were synthesized for the first time. The ZCMS core-shell particles are unique because they are of pseudohexagonal prismatic shape and have hierarchical porosity of both a uniform microporous core and a mesoporous shell coexisting in a particle framework. The nonspherical bimodal porous core-shell particles were then utilized as templates to fabricate a new carbon replica structure. Interestingly, the pore replication process was carried out only through the mesopores in the shell, and not through the micropores due to the narrower micropore size in the core, resulting in nonspherical carbon nanocases with a hollow core and mesoporous shell (HCMS) structure. Nonspherical silica nanocases with HCMS structure were also generated by replication using the carbon nanocases as templates, which are not possible to synthesize through other synthetic methods. Interestingly, the pseudohexagonal prismatic shape of the zeolite crystals was transferred onto the carbon and silica nanocases.

  14. Temperature structure in the Perseus cluster core observed with Hitomi

    Science.gov (United States)

    Hitomi Collaboration; Aharonian, Felix; Akamatsu, Hiroki; Akimoto, Fumie; Allen, Steven W.; Angelini, Lorella; Audard, Marc; Awaki, Hisamitsu; Axelsson, Magnus; Bamba, Aya; Bautz, Marshall W.; Blandford, Roger; Brenneman, Laura W.; Brown, Gregory V.; Bulbul, Esra; Cackett, Edward M.; Chernyakova, Maria; Chiao, Meng P.; Coppi, Paolo S.; Costantini, Elisa; de Plaa, Jelle; de Vries, Cor P.; den Herder, Jan-Willem; Done, Chris; Dotani, Tadayasu; Ebisawa, Ken; Eckart, Megan E.; Enoto, Teruaki; Ezoe, Yuichiro; Fabian, Andrew C.; Ferrigno, Carlo; Foster, Adam R.; Fujimoto, Ryuichi; Fukazawa, Yasushi; Furukawa, Maki; Furuzawa, Akihiro; Galeazzi, Massimiliano; Gallo, Luigi C.; Gandhi, Poshak; Giustini, Margherita; Goldwurm, Andrea; Gu, Liyi; Guainazzi, Matteo; Haba, Yoshito; Hagino, Kouichi; Hamaguchi, Kenji; Harrus, Ilana M.; Hatsukade, Isamu; Hayashi, Katsuhiro; Hayashi, Takayuki; Hayashida, Kiyoshi; Hiraga, Junko S.; Hornschemeier, Ann; Hoshino, Akio; Hughes, John P.; Ichinohe, Yuto; Iizuka, Ryo; Inoue, Hajime; Inoue, Yoshiyuki; Ishida, Manabu; Ishikawa, Kumi; Ishisaki, Yoshitaka; Iwai, Masachika; Kaastra, Jelle; Kallman, Tim; Kamae, Tsuneyoshi; Kataoka, Jun; Kato, Yuichi; Katsuda, Satoru; Kawai, Nobuyuki; Kelley, Richard L.; Kilbourne, Caroline A.; Kitaguchi, Takao; Kitamoto, Shunji; Kitayama, Tetsu; Kohmura, Takayoshi; Kokubun, Motohide; Koyama, Katsuji; Koyama, Shu; Kretschmar, Peter; Krimm, Hans A.; Kubota, Aya; Kunieda, Hideyo; Laurent, Philippe; Lee, Shiu-Hang; Leutenegger, Maurice A.; Limousin, Olivier; Loewenstein, Michael; Long, Knox S.; Lumb, David; Madejski, Greg; Maeda, Yoshitomo; Maier, Daniel; Makishima, Kazuo; Markevitch, Maxim; Matsumoto, Hironori; Matsushita, Kyoko; McCammon, Dan; McNamara, Brian R.; Mehdipour, Missagh; Miller, Eric D.; Miller, Jon M.; Mineshige, Shin; Mitsuda, Kazuhisa; Mitsuishi, Ikuyuki; Miyazawa, Takuya; Mizuno, Tsunefumi; Mori, Hideyuki; Mori, Koji; Mukai, Koji; Murakami, Hiroshi; Mushotzky, Richard F.; Nakagawa, Takao; Nakajima, Hiroshi; Nakamori, Takeshi; Nakashima, Shinya; Nakazawa, Kazuhiro; Nobukawa, Kumiko K.; Nobukawa, Masayoshi; Noda, Hirofumi; Odaka, Hirokazu; Ohashi, Takaya; Ohno, Masanori; Okajima, Takashi; Ota, Naomi; Ozaki, Masanobu; Paerels, Frits; Paltani, Stéphane; Petre, Robert; Pinto, Ciro; Porter, Frederick S.; Pottschmidt, Katja; Reynolds, Christopher S.; Safi-Harb, Samar; Saito, Shinya; Sakai, Kazuhiro; Sasaki, Toru; Sato, Goro; Sato, Kosuke; Sato, Rie; Sawada, Makoto; Schartel, Norbert; Serlemtsos, Peter J.; Seta, Hiromi; Shidatsu, Megumi; Simionescu, Aurora; Smith, Randall K.; Soong, Yang; Stawarz, Łukasz; Sugawara, Yasuharu; Sugita, Satoshi; Szymkowiak, Andrew; Tajima, Hiroyasu; Takahashi, Hiromitsu; Takahashi, Tadayuki; Takeda, Shiníchiro; Takei, Yoh; Tamagawa, Toru; Tamura, Takayuki; Tanaka, Takaaki; Tanaka, Yasuo; Tanaka, Yasuyuki T.; Tashiro, Makoto S.; Tawara, Yuzuru; Terada, Yukikatsu; Terashima, Yuichi; Tombesi, Francesco; Tomida, Hiroshi; Tsuboi, Yohko; Tsujimoto, Masahiro; Tsunemi, Hiroshi; Tsuru, Takeshi Go; Uchida, Hiroyuki; Uchiyama, Hideki; Uchiyama, Yasunobu; Ueda, Shutaro; Ueda, Yoshihiro; Uno, Shiníchiro; Urry, C. Megan; Ursino, Eugenio; Watanabe, Shin; Werner, Norbert; Wilkins, Dan R.; Williams, Brian J.; Yamada, Shinya; Yamaguchi, Hiroya; Yamaoka, Kazutaka; Yamasaki, Noriko Y.; Yamauchi, Makoto; Yamauchi, Shigeo; Yaqoob, Tahir; Yatsu, Yoichi; Yonetoku, Daisuke; Zhuravleva, Irina; Zoghbi, Abderahmen

    2018-03-01

    The present paper explains the temperature structure of X-ray emitting plasma in the core of the Perseus cluster based on 1.8-20.0 keV data obtained with the Soft X-ray Spectrometer (SXS) on board the Hitomi Observatory. A series of four observations was carried out, with a total effective exposure time of 338 ks that covered a central region of ˜7΄ in diameter. SXS was operated with an energy resolution of ˜5 eV (full width at half maximum) at 5.9 keV. Not only fine structures of K-shell lines in He-like ions, but also transitions from higher principal quantum numbers were clearly resolved from Si through Fe. That enabled us to perform temperature diagnostics using the line ratios of Si, S, Ar, Ca, and Fe, and to provide the first direct measurement of the excitation temperature and ionization temperature in the Perseus cluster. The observed spectrum is roughly reproduced by a single-temperature thermal plasma model in collisional ionization equilibrium, but detailed line-ratio diagnostics reveal slight deviations from this approximation. In particular, the data exhibit an apparent trend of increasing ionization temperature with the atomic mass, as well as small differences between the ionization and excitation temperatures for Fe, the only element for which both temperatures could be measured. The best-fit two-temperature models suggest a combination of 3 and 5 keV gas, which is consistent with the idea that the observed small deviations from a single-temperature approximation are due to the effects of projecting the known radial temperature gradient in the cluster core along the line of sight. A comparison with the Chandra/ACIS and the XMM-Newton/RGS results, on the other hand, suggests that additional lower-temperature components are present in the intracluster medium (ICM), but not detectable with Hitomi/SXS giving its 1.8-20 keV energy band.

  15. Core Oligosaccharide of Plesiomonas shigelloides PCM 2231 (Serotype O17 Lipopolysaccharide — Structural and Serological Analysis

    Directory of Open Access Journals (Sweden)

    Anna Maciejewska

    2013-02-01

    Full Text Available The herein presented complete structure of the core oligosaccharide of lipopolysaccharide (LPS P. shigelloides Polish Collection of Microorganisms (PCM 2231 (serotype O17 was investigated by 1H, 13C NMR spectroscopy, mass spectrometry, chemical analyses and serological methods. The core oligosaccharide is composed of an undecasaccharide, which represents the second core type identified for P. shigelloides serotype O17 LPS. This structure is similar to that of the core oligosaccharide of P. shigelloides strains 302-73 (serotype O1 and 7-63 (serotype O17 and differs from these only by one sugar residue. Serological screening of 55 strains of P. shigelloides with the use of serum against identified core oligosaccharide conjugated with bovine serum albumin (BSA indicated the presence of similar structures in the LPS core region of 28 O-serotypes. This observation suggests that the core oligosaccharide structure present in strain PCM 2231 could be the most common type among P. shigelloides lipopolysaccharides.

  16. CORE

    DEFF Research Database (Denmark)

    Krigslund, Jeppe; Hansen, Jonas; Hundebøll, Martin

    2013-01-01

    State-of-the-art in network coding for wireless, meshed networks typically considers two problems separately. First, the problem of providing reliability for a single session. Second, the problem of opportunistic combination of flows by using minimalistic coding, i.e., by XORing packets from...... different flows. Instead of maintaining these approaches separate, we propose a protocol (CORE) that brings together these coding mechanisms. Our protocol uses random linear network coding (RLNC) for intra- session coding but allows nodes in the network to setup inter- session coding regions where flows...

  17. Generic eukaryotic core promoter prediction using structural features of DNA.

    Science.gov (United States)

    Abeel, Thomas; Saeys, Yvan; Bonnet, Eric; Rouzé, Pierre; Van de Peer, Yves

    2008-02-01

    Despite many recent efforts, in silico identification of promoter regions is still in its infancy. However, the accurate identification and delineation of promoter regions is important for several reasons, such as improving genome annotation and devising experiments to study and understand transcriptional regulation. Current methods to identify the core region of promoters require large amounts of high-quality training data and often behave like black box models that output predictions that are difficult to interpret. Here, we present a novel approach for predicting promoters in whole-genome sequences by using large-scale structural properties of DNA. Our technique requires no training, is applicable to many eukaryotic genomes, and performs extremely well in comparison with the best available promoter prediction programs. Moreover, it is fast, simple in design, and has no size constraints, and the results are easily interpretable. We compared our approach with 14 current state-of-the-art implementations using human gene and transcription start site data and analyzed the ENCODE region in more detail. We also validated our method on 12 additional eukaryotic genomes, including vertebrates, invertebrates, plants, fungi, and protists.

  18. TGP, an extremely stable, non-aggregating fluorescent protein created by structure-guided surface engineering

    OpenAIRE

    Close, Devin W.; Don Paul, Craig; Langan, Patricia S.; Wilce, Matthew C.J.; Traore, Daouda A.K.; Halfmann, Randal; Rocha, Reginaldo C.; Waldo, Geoffery S.; Payne, Riley J.; Rucker, Joseph B.; Prescott, Mark; Bradbury, Andrew R.M.

    2015-01-01

    In this paper we describe the engineering and X-ray crystal structure of Thermal Green Protein (TGP), an extremely stable, highly soluble, non-aggregating green fluorescent protein. TGP is a soluble variant of the fluorescent protein eCGP123, which despite being highly stable, has proven to be aggregation-prone. The X-ray crystal structure of eCGP123, also determined within the context of this paper, was used to carry out rational surface engineering to improve its solubility, leading to TGP....

  19. Structure and Stability of Complex Coacervate Core Micelles with Lysozyme

    NARCIS (Netherlands)

    Lindhoud, Saskia; de Vries, Renko; Norde, Willem; Cohen Stuart, Martinus Abraham

    2007-01-01

    Encapsulation of enzymes by polymers is a promising method to influence their activity and stability. Here, we explore the use of complex coacervate core micelles for encapsulation of enzymes. The core of the micelles consists of negatively charged blocks of the diblock copolymer PAA42PAAm417 and

  20. Structure and stability of complex coacervate core micelles with lysozyme

    NARCIS (Netherlands)

    Lindhoud, S.; Vries, de R.J.; Norde, W.; Cohen Stuart, M.A.

    2007-01-01

    Encapsulation of enzymes by polymers is a promising method to influence their activity and stability. Here, we explore the use of complex coacervate core micelles for encapsulation of enzymes. The core of the micelles consists of negatively charged blocks of the diblock copolymer PAA42PAAm417 and

  1. Structure and stability of complex coacervate core micelles with lysozyme

    NARCIS (Netherlands)

    Lindhoud, Saskia; de Vries, Renko; Norde, Willem; Cohen Stuart, Martien A.

    Encapsulation of enzymes by polymers is a promising method to influence their activity and stability. Here, we explore the use of complex coacervate core micelles for encapsulation of enzymes. The core of the micelles consists of negatively charged blocks of the diblock copolymer PAA(42)PAAm(417)

  2. Structure of stable degeneration of K3 surfaces into pairs of rational elliptic surfaces

    Science.gov (United States)

    Kimura, Yusuke

    2018-03-01

    F-theory/heterotic duality is formulated in the stable degeneration limit of a K3 fibration on the F-theory side. In this note, we analyze the structure of the stable degeneration limit. We discuss whether stable degeneration exists for pairs of rational elliptic surfaces. We demonstrate that, when two rational elliptic surfaces have an identical complex structure, stable degeneration always exists. We provide an equation that systematically describes the stable degeneration of a K3 surface into a pair of isomorphic rational elliptic surfaces. When two rational elliptic surfaces have different complex structures, whether their sum glued along a smooth fiber admits deformation to a K3 surface can be determined by studying the structure of the K3 lattice. We investigate the lattice theoretic condition to determine whether a deformation to a K3 surface exists for pairs of extremal rational elliptic surfaces. In addition, we discuss the configurations of singular fibers under stable degeneration. The sum of two isomorphic rational elliptic surfaces glued together admits a deformation to a K3 surface, the singular fibers of which are twice that of the rational elliptic surface. For special situations, singular fibers of the resulting K3 surface collide and they are enhanced to a fiber of another type. Some K3 surfaces become attractive in these situations. We determine the complex structures and the Weierstrass forms of these attractive K3 surfaces. We also deduce the gauge groups in F-theory compactifications on these attractive K3 surfaces times a K3. E 6, E 7, E 8, SU(5), and SO(10) gauge groups arise in these compactifications.

  3. Novel stable structure of Li3PS4 predicted by evolutionary algorithm under high-pressure

    Directory of Open Access Journals (Sweden)

    S. Iikubo

    2018-01-01

    Full Text Available By combining theoretical predictions and in-situ X-ray diffraction under high pressure, we found a novel stable crystal structure of Li3PS4 under high pressures. At ambient pressure, Li3PS4 shows successive structural transitions from γ-type to β-type and from β-type to α type with increasing temperature, as is well established. In this study, an evolutionary algorithm successfully predicted the γ-type crystal structure at ambient pressure and further predicted a possible stable δ-type crystal structures under high pressure. The stability of the obtained structures is examined in terms of both static and dynamic stability by first-principles calculations. In situ X-ray diffraction using a synchrotron radiation revealed that the high-pressure phase is the predicted δ-Li3PS4 phase.

  4. Synergetic effect of organic cores and inorganic shells for core/shell structured composite abrasives for chemical mechanical planarization

    Science.gov (United States)

    Chen, Yang; Li, Zhina; Miao, Naiming

    2014-09-01

    Core/shell structured organic/inorganic composite microspheres has an important potential application in efficient and damage-free chemical mechanical planarization/polishing (CMP) as a kind of novel abrasive due to its uniform non-rigid mechanical property. However, the synergistic effect of material removal between organic cores and inorganic shells of composite abrasives is ambiguous. In this work, oxide-CMP performances of various slurries, containing polystyrene (PS) spheres, solid abrasives (SiO2 or CeO2), mixed abrasives ((PS + SiO2) or (PS + CeO2)), core/shell composites (PS/SiO2 or PS/CeO2), were investigated by atomic force microscopy. Experiment results indicated that the surfaces polished by composite abrasives exhibited lower surface roughness, fewer scratches as well as lower topographical variations than those by other type of abrasives. The core/shell structure of composite abrasives plays an important role in improving CMP behavior. Moreover, the organic cores are mainly beneficial to decrease surface roughness and mechanical damages, and the inorganic shells are in favor of improving material removal rate.

  5. A 12-Point Circumplex Structure of Core Affect.

    Science.gov (United States)

    Yik, Michelle; Russell, James A; Steiger, James H

    2011-08-01

    Core Affect is a state accessible to consciousness as a single simple feeling (feeling good or bad, energized or enervated) that can vary from moment to moment and that is the heart of, but not the whole of, mood and emotion. In four correlational studies (Ns = 535, 190, 234, 395), a 12-Point Affect Circumplex (12-PAC) model of Core Affect was developed that is finer grained than previously available and that integrates major dimensional models of mood and emotion. Self-report scales in three response formats were cross-validated for Core Affect felt during current and remembered moments. A technique that places any external variable into the 12-PAC showed that 29 of 38 personality scales and 30 of 30 mood scales are significantly related to Core Affect, but not in a way that revealed its basic dimensions. 2011 APA, all rights reserved

  6. Stable preparations of tyrosine hydroxylase provide the solution structure of the full-length enzyme

    Science.gov (United States)

    Bezem, Maria T.; Baumann, Anne; Skjærven, Lars; Meyer, Romain; Kursula, Petri; Martinez, Aurora; Flydal, Marte I.

    2016-01-01

    Tyrosine hydroxylase (TH) catalyzes the rate-limiting step in the biosynthesis of catecholamine neurotransmitters. TH is a highly complex enzyme at mechanistic, structural, and regulatory levels, and the preparation of kinetically and conformationally stable enzyme for structural characterization has been challenging. Here, we report on improved protocols for purification of recombinant human TH isoform 1 (TH1), which provide large amounts of pure, stable, active TH1 with an intact N-terminus. TH1 purified through fusion with a His-tagged maltose-binding protein on amylose resin was representative of the iron-bound functional enzyme, showing high activity and stabilization by the natural feedback inhibitor dopamine. TH1 purified through fusion with a His-tagged ZZ domain on TALON is remarkably stable, as it was partially inhibited by resin-derived cobalt. This more stable enzyme preparation provided high-quality small-angle X-ray scattering (SAXS) data and reliable structural models of full-length tetrameric TH1. The SAXS-derived model reveals an elongated conformation (Dmax = 20 nm) for TH1, different arrangement of the catalytic domains compared with the crystal structure of truncated forms, and an N-terminal region with an unstructured tail that hosts the phosphorylation sites and a separated Ala-rich helical motif that may have a role in regulation of TH by interacting with binding partners. PMID:27462005

  7. Physical mechanism of surface roughening of the radial Ge-core/Si-shell nanowire heterostructure and thermodynamic prediction of surface stability of the InAs-core/GaAs-shell nanowire structure.

    Science.gov (United States)

    Cao, Y Y; Ouyang, G; Wang, C X; Yang, G W

    2013-02-13

    As a promising and typical semiconductor heterostructure at the nanoscale, the radial Ge/Si NW heterostructure, that is, the Ge-core/Si-shell NW structure, has been widely investigated and used in various nanodevices such as solar cells, lasers, and sensors because of the strong changes in the band structure and increased charge carrier mobility. Therefore, to attain high quality radial semiconductor NW heterostructures, controllable and stable epitaxial growth of core-shell NW structures has become a major challenge for both experimental and theoretical evaluation. Surface roughening is usually undesirable for the epitaxial growth of high quality radial semiconductor NW heterostructures, because it would destroy the core-shell NW structures. For example, the surface of the Ge-core/Si-shell NWs always exhibits a periodic modulation with island-like morphologies, that is, surface roughening, during epitaxial growth. Therefore, the physical understanding of the surface roughening behavior during the epitaxial growth of core-shell NW structures is essential and urgent for theoretical design and experimentally controlling the growth of high quality radial semiconductor NW heterostructures. Here, we proposed a quantitative thermodynamic theory to address the physical process of epitaxial growth of core-shell NW structures and surface roughening. We showed that the transformation from the Frank-van der Merwe mode to the Stranski-Krastanow mode during the epitaxial growth of radial semiconductor NW heterostructures is the physical origin of surface roughening. We deduced the thermodynamic criterion for the formation of the surface roughening and the phase diagram of growth and showed that the radius of the NWs and the thickness of the shell layer can not only determine the formation of the surface roughening in a core-shell NW structure, but also control the periodicity and amplitude of the surface roughness. The agreement between the theoretical results and the

  8. The formation of a core periphery structure in heterogeneous financial networks

    NARCIS (Netherlands)

    in 't Veld, D.; van der Leij, M.; Hommes, C.

    2014-01-01

    Recent empirical evidence suggests that financial networks exhibit a core periphery network structure. This paper aims at giving an economic explanation for the emergence of such a structure using network formation theory. Focusing on intermediation benefits, we find that a core periphery network

  9. The formation of a core periphery structure in heterogeneous financial networks

    NARCIS (Netherlands)

    in 't Veld, D.; van der Leij, M.; Hommes, C.

    2014-01-01

    Recent empirical evidence suggests that nancial networks exhibit a core periphery network structure. This paper aims at giving an economic explanation for the emergence of such a structure using network formation theory. Focusing on intermediation benets, we find that a core periphery network cannot

  10. Engineering review of the core support structure of the Gas Cooled Fast Breeder Reactor

    International Nuclear Information System (INIS)

    1978-09-01

    The review of the core support structure of the gas cooled fast breeder reactor (GCFR) covered such areas as the design criteria, the design and analysis of the concepts, the development plan, and the projected manufacturing costs. Recommendations are provided to establish a basis for future work on the GCFR core support structure

  11. Engineering review of the core support structure of the Gas Cooled Fast Breeder Reactor

    Energy Technology Data Exchange (ETDEWEB)

    None

    1978-09-01

    The review of the core support structure of the gas cooled fast breeder reactor (GCFR) covered such areas as the design criteria, the design and analysis of the concepts, the development plan, and the projected manufacturing costs. Recommendations are provided to establish a basis for future work on the GCFR core support structure.

  12. Assessment of local and regional climate signals in water stable isotopes and chemistry records from new high resolution shallow ice cores in Adélie Land, Antarctica

    Science.gov (United States)

    Goursaud, Sentia; Masson Delmotte, Valerie; Preunkert, Susanne; Legrand, Michel; Werner, Martin

    2017-04-01

    Documenting climatic variations in Antarctica is important to characterize natural climate variability and to provide a long-term context for recent changes. For this purpose, ice cores are unique archives providing a variety of proxy records. While water stable isotopes are commonly used to reconstruct past temperatures, their variability may also reflect changes in moisture origin and evaporation conditions. Further information on the origin of air masses can be obtained from aerosols, through the chemical analyses of ice cores. In high accumulation regions, such as the coastal Adélie Land area, the combination of water stable isotope and chemical records is crucial to date ice cores by annual layer counting and assess the associated uncertainty on annual accumulation rates, but may also help to unveil past changes in regional atmospheric circulation. In order to document accumulation in the area from Dumont d'Urville station to the central Antarctic plateau, towards Dome C, the Agence Nationale de la Recherche ASUMA project (Improving the Accuracy of the Surface Mass Balance of Antarctica, 2014-2018) initiated new field campaigns and was successful in obtaining a network of new shallow ice cores in a previously undocumented region. Here, we will present new results from two shallow ice cores drilled in Adélie Land, the S1C1 ice core (67.71 °S, 139.83 °E ,279 m a.s.l.) drilled in January 2007 and the TA192A ice core (66.78 °S, 139.56 °E, 602 m a.s.l.). We have dated the ice cores by combining multi-parameter annual layer counting using major ions and δ18O, as well as reference horizons. This allowed us to estimate very contrasted accumulation rates (respectively 21.8 ± 6.9 cm w.e. y-1 and 73.38±21.9 cm w.e. y-1), averaged respectively over the period from 1946 to 2006 and from 1998 to 2014 . As a result, we have reconstructed annual accumulation rates, isotopic and ion time series, and investigated their characteristics (mean values, trends and

  13. Effect of varying geometrical parameters of trapezoidal corrugated-core sandwich structure

    Directory of Open Access Journals (Sweden)

    Zaid N.Z.M.

    2017-01-01

    Full Text Available Sandwich structure is an attractive alternative that increasingly used in the transportation and aerospace industry. Corrugated-core with trapezoidal shape allows enhancing the damage resistance to the sandwich structure, but on the other hand, it changes the structural response of the sandwich structure. The aim of this paper is to study the effect of varying geometrical parameters of trapezoidal corrugated-core sandwich structure under compression loading. The corrugated-core specimen was fabricated using press technique, following the shape of trapezoidal shape. Two different materials were used in the study, glass fibre reinforced plastic (GFRP and carbon fibre reinforced plastic (CFRP. The result shows that the mechanical properties of the core in compression loading are sensitive to the variation of a number of unit cells and the core thickness.

  14. Embodied memory: effective and stable perception by combining optic flow and image structure.

    Science.gov (United States)

    Pan, Jing Samantha; Bingham, Ned; Bingham, Geoffrey P

    2013-12-01

    Visual perception studies typically focus either on optic flow structure or image structure, but not on the combination and interaction of these two sources of information. Each offers unique strengths in contrast to the other's weaknesses. Optic flow yields intrinsically powerful information about 3D structure, but is ephemeral. It ceases when motion stops. Image structure is less powerful in specifying 3D structure, but is stable. It remains when motion stops. Optic flow and image structure are intrinsically related in vision because the optic flow carries one image to the next. This relation is especially important in the context of progressive occlusion, in which optic flow provides information about the location of targets hidden in subsequent image structure. In four experiments, we investigated the role of image structure in "embodied memory" in contrast to memory that is only in the head. We found that either optic flow (Experiment 1) or image structure (Experiment 2) alone were relatively ineffective, whereas the combination was effective and, in contrast to conditions requiring reliance on memory-in-the-head, much more stable over extended time (Experiments 2 through 4). Limits well documented for visual short memory (that is, memory-in-the-head) were strongly exceeded by embodied memory. The findings support J. J. Gibson's (1979/1986, The Ecological Approach to Visual Perception, Boston, MA, Houghton Mifflin) insights about progressive occlusion and the embodied nature of perception and memory.

  15. Prediction of Stable Ruthenium Silicides from First-Principles Calculations: Stoichiometries, Crystal Structures, and Physical Properties.

    Science.gov (United States)

    Zhang, Chuanzhao; Kuang, Xiaoyu; Jin, Yuanyuan; Lu, Cheng; Zhou, Dawei; Li, Peifang; Bao, Gang; Hermann, Andreas

    2015-12-09

    We present results of an unbiased structure search for stable ruthenium silicide compounds with various stoichiometries, using a recently developed technique that combines particle swarm optimization algorithms with first-principles calculations. Two experimentally observed structures of ruthenium silicides, RuSi (space group P2(1)3) and Ru2Si3 (space group Pbcn), are successfully reproduced under ambient pressure conditions. In addition, a stable RuSi2 compound with β-FeSi2 structure type (space group Cmca) was found. The calculations of the formation enthalpy, elastic constants, and phonon dispersions demonstrate the Cmca-RuSi2 compound is energetically, mechanically, and dynamically stable. The analysis of electronic band structures and densities of state reveals that the Cmca-RuSi2 phase is a semiconductor with a direct band gap of 0.480 eV and is stabilized by strong covalent bonding between Ru and neighboring Si atoms. On the basis of the Mulliken overlap population analysis, the Vickers hardness of the Cmca structure RuSi2 is estimated to be 28.0 GPa, indicating its ultra-incompressible nature.

  16. Dark matter halos with cores from hierarchical structure formation

    International Nuclear Information System (INIS)

    Strigari, Louis E.; Kaplinghat, Manoj; Bullock, James S.

    2007-01-01

    We show that dark matter emerging from late decays (z or approx. 0.1 Mpc), and simultaneously generates observable constant-density cores in small dark matter halos. We refer to this class of models as meta-cold dark matter (mCDM), because it is born with nonrelativistic velocities from the decays of cold thermal relics. The constant-density cores are a result of the low phase-space density of mCDM at birth. Warm dark matter cannot produce similar size phase-space limited cores without saturating the Lyα power spectrum bounds. Dark matter-dominated galaxy rotation curves and stellar velocity dispersion profiles may provide the best means to discriminate between mCDM and CDM. mCDM candidates are motivated by the particle spectrum of supersymmetric and extra dimensional extensions to the standard model of particle physics

  17. Stable isotope applications in biomolecular structure and mechanisms. A meeting to bring together producers and users of stable-isotope-labeled compounds to assess current and future needs

    Energy Technology Data Exchange (ETDEWEB)

    Trewhella, J.; Cross, T.A.; Unkefer, C.J. [eds.

    1994-12-01

    Knowledge of biomolecular structure is a prerequisite for understanding biomolecular function, and stable isotopes play an increasingly important role in structure determination of biological molecules. The first Conference on Stable Isotope Applications in Biomolecular Structure and Mechanisms was held in Santa Fe, New Mexico, March 27--31, 1994. More than 120 participants from 8 countries and 44 institutions reviewed significant developments, discussed the most promising applications for stable isotopes, and addressed future needs and challenges. Participants focused on applications of stable isotopes for studies of the structure and function of proteins, peptides, RNA, and DNA. Recent advances in NMR techniques neutron scattering, EPR, and vibrational spectroscopy were highlighted in addition to the production and synthesis of labeled compounds. This volume includes invited speaker and poster presentations as well as a set of reports from discussion panels that focused on the needs of the scientific community and the potential roles of private industry, the National Stable Isotope Resource, and the National High Magnetic Field Laboratory in serving those needs. This is the leading abstract. Individual papers are processed separately for the database.

  18. Stable isotope applications in biomolecular structure and mechanisms. A meeting to bring together producers and users of stable-isotope-labeled compounds to assess current and future needs

    International Nuclear Information System (INIS)

    Trewhella, J.; Cross, T.A.; Unkefer, C.J.

    1994-12-01

    Knowledge of biomolecular structure is a prerequisite for understanding biomolecular function, and stable isotopes play an increasingly important role in structure determination of biological molecules. The first Conference on Stable Isotope Applications in Biomolecular Structure and Mechanisms was held in Santa Fe, New Mexico, March 27--31, 1994. More than 120 participants from 8 countries and 44 institutions reviewed significant developments, discussed the most promising applications for stable isotopes, and addressed future needs and challenges. Participants focused on applications of stable isotopes for studies of the structure and function of proteins, peptides, RNA, and DNA. Recent advances in NMR techniques neutron scattering, EPR, and vibrational spectroscopy were highlighted in addition to the production and synthesis of labeled compounds. This volume includes invited speaker and poster presentations as well as a set of reports from discussion panels that focused on the needs of the scientific community and the potential roles of private industry, the National Stable Isotope Resource, and the National High Magnetic Field Laboratory in serving those needs. This is the leading abstract. Individual papers are processed separately for the database

  19. Density functional theory studies of screw dislocation core structures in bcc metals

    DEFF Research Database (Denmark)

    Frederiksen, Søren Lund; Jacobsen, Karsten Wedel

    2003-01-01

    The core structures of (I 11) screw dislocations in bee metals are studied using density functional theory in the local-density approximation. For Mo and Fe, direct calculations of the core structures show the cores to be symmetric with respect to 180degrees rotations around an axis perpendicular...... to the dislocation line. The magnetic moment in the Fe core is shown to be reduced relative to the bulk value. Calculations of gamma surfaces and the elastic constants B, C' and c(44) are reported for Fe and all group VB and VIB metals. Using a criterion suggested by Vitek and Duesbery the calculations point...

  20. Dipolar Quinoidal Acene Analogues as Stable Isoelectronic Structures of Pentacene and Nonacene

    KAUST Repository

    Shi, Xueliang

    2015-10-08

    Quinoidal thia-acene analogues, as the respective isoelectronic structures of pentacene and nonacene, were synthesized and an unusual 1,2-sulfur migration was observed during the Friedel-Crafts alkylation reaction. The analogues display a closed-shell quinoidal structure in the ground state with a distinctive dipolar character. In contrast to their acene isoelectronic structures, both compounds are stable because of the existence of more aromatic sextet rings, a dipolar character, and kinetic blocking. They exhibit unique packing in single crystals resulting from balanced dipole-dipole and [C-H⋯π]/[C-H⋯S] interactions.

  1. Spatial differentiation and core-periphery structures in Romania

    Directory of Open Access Journals (Sweden)

    Jozsef BENEDEK

    2015-06-01

    Full Text Available Our paper focuses on the spatial differentiation of economic development in Romania. We use spatial econometric methods (spatial autocorrelation in order to determine the differentiation of the country in core regions and peripheries. The analysis is carried out on the regional spatial scale (NUTS 3 units or counties and covers the period 2000-2011. The main results show a pronounced spatial polarization and spatial autocorrelation of economic development (proxied by GDP per capita in Romania in some core regions (the capital Bucharest, while an extended periphery, comprising the eastern part of Transylvania, Moldova and northern Muntenia is lagging behind. The analysis of the multidimensional development (Human Development Index has revealed the existence of some regional polarizing centres (Iași, Constanța, while the spatial configuration of cores and peripheries shows a different picture: beside the capital region, there is a second core area in the central part of Transylvania, while the eastern periphery is centred on the county Brăila.

  2. Stable structures of Al510–800 clusters and lowest energy sequence of truncated octahedral Al clusters up to 10,000 atoms

    International Nuclear Information System (INIS)

    Wu, Xia; He, Chengdong

    2012-01-01

    Highlights: ► The stable structures of Al 510–800 clusters are obtained with the NP-B potential. ► Al 510–800 clusters adopt truncated octahedral (TO) growth pattern based on complete TOs at Al 405 , Al 586 , and Al 711 . ► The lowest energy sequence of complete TOs up to the size 10,000 is proposed. -- Abstract: The stable structures of Al 510–800 clusters are obtained using dynamic lattice searching with constructed cores (DLSc) method by the NP-B potential. According to the structural growth rule, octahedra and truncated octahedra (TO) configurations are adopted as the inner cores in DLSc method. The results show that in the optimized structures two complete TO structures are found at Al 586 and Al 711 . Furthermore, Al 510–800 clusters adopt TO growth pattern on complete TOs at Al 405 , Al 586 , and Al 711 , and the configurations of the surface atoms are investigated. On the other hand, Al clusters with complete TO motifs are studied up to the size 10,000 by the geometrical construction method. The structural characteristics of complete TOs are denoted by the term “family”, and the growth sequence of Al clusters is investigated. The lowest energy sequence of complete TOs is proposed.

  3. The equivalent thermal conductivity of lattice core sandwich structure: A predictive model

    International Nuclear Information System (INIS)

    Cheng, Xiangmeng; Wei, Kai; He, Rujie; Pei, Yongmao; Fang, Daining

    2016-01-01

    Highlights: • A predictive model of the equivalent thermal conductivity was established. • Both the heat conduction and radiation were considered. • The predictive results were in good agreement with experiment and FEM. • Some methods for improving the thermal protection performance were proposed. - Abstract: The equivalent thermal conductivity of lattice core sandwich structure was predicted using a novel model. The predictive results were in good agreement with experimental and Finite Element Method results. The thermal conductivity of the lattice core sandwich structure was attributed to both core conduction and radiation. The core conduction caused thermal conductivity only relied on the relative density of the structure. And the radiation caused thermal conductivity increased linearly with the thickness of the core. It was found that the equivalent thermal conductivity of the lattice core sandwich structure showed a highly dependent relationship on temperature. At low temperatures, the structure exhibited a nearly thermal insulated behavior. With the temperature increasing, the thermal conductivity of the structure increased owing to radiation. Therefore, some attempts, such as reducing the emissivity of the core or designing multilayered structure, are believe to be of benefit for improving the thermal protection performance of the structure at high temperatures.

  4. Analysis of Completely Prevaporized Spray Flames with Water/Octane Core/Shell Structured Droplets

    Directory of Open Access Journals (Sweden)

    Chung-Yao Hsuan

    2015-01-01

    Full Text Available A series of studies on laminar flame propagation in off-stoichiometric dilute sprays of monodispersed inert or fuel drops had been investigated by large activation energy asymptotics. The present study extends previous theoretical model to consider water/octane core/shell structured drops instead of single-phase drops. The core/shell structured drops are composed of core fluid (water encased by a layer of shell fluid (n-octane. In this study, we only deal with the case that core/shell structured drops are vaporized completely just at flame location. Namely, the discussions of this paper are restricted to the completely prevaporized mode. By varying parameters of core water radius, core-to-shell ratio, the amount of liquid loading, and the stoichiometric ratio (lean or rich burning, we examine the gasification of core water and shell fuel of core/shell structured drops upstream of the bulk flame and its relation to the internal heat transfer. The effects of drop radius, core-to-shell ratio, liquid loading, and overall heat loss or gain on flame propagation flux are reported and discussed.

  5. Stable algorithm for the computation of the electromagnetic field distribution of eigenmodes of periodic diffraction structures.

    Science.gov (United States)

    Bezus, Evgeni A; Doskolovich, Leonid L

    2012-11-01

    In the present work, a stable algorithm for the calculation of the electromagnetic field distributions of the eigenmodes of one-dimensional diffraction gratings is presented. The proposed approach is based on the method for the computation of the propagation constants of Bloch waves of such structures previously presented by Cao et al.[J. Opt. Soc. Am. A 19, 335 (2002)] and uses a modified S-matrix algorithm to ensure numerical stability.

  6. Reactor Structure Materials: Corrosion of Reactor Core Internals

    International Nuclear Information System (INIS)

    Van Dyck, S.

    2000-01-01

    The objectives of SCK-CEN's R and D programme on the corrosion of reactor core internals are: (1) to gain mechanistic insight into the Irradition Assisted Stress Corrosion Cracking (IASCC) phenomenon by studying the influence of separate parameters in well controlled experiments; (2) to develop and validate a predictive capability on IASCC by model description and (3) to define and validate countermeasures and monitoring techniques for application in reactors. Progress and achievements in 1999 are described

  7. Nonlinear Light Dynamics in Multi-Core Structures

    Science.gov (United States)

    2017-02-27

    14. ABSTRACT The project has led to a number of results, including introduction of the key mathematical models governing optical field propagation in...be generated in continuous-discrete optical media such as multi-core optical fiber or waveguide arrays; localisation dynamics in a continuous...coherent combining and compression of pulses injected into the considered MCFs. 15. SUBJECT TERMS fibre lasers, coherent beam combining, discrete

  8. Editorial Core-Shell Nano structures: Modeling, Fabrication, Properties, and Applications

    International Nuclear Information System (INIS)

    Qi, W.; Luo, L.; Qian, H.; Ouyang, G.; Nanda, K.K.; Obare, S.O.

    2012-01-01

    Core-shell nano structures, a family of nano materials, have attracted increasing research interest due to their unique structural features that consist of an inner core and an external shell of different chemical compositions. These structural features allow the possibility of combining distinctive properties of varied materials. Comparatively, core-shell nano structures have exhibited improved physical and chemical properties relative to their single-component counterparts. The inherent emergent chemical and physical properties of core-shell nano structures are of great importance to a potentially broader range of applications including electronics, magnetism, optics, and catalysis. So far a large number of core-shell nano structures have been successfully fabricated using approaches ranging from laser ablation and high-temperature evaporation to carbothermal reduction and hydrothermal methods. Structural characterization of these nano structures and determination of their unique properties for various applications have been well documented. This special issue is devoted to describing a number of unique properties and applications of core-shell nano structures by introducing a few research papers in this field.

  9. Muon-Substituted Malonaldehyde: Transforming a Transition State into a Stable Structure by Isotope Substitution.

    Science.gov (United States)

    Goli, Mohammad; Shahbazian, Shant

    2016-02-12

    Isotope substitutions are usually conceived to play a marginal role on the structure and bonding pattern of molecules. However, a recent study [Angew. Chem. Int. Ed. 2014, 53, 13706-13709; Angew. Chem. 2014, 126, 13925-13929] further demonstrates that upon replacing a proton with a positively charged muon, as the lightest radioisotope of hydrogen, radical changes in the nature of the structure and bonding of certain species may take place. The present report is a primary attempt to introduce another example of structural transformation on the basis of the malonaldehyde system. Accordingly, upon replacing the proton between the two oxygen atoms of malonaldehyde with the positively charged muon a serious structural transformation is observed. By using the ab initio nuclear-electronic orbital non-Born-Oppenheimer procedure, the nuclear configuration of the muon-substituted species is derived. The resulting nuclear configuration is much more similar to the transition state of the proton transfer in malonaldehyde rather than to the stable configuration of malonaldehyde. The comparison of the "atoms in molecules" (AIM) structure of the muon-substituted malonaldehyde and the AIM structure of the stable and the transition-state configurations of malonaldehyde also unequivocally demonstrates substantial similarities of the muon-substituted malonaldehyde to the transition state. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. Further HTGR core support structure reliability studies. Interim report No. 1

    International Nuclear Information System (INIS)

    Platus, D.L.

    1976-01-01

    Results of a continuing effort to investigate high temperature gas cooled reactor (HTGR) core support structure reliability are described. Graphite material and core support structure component physical, mechanical and strength properties required for the reliability analysis are identified. Also described are experimental and associated analytical techniques for determining the required properties, a procedure for determining number of tests required, properties that might be monitored by special surveillance of the core support structure to improve reliability predictions, and recommendations for further studies. Emphasis in the study is directed towards developing a basic understanding of graphite failure and strength degradation mechanisms; and validating analytical methods for predicting strength and strength degradation from basic material properties

  11. Structure and Dynamics of Thin Ionomer Films: a Key to A Stable Fuel Cell Membrane.

    Science.gov (United States)

    Perahia, Dvora

    2000-03-01

    The technology for solid polymeric electrolytic membranes for a fuel cells, calls for the thinnest film which is electrochemically stable. At present, none supported polymeric solid state fuel cell membranes, thinner than 50 microns, fail mechanically during fuel cell operation. When approaching the thin film limits, interfacial effects become significant to structure dynamics and consequently, the stability of the membranes. Our work focuses on understanding the interfacial effects on thin per-fluorinated ionomer films, including interfacial effects on the thin films themselves and nanotubes-thin film complexes, mimicking the catalyst-ionomer complexes. In particular we investigated the dynamics and structure in 500 angstrom and less, films made by several perfluorinated ionomers, cast on a solid support. Both the films and their parent solutions were investigated with the goal of resolving the factors that affect the stability in the ultra thin regime. AFM/STM and X-ray and neutron reflectivity were used to investigate the thin films and small angle neutron scattering was utilized to the study of the solutions. Films were both spin-coated and self assembles from solutions on a model oxidized single crystal silicon wafer, treated with HF. When coated from molecular solutions, the films tend to dewet on a time scale of minutes to hours. With increasing concentrations, above the critical micellar concentration of the ionomers in water/alcohol, stable films on the order of 200-500 angstroms were formed. While self-assembled films were found to be stable at temperatures close to Tg of the ionomer, spin-coated ones partially dewet. The surface structure obtained, exhibit periodicity on different length scales, depending on the concentration of the polymer in the solution from which the film was assembled. In the ultra dilute regime, micelles were detected at the solid interface. Films formed from dilute solutions exhibit fractal nature with a fractal dimension varying

  12. Genetic structure of the rattan Calamus thwaitesii in core, buffer and ...

    Indian Academy of Sciences (India)

    We examine the population structure and genetic diversity of an economically important rattan, Calamus thwaitesii, in the core, buffer and peripheral regions of three protected areas in the central Western Ghats, southern India. Our results indicate that in all the three protected areas, the core and buffer regions maintain a ...

  13. Residual dent in locally loaded foam core sandwich structures – Analysis and use for NDI

    NARCIS (Netherlands)

    Koysin, V.; Shipsha, Andrey

    2008-01-01

    This paper addresses the residual denting in the face sheet and corresponding core damage in a locally loaded flat sandwich structure with foam core. The problem is analytically considered in the context of elastic bending of the face sheet accompanied by non-linear deformation of the crushed foam

  14. Core-Shell-structured Dendritic Mesoporous Silica Nanoparticles for Combined Photodynamic Therapy and Antibody Delivery.

    Science.gov (United States)

    Abbaraju, Prasanna Lakshmi; Yang, Yannan; Yu, Meihua; Fu, Jianye; Xu, Chun; Yu, Chengzhong

    2017-07-04

    Multifunctional core-shell-structured dendritic mesoporous silica nanoparticles with a fullerene-doped silica core, a dendritic silica shell and large pores have been prepared. The combination of photodynamic therapy and antibody therapeutics significantly inhibits the cancer cell growth by effectively reducing the level of anti-apoptotic proteins. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  15. Biophysical investigation of type A PutAs reveals a conserved core oligomeric structure

    Energy Technology Data Exchange (ETDEWEB)

    Korasick, David A. [Department of Biochemistry, University of Missouri, Columbia MO USA; Singh, Harkewal [Department of Chemistry, University of Missouri, Columbia MO USA; Pemberton, Travis A. [Department of Chemistry, University of Missouri, Columbia MO USA; Luo, Min [Department of Chemistry, University of Missouri, Columbia MO USA; Dhatwalia, Richa [Department of Chemistry, University of Missouri, Columbia MO USA; Tanner, John J. [Department of Biochemistry, University of Missouri, Columbia MO USA; Department of Chemistry, University of Missouri, Columbia MO USA

    2017-08-01

    Many enzymes form homooligomers, yet the functional significance of self-association is seldom obvious. Herein, we examine the connection between oligomerization and catalytic function for proline utilization A (PutA) enzymes. PutAs are bifunctional enzymes that catalyze both reactions of proline catabolism. Type A PutAs are the smallest members of the family, possessing a minimal domain architecture consisting of N-terminal proline dehydrogenase and C-terminal l-glutamate-γ-semialdehyde dehydrogenase modules. Type A PutAs form domain-swapped dimers, and in one case (Bradyrhizobium japonicum PutA), two of the dimers assemble into a ring-shaped tetramer. Whereas the dimer has a clear role in substrate channeling, the functional significance of the tetramer is unknown. To address this question, we performed structural studies of four-type A PutAs from two clades of the PutA tree. The crystal structure of Bdellovibrio bacteriovorus PutA covalently inactivated by N-propargylglycine revealed a fold and substrate-channeling tunnel similar to other PutAs. Small-angle X-ray scattering (SAXS) and analytical ultracentrifugation indicated that Bdellovibrio PutA is dimeric in solution, in contrast to the prediction from crystal packing of a stable tetrameric assembly. SAXS studies of two other type A PutAs from separate clades also suggested that the dimer predominates in solution. To assess whether the tetramer of B. japonicum PutA is necessary for catalytic function, a hot spot disruption mutant that cleanly produces dimeric protein was generated. The dimeric variant exhibited kinetic parameters similar to the wild-type enzyme. These results implicate the domain-swapped dimer as the core structural and functional unit of type A PutAs.

  16. Interrupted hydrogen/deuterium exchange reveals the stable core of the remarkably helical molten globule of alpha-beta parallel protein flavodoxin.

    NARCIS (Netherlands)

    Nabuurs, S.M.; Mierlo, C.P. van

    2010-01-01

    Kinetic intermediates that appear early during protein folding often resemble the relatively stable molten globule intermediates formed by several proteins under mildly denaturing conditions. Molten globules have a substantial amount of secondary structure but lack virtually all tertiary side-chain

  17. Interrupted hydrogen/deuterium exchange reveals the stable core of the remarkably helical molten globule of a-ß parallel protein flavodoxin

    NARCIS (Netherlands)

    Nabuurs, S.M.; Mierlo, van C.P.M.

    2010-01-01

    Kinetic intermediates that appear early during protein folding often resemble the relatively stable molten globule intermediates formed by several proteins under mildly denaturing conditions. Molten globules have a substantial amount of secondary structure but lack virtually all tertiary side-chain

  18. Density-based and transport-based core-periphery structures in networks.

    Science.gov (United States)

    Lee, Sang Hoon; Cucuringu, Mihai; Porter, Mason A

    2014-03-01

    Networks often possess mesoscale structures, and studying them can yield insights into both structure and function. It is most common to study community structure, but numerous other types of mesoscale structures also exist. In this paper, we examine core-periphery structures based on both density and transport. In such structures, core network components are well-connected both among themselves and to peripheral components, which are not well-connected to anything. We examine core-periphery structures in a wide range of examples of transportation, social, and financial networks-including road networks in large urban areas, a rabbit warren, a dolphin social network, a European interbank network, and a migration network between counties in the United States. We illustrate that a recently developed transport-based notion of node coreness is very useful for characterizing transportation networks. We also generalize this notion to examine core versus peripheral edges, and we show that the resulting diagnostic is also useful for transportation networks. To examine the properties of transportation networks further, we develop a family of generative models of roadlike networks. We illustrate the effect of the dimensionality of the embedding space on transportation networks, and we demonstrate that the correlations between different measures of coreness can be very different for different types of networks.

  19. A simple approach to the construction of the core structure present in ...

    Indian Academy of Sciences (India)

    . Abstract. A convenient route for the synthesis of oxacyclobutapentalene, the tricyclic bridged core structure present in bioactive marine diterpene bielschowskysin and the polyketide hippolachnin A, is reported. The key steps involve ring ...

  20. Beacon: A three-dimensional structural analysis code for bowing history of fast breeder reactor cores

    International Nuclear Information System (INIS)

    Miki, K.

    1979-01-01

    The core elements of an LMFBR are bowed due to radial gradients of both temperature and neutron flux in the core. Since all hexagonal elements are multiply supported by adjacent elements or the restraint system, restraint forces and bending stresses are induced. In turn, these forces and stresses are relaxed by irradiation enhanced creep of the material. The analysis of the core bowing behavior requires a three-dimensional consideration of the mechanical interactions among the core elements, because the core consists of different kinds of elements and of fuel assemblies with various burnup histories. A new computational code BEACON has been developed for analyzing the bowing behavior of an LMFBR's core in three dimensions. To evaluate mechanical interactions among core elements, the code uses the analytical method of the earlier SHADOW code. BEACON analyzes the mechanical interactions in three directions, which form angles of 60 0 with one another. BEACON is applied to the 60 0 sector of a typical LMFBR's core for analyzing the bowing history during one equilibrium cycle. 120 core elements are treated, assuming the boundary condition of rotational symmetry. The application confirms that the code can be an effective tool for parametric studies as well as for detailed structural analysis of LMFBR's core. (orig.)

  1. Stable Encoding of Task Structure Coexists With Flexible Coding of Task Events in Sensorimotor Striatum

    Science.gov (United States)

    Kubota, Yasuo; Liu, Jun; Hu, Dan; DeCoteau, William E.; Eden, Uri T.; Smith, Anne C.

    2009-01-01

    The sensorimotor striatum, as part of the brain's habit circuitry, has been suggested to store fixed action values as a result of stimulus-response learning and has been contrasted with a more flexible system that conditionally assigns values to behaviors. The stability of neural activity in the sensorimotor striatum is thought to underlie not only normal habits but also addiction and clinical syndromes characterized by behavioral fixity. By recording in the sensorimotor striatum of mice, we asked whether neuronal activity acquired during procedural learning would be stable even if the sensory stimuli triggering the habitual behavior were altered. Contrary to expectation, both fixed and flexible activity patterns appeared. One, representing the global structure of the acquired behavior, was stable across changes in task cuing. The second, a fine-grain representation of task events, adjusted rapidly. Such dual forms of representation may be critical to allow motor and cognitive flexibility despite habitual performance. PMID:19625536

  2. TGP, an extremely stable, non-aggregating fluorescent protein created by structure-guided surface engineering

    Science.gov (United States)

    Close, Devin W.; Don Paul, Craig; Langan, Patricia S.; Wilce, Matthew C.J.; Traore, Daouda A.K.; Halfmann, Randal; Rocha, Reginaldo C.; Waldo, Geoffery S.; Payne, Riley J.; Rucker, Joseph B.; Prescott, Mark; Bradbury, Andrew R.M.

    2014-01-01

    In this paper we describe the engineering and X-ray crystal structure of Thermal Green Protein (TGP), an extremely stable, highly soluble, non-aggregating green fluorescent protein. TGP is a soluble variant of the fluorescent protein eCGP123, which despite being highly stable, has proven to be aggregation-prone. The X-ray crystal structure of eCGP123, also determined within the context of this paper, was used to carry out rational surface engineering to improve its solubility, leading to TGP. The approach involved simultaneously eliminating crystal lattice contacts while increasing the overall negative charge of the protein. Despite intentional disruption of lattice contacts and introduction of high entropy glutamate side chains, TGP crystallized readily in a number of different conditions and the X-ray crystal structure of TGP was determined to 1.9 Å resolution. The structural reasons for the enhanced stability of TGP and eCGP123 are discussed. We demonstrate the utility of using TGP as a fusion partner in various assays and significantly, in amyloid assays in which the standard fluorescent protein, EGFP, is undesirable because of aberrant oligomerization. PMID:25287913

  3. Thermal green protein, an extremely stable, nonaggregating fluorescent protein created by structure-guided surface engineering.

    Science.gov (United States)

    Close, Devin W; Paul, Craig Don; Langan, Patricia S; Wilce, Matthew C J; Traore, Daouda A K; Halfmann, Randal; Rocha, Reginaldo C; Waldo, Geoffery S; Payne, Riley J; Rucker, Joseph B; Prescott, Mark; Bradbury, Andrew R M

    2015-07-01

    In this article, we describe the engineering and X-ray crystal structure of Thermal Green Protein (TGP), an extremely stable, highly soluble, non-aggregating green fluorescent protein. TGP is a soluble variant of the fluorescent protein eCGP123, which despite being highly stable, has proven to be aggregation-prone. The X-ray crystal structure of eCGP123, also determined within the context of this paper, was used to carry out rational surface engineering to improve its solubility, leading to TGP. The approach involved simultaneously eliminating crystal lattice contacts while increasing the overall negative charge of the protein. Despite intentional disruption of lattice contacts and introduction of high entropy glutamate side chains, TGP crystallized readily in a number of different conditions and the X-ray crystal structure of TGP was determined to 1.9 Å resolution. The structural reasons for the enhanced stability of TGP and eCGP123 are discussed. We demonstrate the utility of using TGP as a fusion partner in various assays and significantly, in amyloid assays in which the standard fluorescent protein, EGFP, is undesirable because of aberrant oligomerization. © 2014 Wiley Periodicals, Inc.

  4. The search for the most stable structures of silicon-carbon monolayer compounds.

    Science.gov (United States)

    Li, Pengfei; Zhou, Rulong; Zeng, Xiao Cheng

    2014-10-21

    The most stable structures of two-dimensional (2D) silicon-carbon monolayer compounds with different stoichiometric compositions (i.e., Si : C ratio = 2 : 3, 1 : 3 and 1 : 4) are predicted for the first time based on the particle-swarm optimization (PSO) technique combined with density functional theory optimization. Although the 2D Si-C monolayer compounds considered here are rich in carbon, many of the low-energy metastable and the lowest-energy silicon-carbon structures are not graphene (carbon monolayer) like. Phonon-spectrum calculations and ab initio molecular dynamics simulations were also performed to confirm the dynamical stability of the predicted most stable 2D silicon-carbon structures as well their thermal stability at elevated temperature. The computed electronic band structures show that all three predicted silicon-carbon compounds are semiconductors with direct or indirect bandgaps. Importantly, their bandgaps are predicted to be close to those of bulk silicon or bulk germanium. If confirmed in the laboratory, these 2D silicon-carbon compounds with different stoichiometric compositions may be exploited for future applications in nanoelectronic devices.

  5. Determination of Core-Shell Structures in Pd-Hg Nanoparticles by STEM-EDX

    DEFF Research Database (Denmark)

    Deiana, Davide; Verdaguer Casadevall, Arnau; Malacrida, Paolo

    2015-01-01

    The structural and elemental configuration of a high-performing Pd-Hg electrocatalyst for oxygen reduction to hydrogen peroxide has been studied by means of high-resolution scanning transmission electron microscopy. Pd-Hg nanoparticles are shown to have a crystalline core-shell structure, with a Pd...... core and a Pd-Hg ordered alloy shell. The ordered shell is responsible for the high oxygen reduction selectivity to H2O2....

  6. Structural insights into methanol-stable variants of lipase T6 from Geobacillus stearothermophilus.

    Science.gov (United States)

    Dror, Adi; Kanteev, Margarita; Kagan, Irit; Gihaz, Shalev; Shahar, Anat; Fishman, Ayelet

    2015-11-01

    Enzymatic production of biodiesel by transesterification of triglycerides and alcohol, catalyzed by lipases, offers an environmentally friendly and efficient alternative to the chemically catalyzed process while using low-grade feedstocks. Methanol is utilized frequently as the alcohol in the reaction due to its reactivity and low cost. However, one of the major drawbacks of the enzymatic system is the presence of high methanol concentrations which leads to methanol-induced unfolding and inactivation of the biocatalyst. Therefore, a methanol-stable lipase is of great interest for the biodiesel industry. In this study, protein engineering was applied to substitute charged surface residues with hydrophobic ones to enhance the stability in methanol of a lipase from Geobacillus stearothermophilus T6. We identified a methanol-stable variant, R374W, and combined it with a variant found previously, H86Y/A269T. The triple mutant, H86Y/A269T/R374W, had a half-life value at 70 % methanol of 324 min which reflects an 87-fold enhanced stability compared to the wild type together with elevated thermostability in buffer and in 50 % methanol. This variant also exhibited an improved biodiesel yield from waste chicken oil compared to commercial Lipolase 100L® and Novozyme® CALB. Crystal structures of the wild type and the methanol-stable variants provided insights regarding structure-stability correlations. The most prominent features were the extensive formation of new hydrogen bonds between surface residues directly or mediated by structural water molecules and the stabilization of Zn and Ca binding sites. Mutation sites were also characterized by lower B-factor values calculated from the X-ray structures indicating improved rigidity.

  7. Core American values and the structure of antigay prejudice.

    Science.gov (United States)

    Callahan, Matthew Paolucci; Vescio, Theresa K

    2011-01-01

    This work presents a new scale to measure conflicting attitudes toward sexual minorities. This scale parallels existing measures of conflicting racial attitudes (anti-Black and pro-Black attitudes; Katz & Hass, 1988). After constructing and validating measures of antigay and progay attitudes, we tested relationships among core American values with racial and sexual minority attitudes. We examined relations among the Protestant Work Ethic (PWE), Traditional Family Ideology (TFI), and egalitarian values with attitudes toward racial outgroups and sexual minorities. The results revealed that both PWE values and egalitarian values predicted anti-Black attitudes. By contrast, endorsement of egalitarian values, but not PWE values, predicted pro-Black attitudes. Results also revealed a similar but distinct pattern among values and heterosexuals' attitudes toward sexual minorities. TFI, but not egalitarian value endorsement, predicted antigay attitudes, whereas both TFI and egalitarian value endorsement predicted progay attitudes. The implications of these findings are discussed.

  8. Gregarious Data Re-structuring in a Many Core Architecture

    Energy Technology Data Exchange (ETDEWEB)

    Shrestha, Sunil; Manzano Franco, Joseph B.; Marquez, Andres; Zuckerman, Stephane; Song, Shuaiwen; Gao, Guang R.

    2015-08-24

    this paper, we have developed a new methodology that takes in consideration the access patterns from a single parallel actor (e.g. a thread), as well as, the access patterns of “grouped” parallel actors that share a resource (e.g. a distributed Level 3 cache). We start with a hierarchical tile code for our target machine and apply a series of transformations at the tile level to improve data residence in a given memory hierarchy level. The contribution of this paper includes (a) collaborative data restructuring for group reuse and (b) low overhead transformation technique to improve access pattern and bring closely connected data elements together. Preliminary results in a many core architecture, Tilera TileGX, shows promising improvements over optimized OpenMP code (up to 31% increase in GFLOPS) and over our own previous work on fine grained runtimes (up to 16%) for selected kernels

  9. Core-Shell Structured Electro- and Magneto-Responsive Materials: Fabrication and Characteristics

    Directory of Open Access Journals (Sweden)

    Hyoung Jin Choi

    2014-11-01

    Full Text Available Core-shell structured electrorheological (ER and magnetorheological (MR particles have attracted increasing interest owing to their outstanding field-responsive properties, including morphology, chemical and dispersion stability, and rheological characteristics of shear stress and yield stress. This study covers recent progress in the preparation of core-shell structured materials as well as their critical characteristics and advantages. Broad emphasises from the synthetic strategy of various core-shell particles to their feature behaviours in the magnetic and electric fields have been elaborated.

  10. Technical Meeting on Liquid Metal Reactor Concepts: Core Design and Structural Materials. Working Material

    International Nuclear Information System (INIS)

    2013-01-01

    The objective of the TM on “Liquid metal reactor concept: core design and structural materials” was to present and discuss innovative liquid metal fast reactor (LMFR) core designs with special focus on the choice, development, testing and qualification of advanced reactor core structural materials. Main results arising from national and international R&D programmes and projects in the field were reviewed, and new activities to be carried out under the IAEA aegis were identified on the basis of the analysis of current research and technology gaps

  11. Measurement and Analysis of Structural Integrity of Reactor Core Support Structure in Pressurized Water Reactor (PWR) Plant

    Science.gov (United States)

    Ansari, Saleem A.; Haroon, Muhammad; Rashid, Atif; Kazmi, Zafar

    2017-02-01

    Extensive calculation and measurements of flow-induced vibrations (FIV) of reactor internals were made in a PWR plant to assess the structural integrity of reactor core support structure against coolant flow. The work was done to meet the requirements of the Fukushima Response Action Plan (FRAP) for enhancement of reactor safety, and the regulatory guide RG-1.20. For the core surveillance measurements the Reactor Internals Vibration Monitoring System (IVMS) has been developed based on detailed neutron noise analysis of the flux signals from the four ex-core neutron detectors. The natural frequencies, displacement and mode shapes of the reactor core barrel (CB) motion were determined with the help of IVMS. The random pressure fluctuations in reactor coolant flow due to turbulence force have been identified as the predominant cause of beam-mode deflection of CB. The dynamic FIV calculations were also made to supplement the core surveillance measurements. The calculational package employed the computational fluid dynamics, mode shape analysis, calculation of power spectral densities of flow & pressure fields and the structural response to random flow excitation forces. The dynamic loads and stiffness of the Hold-Down Spring that keeps the core structure in position against upward coolant thrust were also determined by noise measurements. Also, the boron concentration in primary coolant at any time of the core cycle has been determined with the IVMS.

  12. Structurally stable gel bead containing entrapped enzyme and method for manufacture thereof

    Science.gov (United States)

    Woodward, J.

    1998-12-08

    This research provides a structurally stable gel bead containing an entrapped enzyme and a method for its manufacture. The enzyme is covalently cross-linked to gelatin in the presence of glutaraldehyde prior to the formation of the gel bead, to prevent leakage of the enzyme. Propylene glycol alginate is then added to the mixture. Once the gel beads are formed, they are then soaked in glutaraldehyde, which imparts structural stability to the gel beads. This method can be used with many types of enzymes, such as proteases, carbohydrases, proteases, ligases, isomerases, oxidoreductases, and specialty enzymes. These and other enzymes can be immobilized in the gel beads and utilized in a number of enzymatic processes. Exogenously added ions are not required to maintain the structural stability of these gel beads. 7 figs.

  13. Oxide-supported IrNiO(x) core-shell particles as efficient, cost-effective, and stable catalysts for electrochemical water splitting.

    Science.gov (United States)

    Nong, Hong Nhan; Oh, Hyung-Suk; Reier, Tobias; Willinger, Elena; Willinger, Marc-Georg; Petkov, Valeri; Teschner, Detre; Strasser, Peter

    2015-03-02

    Active and highly stable oxide-supported IrNiO(x) core-shell catalysts for electrochemical water splitting are presented. IrNi(x)@IrO(x) nanoparticles supported on high-surface-area mesoporous antimony-doped tin oxide (IrNiO(x)/Meso-ATO) were synthesized from bimetallic IrNi(x) precursor alloys (PA-IrNi(x) /Meso-ATO) using electrochemical Ni leaching and concomitant Ir oxidation. Special emphasis was placed on Ni/NiO surface segregation under thermal treatment of the PA-IrNi(x)/Meso-ATO as well as on the surface chemical state of the particle/oxide support interface. Combining a wide array of characterization methods, we uncovered the detrimental effect of segregated NiO phases on the water splitting activity of core-shell particles. The core-shell IrNiO(x)/Meso-ATO catalyst displayed high water-splitting activity and unprecedented stability in acidic electrolyte providing substantial progress in the development of PEM electrolyzer anode catalysts with drastically reduced Ir loading and significantly enhanced durability. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  14. Rich stoichiometries of stable Ca-Bi system: Structure prediction and superconductivity

    Science.gov (United States)

    Dong, Xu; Fan, Changzeng

    2015-03-01

    Using a variable-composition ab initio evolutionary algorithm implemented in the USPEX code, we have performed a systematic search for stable compounds in the Ca-Bi system at different pressures. In addition to the well-known tI12-Ca2Bi and oS12-CaBi2, a few more structures were found by our calculations, among which phase transitions were also predicted in Ca2Bi (tI12 --> oI12 --> hP6), Ca3Bi2 (hP5 --> mC20 --> aP5) and CaBi (tI2 --> tI8), as well as a new phase (Ca3Bi) with a cF4 structure. All the newly predicted structures can be both dynamically and thermodynamically stable with increasing pressure. The superconductive properties of cF4-CaBi3, tI2-CaBi and cF4-Ca3Bi were studied and the superconducting critical temperature Tc can be as high as 5.16, 2.27 and 5.25 K, respectively. Different superconductivity behaviors with pressure increasing have been observed by further investigations.

  15. Research advances in polymer emulsion based on "core-shell" structure particle design.

    Science.gov (United States)

    Ma, Jian-zhong; Liu, Yi-hong; Bao, Yan; Liu, Jun-li; Zhang, Jing

    2013-09-01

    In recent years, quite many studies on polymer emulsions with unique core-shell structure have emerged at the frontier between material chemistry and many other fields because of their singular morphology, properties and wide range of potential applications. Organic substance as a coating material onto either inorganic or organic internal core materials promises an unparalleled opportunity for enhancement of final functions through rational designs. This contribution provides a brief overview of recent progress in the synthesis, characterization, and applications of both inorganic-organic and organic-organic polymer emulsions with core-shell structure. In addition, future research trends in polymer composites with core-shell structure are also discussed in this review. Copyright © 2013 Elsevier B.V. All rights reserved.

  16. Entropy stable high order discontinuous Galerkin methods for ideal compressible MHD on structured meshes

    Science.gov (United States)

    Liu, Yong; Shu, Chi-Wang; Zhang, Mengping

    2018-02-01

    We present a discontinuous Galerkin (DG) scheme with suitable quadrature rules [15] for ideal compressible magnetohydrodynamic (MHD) equations on structural meshes. The semi-discrete scheme is analyzed to be entropy stable by using the symmetrizable version of the equations as introduced by Godunov [32], the entropy stable DG framework with suitable quadrature rules [15], the entropy conservative flux in [14] inside each cell and the entropy dissipative approximate Godunov type numerical flux at cell interfaces to make the scheme entropy stable. The main difficulty in the generalization of the results in [15] is the appearance of the non-conservative "source terms" added in the modified MHD model introduced by Godunov [32], which do not exist in the general hyperbolic system studied in [15]. Special care must be taken to discretize these "source terms" adequately so that the resulting DG scheme satisfies entropy stability. Total variation diminishing / bounded (TVD/TVB) limiters and bound-preserving limiters are applied to control spurious oscillations. We demonstrate the accuracy and robustness of this new scheme on standard MHD examples.

  17. Use of systematics in the interpretation of nuclear structure far from the beta-stable region

    International Nuclear Information System (INIS)

    Wood, J.L.

    1979-01-01

    The use of systematics in the interpretation of nuclear structure far from the beta-stable region is discussed. In particular, a set of rules for the use of systematics is presented together with some experimental criteria that need to be fulfilled for radioactive decay scheme studies in order that all states up to a given spin-parity and energy are located. Illustrative examples are taken from the region 180 < A < 210, with particular emphasis on the odd-mass Au and Hg nuclei. 6 figures

  18. Stable isotopes provide insight into population structure and segregation in eastern North Atlantic sperm whales

    DEFF Research Database (Denmark)

    Borrell, Asunción; Velásquez Vacca, Adriana; Pinela, Ana M.

    2013-01-01

    highly mobile, shows indication of structuring in the eastern North Atlantic, an ocean basin in which a single population is believed to occur. To do so, we examined stable isotope values in sequential growth layer groups of teeth from individuals sampled in Denmark and NW Spain. In each layer we...... measured oxygen-isotope ratios (delta O-18) in the inorganic component (hydroxyapatite), and nitrogen and carbon isotope ratios (delta N-15: delta C-13) in the organic component (primarily collagenous). We found significant differences between Denmark and NW Spain in delta N-15 and delta O-18 values...

  19. Reservoir age variations and stable isotope values of bulk sediment in a core from the Limfjord, Denmark

    DEFF Research Database (Denmark)

    Philippsen, Bente; Olsen, Jesper; Rasmussen, Peter

    thousand years is possible for freshwater with a high content of dissolved carbonate. On the other hand, freshwater without a significant content of 14C-dead carbon does not have a reservoir age. In coastal waters, the different water sources mix and produce highly variable reservoir ages. Due to Holocene...... on radiocarbon dating of shells and on stable isotope measurements of bulk sediment from 7400 to 1300 cal BP. Reservoir ages in coastal waters and estuaries can differ considerably from the global model ocean. The seas around Denmark have a reservoir age of c. 400 years, while a hardwater effect of a few...... relative sea level fluctuations, caused by the interplay of eustatic sea level changes and isostasy, the Limfjord had varying connections to the sea. As the relative proportion of marine and fresh water varied with time, the reservoir age for the Limfjord is also expected to vary. Radiocarbon datings...

  20. Structures, microfabrics and textures of the Cordilleran-type Rechnitz metamorphic core complex, Eastern Alps☆

    Science.gov (United States)

    Cao, Shuyun; Neubauer, Franz; Bernroider, Manfred; Liu, Junlai; Genser, Johann

    2013-01-01

    Rechnitz window group represents a Cordilleran-style metamorphic core complex, which is almost entirely located within nearly contemporaneous Neogene sediments at the transition zone between the Eastern Alps and the Neogene Pannonian basin. Two tectonic units are distinguished within the Rechnitz metamorphic core complex (RMCC): (1) a lower unit mainly composed of Mesozoic metasediments, and (2) an upper unit mainly composed of ophiolite remnants. Both units are metamorphosed within greenschist facies conditions during earliest Miocene followed by exhumation and cooling. The internal structure of the RMCC is characterized by the following succession of structure-forming events: (1) blueschist relics of Paleocene/Eocene age formed as a result of subduction (D1), (2) ductile nappe stacking (D2) of an ophiolite nappe over a distant passive margin succession (ca. E–W to WNW–ESE oriented stretching lineation), (3) greenschist facies-grade metamorphism annealing dominant in the lower unit, and (4) ductile low-angle normal faulting (D3) (with mainly NE–SW oriented stretching lineation), and (5) ca. E to NE-vergent folding (D4). The microfabrics are related to mostly ductile nappe stacking to ductile low-angle normal faulting. Paleopiezometry in conjunction with P–T estimates yield high strain rates of 10− 11 to 10− 13 s− 1, depending on the temperature (400–350 °C) and choice of piezometer and flow law calibration. Progressive microstructures and texture analysis indicate an overprint of the high-temperature fabrics (D2) by the low-temperature deformation (D3). Phengitic mica from the Paleocene/Eocene high-pressure metamorphism remained stable during D2 ductile deformation as well as preserved within late stages of final sub-greenschist facies shearing. Chlorite geothermometry yields two temperature groups, 376–328 °C, and 306–132 °C. Chlorite is seemingly accessible to late-stage resetting. The RMCC underwent an earlier large-scale coaxial

  1. Core Genome Multilocus Sequence Typing Scheme for Stable, Comparative Analyses of Campylobacter jejuni and C. coli Human Disease Isolates.

    Science.gov (United States)

    Cody, Alison J; Bray, James E; Jolley, Keith A; McCarthy, Noel D; Maiden, Martin C J

    2017-07-01

    Human campylobacteriosis, caused by Campylobacter jejuni and C. coli , remains a leading cause of bacterial gastroenteritis in many countries, but the epidemiology of campylobacteriosis outbreaks remains poorly defined, largely due to limitations in the resolution and comparability of isolate characterization methods. Whole-genome sequencing (WGS) data enable the improvement of sequence-based typing approaches, such as multilocus sequence typing (MLST), by substantially increasing the number of loci examined. A core genome MLST (cgMLST) scheme defines a comprehensive set of those loci present in most members of a bacterial group, balancing very high resolution with comparability across the diversity of the group. Here we propose a set of 1,343 loci as a human campylobacteriosis cgMLST scheme (v1.0), the allelic profiles of which can be assigned to core genome sequence types. The 1,343 loci chosen were a subset of the 1,643 loci identified in the reannotation of the genome sequence of C. jejuni isolate NCTC 11168, chosen as being present in >95% of draft genomes of 2,472 representative United Kingdom campylobacteriosis isolates, comprising 2,207 (89.3%) C. jejuni isolates and 265 (10.7%) C. coli isolates. Validation of the cgMLST scheme was undertaken with 1,478 further high-quality draft genomes, containing 150 or fewer contiguous sequences, from disease isolate collections: 99.5% of these isolates contained ≥95% of the 1,343 cgMLST loci. In addition to the rapid and effective high-resolution analysis of large numbers of diverse isolates, the cgMLST scheme enabled the efficient identification of very closely related isolates from a well-defined single-source campylobacteriosis outbreak. Copyright © 2017 Cody et al.

  2. Structure-Guided Redesign Increases the Propensity of HIV Env To Generate Highly Stable Soluble Trimers.

    Science.gov (United States)

    Guenaga, Javier; Dubrovskaya, Viktoriya; de Val, Natalia; Sharma, Shailendra K; Carrette, Barbara; Ward, Andrew B; Wyatt, Richard T

    2015-12-30

    Due to high viral diversity, an effective HIV-1 vaccine will likely require Envs derived from multiple subtypes to generate broadly neutralizing antibodies (bNAbs). Soluble Env mimics, like the native flexibly linked (NFL) and SOSIP trimers, derived from the subtype A BG505 Env, form homogeneous, stable native-like trimers. However, other Env sequences, such as JRFL and 16055 from subtypes B and C, do so to a lesser degree. The high-resolution BG505 SOSIP crystal structures permit the identification and redesign of Env elements involved in trimer stability. Here, we identified structure trimer-derived (TD) residues that increased the propensity of the subtype B JRFL and subtype C 16055 Env sequences to form well-ordered, homogenous, and highly stable soluble trimers. The generation of these spike mimics no longer required antibody-based selection, positive or negative. Using the redesigned subtype B and C trimer representatives as respective foundations, we further stabilized the NFL TD trimers by engineering an intraprotomer disulfide linkage in the prebridging sheet, I201C-A433C (CC), that locks the gp120 in the receptor nontriggered state. We demonstrated that this disulfide pair prevented CD4 induced-conformational rearrangements in NFL trimers derived from the prototypic subtype A, B, and C representatives. Coupling the TD-based design with the engineered disulfide linkage, CC, increased the propensity of Env to form soluble highly stable spike mimics that are resistant to CD4-induced changes. These advances will allow testing of the hypothesis that such stabilized immunogens will more efficiently elicit neutralizing antibodies in small-animal models and primates. HIV-1 displays unprecedented global diversity circulating in the human population. Since the envelope glycoprotein (Env) is the target of neutralizing antibodies, Env-based vaccine candidates that address such diversity are needed. Soluble well-ordered Env mimics, typified by NFL and SOSIP trimers

  3. Anisotropic structure of the Inner Core and its uncertainty from transdimensional body-wave tomography

    Science.gov (United States)

    Burdick, S.; Waszek, L.; Lekic, V.

    2017-12-01

    Studies of body waves and normal modes have revealed strong quasi-hemispheric variations in seismic velocity, anisotropy and attenuation in the inner core. A rigorous mapping of the hemispheric boundaries and smaller scale heterogeneity within the hemispheres is crucial for distinguishing between hypotheses about inner core formation and evolution. However, the relatively sparse and heterogeneous distribution of paths piercing the inner core creates difficulties in constraining the boundaries and sub-hemispheric variations with body wave tomography. Damped tomographic inversions tend to smooth out strong structural gradients and risk carrying the imprint of sparse path coverage, while under-parametrized models can miss pertinent small-scale variations. For these reasons, we apply a probabilistic and transdimensional (THB) tomography method on core-sensitive differential P-wave traveltimes. The THB approach is well-suited to the problem of inner core tomography since 1) it remains parsimonious by allowing the parametrization to be determined the requirements of the data and 2) it preserves sharp boundaries in seismic properties, allowing it to capture both short-wavelength structure and the strong hemispheric dichotomy. Furthermore, the approach yields estimates of uncertainty in isotropic and anisotropic velocity, hemispheric boundary geometry, anisotropy axis and the tradeoffs between these properties. We quantify the effects of mantle heterogeneity with inner core structure and place constraints on inner core dynamics and minerology.

  4. Finding the core: Network structure in interbank markets

    NARCIS (Netherlands)

    van Lelyveld, I.; in 't Veld, D.

    2012-01-01

    This paper investigates the network structure of interbank markets, which has proved to be important for financial stability during the crisis. First, we describe and map the interbank network in the Netherlands, an exception in the literature because of its small and open banking environment.

  5. Methanol oxidation reaction on core-shell structured Ruthenium-Palladium nanoparticles: Relationship between structure and electrochemical behavior

    Science.gov (United States)

    Kübler, Markus; Jurzinsky, Tilman; Ziegenbalg, Dirk; Cremers, Carsten

    2018-01-01

    In this work the relationship between structural composition and electrochemical characteristics of Palladium(Pd)-Ruthenium(Ru) nanoparticles during alkaline methanol oxidation reaction is investigated. The comparative study of a standard alloyed and a precisely Ru-core-Pd-shell structured catalyst allows for a distinct investigation of the electronic effect and the bifunctional mechanism. Core-shell catalysts benefit from a strong electronic effect and an efficient Pd utilization. It is found that core-shell nanoparticles are highly active towards methanol oxidation reaction for potentials ≥0.6 V, whereas alloyed catalysts show higher current outputs in the lower potential range. However, differential electrochemical mass spectrometry (DEMS) experiments reveal that the methanol oxidation reaction on core-shell structured catalysts proceeds via the incomplete oxidation pathway yielding formaldehyde, formic acid or methyl formate. Contrary, the alloyed catalyst benefits from the Ru atoms at its surface. Those are found to be responsible for high methanol oxidation activity at lower potentials as well as for complete oxidation of CH3OH to CO2 via the bifunctional mechanism. Based on these findings a new Ru-core-Pd-shell-Ru-terrace catalyst was synthesized, which combines the advantages of the core-shell structure and the alloy. This novel catalyst shows high methanol electrooxidation activity as well as excellent selectivity for the complete oxidation pathway.

  6. Top coalitions, common rankings, and semistrict core stability

    OpenAIRE

    Dinko Dimitrov

    2006-01-01

    The top coalition property of Banerjee et al. (2001) and the common ranking property of Farrell and Scotchmer (1988) are sufficient conditions for core stability in hedonic games. We introduce the semistrict core as a stronger stability concept than the core, and show that the top coalition property guarantees the existence of semistrictly core stable coalition structures. Moreover, for each game satisfying the common ranking property, the core and the semistrict core coincide.

  7. Length of encapsidated cargo impacts stability and structure of in vitro assembled alphavirus core-like particles

    Science.gov (United States)

    Rayaprolu, Vamseedhar; Moore, Alan; Che-Yen Wang, Joseph; Goh, Boon Chong; Perilla, Juan R.; Zlotnick, Adam; Mukhopadhyay, Suchetana

    2017-12-01

    In vitro assembly of alphavirus nucleocapsid cores, called core-like particles (CLPs), requires a polyanionic cargo. There are no sequence or structure requirements to encapsidate single-stranded nucleic acid cargo. In this work, we wanted to determine how the length of the cargo impacts the stability and structure of the assembled CLPs. We hypothesized that cargo neutralizes the basic region of the alphavirus capsid protein and if the cargo is long enough, it will also act to scaffold the CP monomers together. Experimentally we found that CLPs encapsidating short 27mer oligonucleotides were less stable than CLPs encapsidating 48mer or 90mer oligonucleotides under different chemical and thermal conditions. Furthermore, cryo-EM studies showed there were structural differences between CLPs assembled with 27mer and 48mer cargo. To mimic the role of the cargo in CLP assembly we made a mutant (4D) where we substituted a cluster of four Lys residues in the CP with four Asp residues. We found that these few amino acid substitutions were enough to initiate CLP assembly in the absence of cargo. The cargo-free 4D CLPs show higher resistance to ionic strength and increased temperature compared to wild-type cargo containing CLPs suggesting their CLP assembly mechanism might also be different.

  8. Trophic structure in a seabird host-parasite food web: insights from stable isotope analyses.

    Directory of Open Access Journals (Sweden)

    Elena Gómez-Díaz

    2010-05-01

    Full Text Available Ecological studies on food webs rarely include parasites, partly due to the complexity and dimensionality of host-parasite interaction networks. Multiple co-occurring parasites can show different feeding strategies and thus lead to complex and cryptic trophic relationships, which are often difficult to disentangle by traditional methods. We analyzed stable isotope ratios of C ((13C/(12C, delta(13C and N ((15N/(14N, delta(15N of host and ectoparasite tissues to investigate trophic structure in 4 co-occurring ectoparasites: three lice and one flea species, on two closely related and spatially segregated seabird hosts (Calonectris shearwaters. delta(13C isotopic signatures confirmed feathers as the main food resource for the three lice species and blood for the flea species. All ectoparasite species showed a significant enrichment in delta(15N relatively to the host tissue consumed (discrimination factors ranged from 2 to 5 per thousand depending on the species. Isotopic differences were consistent across multiple host-ectoparasite locations, despite of some geographic variability in baseline isotopic levels. Our findings illustrate the influence of both ectoparasite and host trophic ecology in the isotopic structuring of the Calonectris ectoparasite community. This study highlights the potential of stable isotope analyses in disentangling the nature and complexity of trophic relationships in symbiotic systems.

  9. Nature of diffraction fringes originating in the core of core-shell nanoparticle Cu/SiO2 and formation mechanism of the structures

    Science.gov (United States)

    Radnaev, A. R.; Kalashnikov, S. V.; Nomoev, A. V.

    2016-05-01

    diffusion of oxygen atoms in certain areas (clusters) with their increased diffusion of oxygen atoms in certain areas (clusters) with their increased number has been suggested [4]. At the same time, there is a boundary between the stable phase of α-Cu and 'pre-precipitations' containing oxygen, but not having the full value oxide: red copper ore, Cu2O (Figure 1b - solvus of suggested metastable phase). In this case, diffraction fringes can be treated as 'pre-precipitations' in the form of Guinier-Preston zones with diffuse interfaces and a stable α-Cu phase.In the second case, all oxygen and silicon after condensation and crystallisation are fixed in the form of amorphous SiO2 on the core surface of copper. As far as there are no atoms of saluted oxygen or silicon in copper, there are no conditions for the formation of non-equilibrium structures. Consequently, the diffraction pattern of nanoparticle cores is not observed (Figure 2a).In the third case, in the presence of quite a large amount of silicon in the stoichiometric drop, the process of copper oxide formation is not possible, because all the oxygen is used for the production of silicon dioxide since the sensitivity of oxygen to silicon is higher than to copper. This can be explained by the difference in Gibbs energy for the oxidising reaction of components. At the temperature of 25 °C it is 29.0 J/(g mol) - for copper, and 80.8 J/(g mol) for silicon. Silicon dioxide occurring due to the oxygen content in copper will be displaced on the surface of the drop in the form of ash, forming the SiO2 shell [24]. The reason lies in the lower specific density of silicon (approximately 2.2 g/cm3) compared to copper (8.92 g/cm3). This is why, in our case, it is appropriate to study the system where there is no influence of oxygen on the crystallisation of the Cu-Si system [5]. In the cores of such nanoparticles, prominent diffraction fringes can be observed in the α-Cu core (Figure 3b).Analysis of the Cu-Si phase diagram

  10. Ultra-Stable Zero-CTE HoneySiC and H2CMN Mirror Support Structures, Phase I

    Data.gov (United States)

    National Aeronautics and Space Administration — NASA MSFC, GSFC and JPL are interested in Ultra-Stable Mirror Support Structures for Exoplanet Missions. Telescopes with Apertures of 4-meters or larger and using an...

  11. Ultra-Stable Zero-CTE HoneySiC and H2CMN Mirror Support Structures, Phase II

    Data.gov (United States)

    National Aeronautics and Space Administration — NASA MSFC, GSFC and JPL are interested in Ultra-Stable Mirror Support Structures for Exoplanet Missions. Telescopes with Apertures of 4-meters or larger and using an...

  12. Improved damage tolerant face/core interface design in sandwich structures

    DEFF Research Database (Denmark)

    Lundsgaard-Larsen, Christian; Berggreen, Christian; Quispitupa, Amilcar

    2009-01-01

    kinking behavior may be altered / avoided by changing the interface design by using Chopped Strand Mat (CSM), Continuous Filament Mat (CFM) and woven mats at the face/core interface as sources for fiber bridging, thus keeping and arresting the crack in the interface.......A face/core debond in a sandwich structure may propagate in the interface or kink into either the face or core depending on the mode-mixity of the loading. This study explores experimental methodologies for mapping the kinking behavior at various mode-mixities. Further, it is shown that the crack...

  13. Improved damage tolerant face/core interface design in sandwich structures

    DEFF Research Database (Denmark)

    Lundsgaard-Larsen, Christian; Berggreen, Christian; Quispitupa, Amilcar

    2009-01-01

    A face/core debond in a sandwich structure may propagate in the interface or kink into either the face or core depending on the mode-mixity of the loading. This study explores experimental methodologies for mapping the kinking behavior at various mode-mixities. Further, it is shown that the crack...... kinking behavior may be altered / avoided by changing the interface design by using Chopped Strand Mat (CSM), Continuous Filament Mat (CFM) and woven mats at the face/core interface as sources for fiber bridging, thus keeping and arresting the crack in the interface....

  14. Investigating the Theoretical Structure of the DAS-II Core Battery at School Age Using Bayesian Structural Equation Modeling

    Science.gov (United States)

    Dombrowski, Stefan C.; Golay, Philippe; McGill, Ryan J.; Canivez, Gary L.

    2018-01-01

    Bayesian structural equation modeling (BSEM) was used to investigate the latent structure of the Differential Ability Scales-Second Edition core battery using the standardization sample normative data for ages 7-17. Results revealed plausibility of a three-factor model, consistent with publisher theory, expressed as either a higher-order (HO) or a…

  15. Structure and genome organization of AFV2, a novel archaeal lipothrixvirus with unusual terminal and core structures

    DEFF Research Database (Denmark)

    Häring, Monika; Vestergaard, Gisle Alberg; Brügger, Kim

    2005-01-01

    A novel filamentous virus, AFV2, from the hyperthermophilic archaeal genus Acidianus shows structural similarity to lipothrixviruses but differs from them in its unusual terminal and core structures. The double-stranded DNA genome contains 31,787 bp and carries eight open reading frames homologous...

  16. The formation of a core-periphery structure in heterogeneous financial networks

    NARCIS (Netherlands)

    van der Leij, M.; in 't Veld, D.; Hommes, C.

    2016-01-01

    Recent empirical evidence suggests that financial networks exhibit a core-periphery network structure. This paper aims at giving an explanation for the emergence of such a structure using network formation theory. We propose a simple model of the overnight interbank lending market, in which banks

  17. Exploring the impact of socio-technical core-periphery structures in open source software development

    NARCIS (Netherlands)

    Amrit, Chintan Amrit; van Hillegersberg, Jos

    2010-01-01

    In this paper we apply the social network concept of core-periphery structure to the socio-technical structure of a software development team. We propose a socio-technical pattern that can be used to locate emerging coordination problems in Open Source projects. With the help of our tool and method

  18. Structural Color Palettes of Core-Shell Photonic Ink Capsules Containing Cholesteric Liquid Crystals.

    Science.gov (United States)

    Lee, Sang Seok; Seo, Hyeon Jin; Kim, Yun Ho; Kim, Shin-Hyun

    2017-06-01

    Photonic microcapsules with onion-like topology are microfluidically designed to have cholesteric liquid crystals with opposite handedness in their core and shell. The microcapsules exhibit structural colors caused by dual photonic bandgaps, resulting in a rich variety of color on the optical palette. Moreover, the microcapsules can switch the colors from either core or shell depending on the selection of light-handedness. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Morphology, molecular structure, and stable carbon isotopic composition of black carbon (BC) in urban topsoils.

    Science.gov (United States)

    Zong, Yutong; Xiao, Qing; Lu, Shenggao

    2018-02-01

    Urban soils contain significant amounts of black carbon (BC) from biomass and fossil fuel combustion and regard to be a pool of BC. BC in urban soils has multiple effects on environmental processes in urban system, such as global climate change, air quality, and public health. Urban topsoil samples (0-10 cm) were collected from Anshan, Liaoning Province, northeast China, which is one of the most important old steel industrial bases in China. The BC in urban topsoils was extracted using the density method. Their chemical composition, morphology, molecular structure, and stable carbon isotopic composition were examined using elemental analysis, scanning electron microscopy with energy-dispersive X-ray spectroscopy (SEM-EDS), Fourier transform infrared spectroscopy (FTIR), thermogravimetric analysis (TGA), X-ray diffraction (XRD), and stable carbon isotope (δ 13 C). Elemental analysis shows that carbon content in the BC of studied soils ranged from 64.5 to 78.4%, with the average more than 70%. The O/C atomic ratio of BC is on average 0.18. The BC particle displays different morphology, including porous spherical, irregular porous fragmentary, and blocky shapes. The porous spherical BC particles has atomic molar O/C ratio determined by SEM-EDS ranging from 0.04 to 0.37. XRD indicates that BC exists in mainly combining with mineral phases hematite (Fe 2 O 3 ), kaolinite (Al 2 Si 2 O 5 (OH) 4 ), quartz (SiO 2 ), and calcite (CaCO 3 ). The FTIR spectra of BC particles show major bands at approximately 3400 cm -1 (O-H), 2920 cm -1 (C = H), 1600 cm -1 (C = C), 1230 cm -1 (C = O), and 1070 cm -1 (C = O). The stable carbon isotope (δ 13 C) of BC ranges from -24.48 to -23.18‰ with the average of -23.79 ± 0.39‰. The concentration of BC in the industrial area is significantly (p fuel combustion. Results indicated that a combination of atomic O/C ratio, porous structure, and stable carbon isotopic (δ 13 C) of BC could reflect effectively the origin of BC

  20. A Collection of Chemical, Mineralogical, and Stable Isotopic Compositional Data for Green River Oil Shale from Depositional Center Cores in Colorado, Utah, and Wyoming

    Science.gov (United States)

    Tuttle, Michele L.W.

    2009-01-01

    For over half a century, the U.S. Geological Survey and collaborators have conducted stratigraphic and geochemical studies on the Eocene Green River Formation, which is known to contain large oil shale resources. Many of the studies were undertaken in the 1970s during the last oil shale boom. One such study analyzed the chemistry, mineralogy, and stable isotopy of the Green River Formation in the three major depositional basins: Piceance basin, Colo.; Uinta basin, Utah; and the Green River basin, Wyo. One depositional-center core from each basin was sampled and analyzed for major, minor, and trace chemistry; mineral composition and sulfide-mineral morphology; sulfur, nitrogen, and carbon forms; and stable isotopic composition (delta34S, delta15N, delta13C, and delta18O). Many of these data were published and used to support interpretative papers (see references herein). Some bulk-chemical and carbonate-isotopic data were never published and may be useful to studies that are currently exploring topics such as future oil shale development and the climate, geography, and weathering in the Eocene Epoch. These unpublished data, together with most of the U.S. Geological Survey data already published on these samples, are tabulated in this report.

  1. Molecular dynamics study of dislocation cores in copper: structure and diffusion at high temperatures

    International Nuclear Information System (INIS)

    Huang, Jin

    1989-01-01

    The variation of the core structure of an easy glide dislocation with temperature and its influence on the stacking fault energy (γ) have been investigated for the first time by molecular-dynamics simulation in copper. The calculations have been performed at various temperatures, using an ab-initio pseudo-potential. Our results show that the core of the Shockley partials, into which the perfect edge dislocation dissociates, becomes increasingly extended as temperature increases. However their separation remains constant. The calculated energy values of the infinite extension stacking fault and the ribbon fault between the partials are quite different, but the evolution of the core structure does not affect the temperature dependence of the latter. We have found that a high disorder appears in the core region when temperature increases due to important anharmonicity effects of the atomic vibrations. The core structure remains solid-like for T m (T m : melting point of bulk) in spite of the high disorder. Above T m , the liquid nucleus germinates in the core region, and then propagates into the bulk. In addition we studied the mobility of vacancies and interstitials trapped on the partials. Although fast diffusion is thought to occur exclusively in a pipe surrounding the dislocation core, in the present study a quasi two-dimensional diffusion is observed for both defects not only in the cores but also in the stacking fault ribbon. On the opposite of current assumptions, the activation energy for diffusion is found to be identical for both defects, which may therefore comparably contribute to mass transport along the dislocations. (author) [fr

  2. Effect of surface texture and structure on the development of stable fluvial armors

    Science.gov (United States)

    Bertin, Stephane; Friedrich, Heide

    2018-04-01

    Stable fluvial armors are found in river systems under conditions of partial sediment transport and limited sediment supply, a common occurrence in nature. Stable armoring is also readily recreated in experimental flumes. Initially, this bed stabilizing phenomenon was examined for different flow discharges and solely related to surface coarsening and bedload transport reduction. The models developed suggest a specific armor composition (i.e., texture) dependent on the parent bed material and formative discharge. Following developments in topographic remote sensing, recent research suggests that armor structure is an important control on bed stability and roughness. In this paper, replicated flume runs during which digital elevation models (DEMs) were collected from both exposed and flooded gravel beds are used to interpret armoring manifestations and to assess their replicability. A range of methodologies was used for the analysis, providing information on (i) surface grain size and orientation, (ii) bed-elevation distributions, (iii) the spatial coherence of the elevations at the grain-scale, (iv) surface slope and aspect, (v) grain imbrication and (vi) the spatial variability in DEM properties. The bed-surface topography was found to be more responsive than bed-material size to changes in flow strength. Our experimental results also provide convincing evidence that gravel-beds' response to water-work during parallel degradation is unique (i.e., replicable) given the formative parameters. Based on this finding, relationships between the armors' properties and formative parameters are proposed, and are supported by adding extensive data from previous research.

  3. Determination of Trophic Structure in Selected Freshwater Ecosystems by using Stable Isotope Analysis.

    Science.gov (United States)

    Zainordin, 'Amila Faqhira; Ab Hamid, Suhaila

    2017-07-01

    Stable isotope analysis has been used extensively to establish trophic relationships in many ecosystems. Present study utilised stable isotope signatures of carbon and nitrogen to identify trophic structure of aquatic food web in river and rice field ecosystems in Perak, northern peninsular Malaysia. The mean δ 13 C values of all producers ranged from -35.29 ± 0.21 to -26.00 ± 0.050‰. The greatest δ 15 N values noted was in zenarchopterid fish with 9.68 ± 0.020‰. The δ 15 N values of aquatic insects ranged between 2.59 ± 0.107 in Elmidae (Coleoptera) and 8.11 ± 0.022‰ in Nepidae (Hemiptera). Correspondingly, with all the δ 13 C and δ 15 N values recorded, it can be deduced that there are four trophic levels existed in the freshwater ecosystems which started with the producer (plants), followed by primary consumer (aquatic insects and non-predatory fish), secondary consumer (invertebrate predators) and lastly tertiary consumer (vertebrate predators).

  4. How Cr changes the dislocation core structure of α-Fe: the role of magnetism.

    Science.gov (United States)

    Zhang, Xu; Lu, Gang

    2013-02-27

    Cr is a critical alloying element in ferritic steels and its effect on the dislocation core structure of α-Fe is examined computationally using a quantum mechanics/molecular mechanics method. We find that Cr can significantly change the dislocation core structure of Fe where magnetism plays a crucial role. The strain-dependent magnetic interaction between Cr and the host Fe atoms is responsible for the dislocation core structure. When Cr is at the tension side of the slip plane, the Cr-Fe magnetic interaction is repulsive, which lowers the dislocation energy and pins the dislocation. When Cr occupies the compression side of the slip plane, the Cr-Fe interaction is attractive which increases the dislocation energy and promotes the dislocation to break away from Cr.

  5. Core-satellite ZnS-Ag nanoassemblies: Synthesis, structure, and optical properties.

    Science.gov (United States)

    Rohani, Parham; Sharma, Munish K; Swihart, Mark T

    2016-02-01

    We synthesized hollow core-satellite nanoassemblies comprised of hollow zinc sulfide (ZnS) shells decorated with silver nanoparticles (Ag NPs). This was achieved by solution-phase attachment of Ag NPs to hollow ZnS nanospheres (NSs) prepared by spray pyrolysis. This produces an aqueous dispersion of ZnS-Ag hybrid structures, 50-500nm in overall diameter. We characterized the nanostructures by scanning electron microscopy (SEM), transmission electron microscopy (TEM), powder X-ray diffraction (XRD), and energy dispersive X-ray spectroscopy (EDX) to elucidate the ZnS (core)-Ag (satellite) morphology and optimize conditions for producing such structures. Optical spectroscopy showed that photoluminescence of ZnS was quenched by Ag while absorbance was enhanced. This work provides a simple and general means of producing hollow core-satellite structures that could be of broad applicability. Copyright © 2015 Elsevier Inc. All rights reserved.

  6. Structure and Properties of Coatings Made with Self Shielded Cored Wire

    Directory of Open Access Journals (Sweden)

    Gucwa M.

    2016-09-01

    Full Text Available The welding technologies are widely used for design of protection layer against wear and corrosion. Hardfacing, which is destined for obtaining coatings with high hardness, takes special place in these technologies. One of the most effective way of hardfacing is using self shielded flux cored arc welding (FCAW-S. Chemical composition obtained in flux cored wire is much more rich in comparison to this obtained in solid wire. The filling in flux cored wires can be enriched for example with the mixture of hard particles or phases with specified ratio, which is not possible for solid wires. This is the reason why flux cored wires give various possibilities of application of this kind of filler material for improving surface in mining industry, processing of minerals, energetic etc. In the present paper the high chromium and niobium flux cored wire was used for hardfacing process with similar heat input. The work presents studies of microstructures of obtained coatings and hardness and geometric properties of them. The structural studies were made with using optical microscopy and X-ray diffraction that allowed for identification of carbides and other phases obtained in the structures of deposited materials. Investigated samples exhibit differences in coating structures made with the same heat input 4,08 kJ/mm. There are differences in size, shape and distribution of primary and eutectic carbides in structure. These differences cause significant changes in hardness of investigated coatings.

  7. Probing atomic structure in magnetic core/shell nanoparticles using synchrotron radiation.

    Science.gov (United States)

    Baker, S H; Roy, M; Thornton, S C; Qureshi, M; Binns, C

    2010-09-29

    Core/shell Fe/Cu and Fe/Au nanoparticles were prepared directly by deposition from the gas phase. A detailed study of the atomic structure in both the cores and shells of the nanoparticles was undertaken by means of extended absorption fine structure (EXAFS) measurements. For Fe/Cu nanoparticles, a Cu shell ∼ 20 monolayers thick appears similar in structure to bulk Cu and is sufficient to cause the structure in the Fe core to switch from body centred cubic (bcc; as in bulk Fe) to face centred cubic. This is not the case for thinner Cu shells, 1-2 monolayers in thickness, in which there is a considerable contraction in nearest-neighbour interatomic distance as the shell structure changes to bcc. In Fe/Au nanoparticles, the crystal structure in the Fe core remains bcc for all Au thicknesses although there is some stretching of the lattice. In thin Au shells ∼ 2 monolayers thick, there is strong contraction in interatomic distances. There does not appear to be significant alloying at the Fe/Au interface.

  8. Green synthesis of the reduced graphene oxide-CuI quasi-shell-core nanocomposite: A highly efficient and stable solar-light-induced catalyst for organic dye degradation in water

    Science.gov (United States)

    Choi, Jiha; Reddy, D. Amaranatha; Islam, M. Jahurul; Seo, Bora; Joo, Sang Hoon; Kim, Tae Kyu

    2015-12-01

    Surfactant-free, reduced graphene oxide (RGO)-CuI quasi-shell-core nanocomposites were successfully synthesized using ultra-sonication assisted chemical method at room temperature. The morphologies, structures and optical properties of the CuI and CuI-RGO nanocomposites were characterized by transmission electron microscopy (TEM), X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), Fourier-transformed infrared spectroscopy (FTIR), UV-visible absorption spectroscopy, and photoluminescence (PL) spectroscopy. Morphological and structural analyses indicated that the CuI-RGO core-shell nanocomposites comprise single-crystalline face-centered cubic phase CuI nanostructures, coated with a thin RGO quasi-shell. Photocatalysis experiments revealed that the as-synthesized CuI-RGO nanocomposites exhibit remarkably enhanced photocatalytic activities and stabilities for photo degradation of Rhodamine-B (RhB) organic dye under simulated solar light irradiation. The photo degradation ability is strongly affected by the concentration of RGO in the nanocomposites; the highest photodegradation rate was obtained at a graphene loading content of 2 mg mL-1 nanocomposite. The remarkable photocatalytic performance of the CuI-RGO nanocomposites mainly originates from their unique adsorption and electron-accepting and electron-transporting properties of RGO. The present work provides a novel green synthetic route to producing CuI-RGO nanocomposites without toxic solvents or reducing agents, thereby providing highly efficient and stable solar light-induced RGO-CuI quasi-shell-core nanocomposites for organic dye photo degradation in water.

  9. Synthesis, structural, optical and photocatalytic properties of CdS/ZnS core/shell nanoparticles

    Science.gov (United States)

    Reddy, Ch. Venkata; Shim, Jaesool; Cho, Migyung

    2017-04-01

    CdS, ZnS and CdS/ZnS core/shell nanoparticles were successfully synthesized via two-step synthesis method. The as-prepared CdS, ZnS and CdS/ZnS core/shell nanoparticles were used to study the structural, morphological, and optical properties by PXRD, TEM, HRTEM, UV-vis spectroscopy, N2 adsorption-desorption, FT-IR, PL and Raman spectroscopy measurements. The XRD pattern confirms the crystal structure of the prepared ZnS, CdS, and CdS/ZnS core/shell nanoparticles. The crystallinity of the as-prepared samples is confirmed by PXRD, TEM and HRTEM analysis. The BET analysis showed that the CdS/ZnS core/shell nanoparticles had larger surface area and pore diameter than CdS and ZnS. The Raman and FT-IR spectra confirm the fundamental vibrational modes of CdS and ZnS respectively. Compared to pure CdS and ZnS, CdS/ZnS core/shell nanoparticles exhibited higher photocatalytic activity for the degradation of methyl orange (MO). The enhancement of photocatalytic activity in the CdS/ZnS core/shell nanoparticles is due to the interface actions between CdS and ZnS, which greatly reduces the recombination of photogenerated electrons-holes pair. The proposed mechanism for degradation of MO dye is discussed in detail.

  10. High-resolution probing of inner core structure with seismic interferometry

    KAUST Repository

    Huang, Hsin-Hua

    2015-12-23

    © 2015. American Geophysical Union. All Rights Reserved. Increasing complexity of Earth\\'s inner core has been revealed in recent decades as the global distribution of seismic stations has improved. The uneven distribution of earthquakes, however, still causes a biased geographical sampling of the inner core. Recent developments in seismic interferometry, which allow for the retrieval of core-sensitive body waves propagating between two receivers, can significantly improve ray path coverage of the inner core. In this study, we apply such earthquake coda interferometry to 1846 USArray stations deployed across the U.S. from 2004 through 2013. Clear inner core phases PKIKP2 and PKIIKP2 are observed across the entire array. Spatial analysis of the differential travel time residuals between the two phases reveals significant short-wavelength variation and implies the existence of strong structural variability in the deep Earth. A linear N-S trending anomaly across the middle of the U.S. may reflect an asymmetric quasi-hemispherical structure deep within the inner core with boundaries of 99°W and 88°E.

  11. Electronic Structure Calculations and Adaptation Scheme in Multi-core Computing Environments

    Energy Technology Data Exchange (ETDEWEB)

    Seshagiri, Lakshminarasimhan; Sosonkina, Masha; Zhang, Zhao

    2009-05-20

    Multi-core processing environments have become the norm in the generic computing environment and are being considered for adding an extra dimension to the execution of any application. The T2 Niagara processor is a very unique environment where it consists of eight cores having a capability of running eight threads simultaneously in each of the cores. Applications like General Atomic and Molecular Electronic Structure (GAMESS), used for ab-initio molecular quantum chemistry calculations, can be good indicators of the performance of such machines and would be a guideline for both hardware designers and application programmers. In this paper we try to benchmark the GAMESS performance on a T2 Niagara processor for a couple of molecules. We also show the suitability of using a middleware based adaptation algorithm on GAMESS on such a multi-core environment.

  12. A graph modification approach for finding core-periphery structures in protein interaction networks.

    Science.gov (United States)

    Bruckner, Sharon; Hüffner, Falk; Komusiewicz, Christian

    2015-01-01

    The core-periphery model for protein interaction (PPI) networks assumes that protein complexes in these networks consist of a dense core and a possibly sparse periphery that is adjacent to vertices in the core of the complex. In this work, we aim at uncovering a global core-periphery structure for a given PPI network. We propose two exact graph-theoretic formulations for this task, which aim to fit the input network to a hypothetical ground truth network by a minimum number of edge modifications. In one model each cluster has its own periphery, and in the other the periphery is shared. We first analyze both models from a theoretical point of view, showing their NP-hardness. Then, we devise efficient exact and heuristic algorithms for both models and finally perform an evaluation on subnetworks of the S. cerevisiae PPI network.

  13. Stable anilinyl radicals coordinated to nickel: X-ray crystal structure and characterization.

    Science.gov (United States)

    Kochem, Amélie; Gellon, Gisèle; Leconte, Nicolas; Baptiste, Benoit; Philouze, Christian; Jarjayes, Olivier; Orio, Maylis; Thomas, Fabrice

    2013-12-02

    Two anilinosalen and a mixed phenol-anilinosalen ligands involving sterically hindered anilines moieties were synthesized. Their nickel(II) complexes 1, 2, and 3 were prepared and characterized. They could be readily one-electron oxidized (E(1/2)=-0.30, -0.26 and 0.10 V vs. Fc(+)/Fc, respectively) into anilinyl radicals species [1](+), [2](+), and [3](+), respectively. The radical complexes are extremely stable and were isolated as single crystals. X-ray crystallographic structures reveal that the changes in bond length resulting from oxidation do not exceed 0.02 Å within the ligand framework in the symmetrical [1](+) and [2](+). No quinoid bond pattern was present. In contrast, larger structural rearrangements were evidenced for the unsymmetrical [3](+), with shortening of one C(ortho)-C(meta) bond. Radical species [1](+) and [2](+) exhibit a strong absorption band at around 6000 cm(-1) (class III mixed valence compounds). This band is significantly less intense than [3](+), consistent with a rather localized anilinyl radical character, and thus a classification of this species as class II mixed-valence compound. Magnetic and electronic properties, as well as structural parameters, have been computed by DFT methods. Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  14. Highly active and stable oxaloacetate decarboxylase Na⁺ pump complex for structural analysis.

    Science.gov (United States)

    Inoue, Michio; Li, Xiaodan

    2015-11-01

    The oxaloacetate decarboxylase primary Na(+) pump (Oad) produces energy for the surviving of some pathogenic bacteria under anaerobic conditions. Oad composes of three subunits: Oad-α, a biotinylated soluble subunit and catalyzes the decarboxylation of oxaloacetate; Oad-β, a transmembrane subunit and functions as a Na(+) pump; and Oad-γ, a single transmembrane α-helical anchor subunit and assembles Oad-α/β/γ complex. The molecular mechanism of Oad complex coupling the exothermic decarboxylation to generate the Na(+) electrochemical gradient remains unsolved. Our biophysical and biochemical studies suggested that the stoichiometry of Oad complex from Vibrio cholerae composed of α, β, γ in 4:2:2 stoichiometry not that of 4:4:4. The high-resolution structure determination of the Oad complex would reveal the energetic transformation mechanism from the catalytical soluble α subunit to membrane β subunit. Sufficient amount stable, conformational homogenous and active Oad complex with the right stoichiometry is the prerequisite for structural analysis. Here we report an easy and reproducible protocol to obtain high quantity and quality Oad complex protein for structural analysis. Copyright © 2015 Elsevier Inc. All rights reserved.

  15. Hierarchical Mesoporous NiO/MnO2@PANI Core-Shell Microspheres, Highly Efficient and Stable Bifunctional Electrocatalysts for Oxygen Evolution and Reduction Reactions.

    Science.gov (United States)

    He, Junkai; Wang, Mingchao; Wang, Wenbo; Miao, Ran; Zhong, Wei; Chen, Sheng-Yu; Poges, Shannon; Jafari, Tahereh; Song, Wenqiao; Liu, Jiachen; Suib, Steven L

    2017-12-13

    We report on the new facile synthesis of mesoporous NiO/MnO 2 in one step by modifying inverse micelle templated UCT (University of Connecticut) methods. The catalyst shows excellent electrocatalytic activity and stability for both the oxygen evolution reaction (OER) and the oxygen reduction reaction (ORR) in alkaline media after further coating with polyaniline (PANI). For electrochemical performance, the optimized catalyst exhibits a potential gap, ΔE, of 0.75 V to achieve a current of 10 mA cm -2 for the OER and -3 mA cm -2 for the ORR in 0.1 M KOH solution. Extensive characterization methods were applied to investigate the structure-property of the catalyst for correlations with activity (e.g., XRD, BET, SEM, HRTEM, FIB-TEM, XPS, TGA, and Raman). The high electrocatalytic activity of the catalyst closely relates to the good electrical conductivity of PANI, accessible mesoporous structure, high surface area, as well as the synergistic effect of the specific core-shell structure. This work opens a new avenue for the rational design of core-shell structure catalysts for energy conversion and storage applications.

  16. An analysis of reactor structural response to fuel sodium interaction in a hypothetical core disruptive accident

    International Nuclear Information System (INIS)

    Suzuki, K.; Tashiro, M.; Sasanuma, K.; Nagashima, K.

    1976-01-01

    This study shows the effect of constraints around FSI zone on FSI phenomena and deformations of reactor structures. SUGAR-PISCES code system has been developed to evaluate the phenomena of FSI and the response of reactor structure. SUGAR calculates the phenomena of FSI. PISCES, developed by Physics International Company in U.S.A., calculates the dynamic response of reactor structure in two-dimensional, time-dependent finite-difference Lagrangian model. The results show that the peak pressure and energy by FSI and the deformation of reactor structures are about twice in case of FSI zone surrounding by blanket than by coolant. The FSI phenomena highly depend on the reactor structure and the realistic configuration around core must be considered for analyzing hypothetical core disruptive accident. This work was supported by a grant from Power Reactor and Nuclear Fuel Development Corporation. (auth.)

  17. The Relationship Between Atomic Structure and Strain Distribution of Misfit Dislocation Cores at Cubic Heteroepitaxial Interfaces.

    Science.gov (United States)

    Wen, Cai

    2017-06-01

    The atomic reconstruction of a misfit dislocation (MD) core causes change in the strain distribution around the core. Several MD cores at the AlSb/GaAs (001) cubic zincblende interface, including a symmetrical glide set Lomer dislocation (LD), a left-displaced glide set LD, a glide set LD with an atomic step, a symmetrical shuffle set LD, and a 60° dislocation pair, were studied using simulated projected potential and aberration-corrected transmission electron microscope images. Image deconvolution was also used to restore structure images from nonoptimum-defocus images. The corresponding biaxial strain maps, ε xx (in-plane) and ε yy (out-of-plane), were obtained by geometric phase analysis using the GaAs substrate as the reference lattice. The results show that atomic structure characteristics of MD cores can be revealed by the strain maps. The strain maps should be measured from optimum-defocus images or restored structure images. Furthermore, the ε xx strain map has been found more accurate than the ε yy strain map for MD cores, and the specimen thickness should be below the critical thickness due to the influence of dynamical scattering.

  18. Synthesis of magnetically separable Sn doped magnetite/silica core-shell structure and photocatalytic property

    International Nuclear Information System (INIS)

    Wang, Wei-Wei; Yao, Jia-Liang

    2010-01-01

    Sn doped Fe 3 O 4 /SiO 2 core-shell structures with the magnetic and photocatalytic properties have been successfully synthesized using Fe 3 O 4 microspheres as the precursor. The morphology, phase and structure of the bifunctional products were investigated by X-ray powder diffraction, transmission electron microscopy, selected-area electron diffraction, high-resolution transmission electron microscopy, energy dispersive spectroscopy, and scanning electron microscopy. The effects of the amount and hydrolysis rate of tetraethyl orthosilicate on the preparation of the Fe 3 O 4 /SiO 2 core-shell structures were investigated. Low concentration and slow hydrolysis rate of tetraethyl orthosilicate were useful to obtain the uniform silica coated Fe 3 O 4 . The magnetic measurements indicated that the Sn doped Fe 3 O 4 /SiO 2 core-shell structures showed ferromagnetic property and the magnetic saturation value slightly decreased after coated the silica layer. The magnetic Sn doped Fe 3 O 4 /SiO 2 core-shell structures exhibited good photocatalytic activity in the degradation of methyl orange and could be separated by applying an appropriate magnetic field.

  19. Fragmentation of massive dense cores down to ≲ 1000 AU: Relation between fragmentation and density structure

    Energy Technology Data Exchange (ETDEWEB)

    Palau, Aina; Girart, Josep M. [Institut de Ciències de l' Espai (CSIC-IEEC), Campus UAB-Facultat de Ciències, Torre C5-parell 2, E-08193 Bellaterra, Catalunya (Spain); Estalella, Robert [Departament d' Astronomia i Meteorologia (IEEC-UB), Institut de Ciències del Cosmos, Universitat de Barcelona, Martí i Franquès, 1, E-08028 Barcelona (Spain); Fuente, Asunción [Observatorio Astronómico Nacional, P.O. Box 112, E-28803 Alcalá de Henares, Madrid (Spain); Fontani, Francesco; Sánchez-Monge, Álvaro [Osservatorio Astrofisico di Arcetri, INAF, Lago E. Fermi 5, I-50125 Firenze (Italy); Commerçon, Benoit; Hennebelle, Patrick [Laboratoire de Radioastronomie, UMR CNRS 8112, École Normale Supérieure et Observatoire de Paris, 24 rue Lhomond, F-75231 Paris Cedex 05 (France); Busquet, Gemma [INAF-Istituto di Astrofisica e Planetologia Spaziali, Area di Recerca di Tor Vergata, Via Fosso Cavaliere 100, I-00133 Roma (Italy); Bontemps, Sylvain [Université de Bordeaux, LAB, UMR 5804, F-33270 Floirac (France); Zapata, Luis A. [Centro de Radioastronomía y Astrofísica, Universidad Nacional Autónoma de México, P.O. Box 3-72, 58090 Morelia, Michoacán (Mexico); Zhang, Qizhou [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Di Francesco, James, E-mail: palau@ieec.uab.es [Department of Physics and Astronomy, University of Victoria, P.O. Box 355, STN CSC, Victoria, BC, V8W 3P6 (Canada)

    2014-04-10

    In order to shed light on the main physical processes controlling fragmentation of massive dense cores, we present a uniform study of the density structure of 19 massive dense cores, selected to be at similar evolutionary stages, for which their relative fragmentation level was assessed in a previous work. We inferred the density structure of the 19 cores through a simultaneous fit of the radial intensity profiles at 450 and 850 μm (or 1.2 mm in two cases) and the spectral energy distribution, assuming spherical symmetry and that the density and temperature of the cores decrease with radius following power-laws. Even though the estimated fragmentation level is strictly speaking a lower limit, its relative value is significant and several trends could be explored with our data. We find a weak (inverse) trend of fragmentation level and density power-law index, with steeper density profiles tending to show lower fragmentation, and vice versa. In addition, we find a trend of fragmentation increasing with density within a given radius, which arises from a combination of flat density profile and high central density and is consistent with Jeans fragmentation. We considered the effects of rotational-to-gravitational energy ratio, non-thermal velocity dispersion, and turbulence mode on the density structure of the cores, and found that compressive turbulence seems to yield higher central densities. Finally, a possible explanation for the origin of cores with concentrated density profiles, which are the cores showing no fragmentation, could be related with a strong magnetic field, consistent with the outcome of radiation magnetohydrodynamic simulations.

  20. Aedes aegypti has spatially structured and seasonally stable populations in Yogyakarta, Indonesia.

    Science.gov (United States)

    Rašić, Gordana; Endersby-Harshman, Nancy; Tantowijoyo, Warsito; Goundar, Anjali; White, Vanessa; Yang, Qiong; Filipović, Igor; Johnson, Petrina; Hoffmann, Ary A; Arguni, Eggi

    2015-12-01

    Dengue fever, the most prevalent global arboviral disease, represents an important public health problem in Indonesia. Control of dengue relies on the control of its main vector, the mosquito Aedes aegypti, yet nothing is known about the population history and genetic structure of this insect in Indonesia. Our aim was to assess the spatio-temporal population genetic structure of Ae. aegypti in Yogyakarta, a densely populated region on Java with common dengue outbreaks. We used multiple marker systems (microsatellites, nuclear and mitochondrial genome-wide single nucleotide polymorphisms generated via Restriction-site Associated DNA sequencing) to analyze 979 Ae. aegypti individuals collected from the Yogyakarta city and the surrounding hamlets during the wet season in 2011 and the following dry season in 2012. We employed individual- and group-based approaches for inferring genetic structure. We found that Ae. aegypti in Yogyakarta has spatially structured and seasonally stable populations. The spatial structuring was significant for the nuclear and mitochondrial markers, while the temporal structuring was non-significant. Nuclear markers identified three main genetic clusters, showing that hamlets have greater genetic isolation from each other and from the inner city sites. However, one hamlet experienced unrestricted mosquito interbreeding with the inner city, forming a single genetic cluster. Genetic distance was poorly correlated with the spatial distance among mosquito samples, suggesting stronger influence of human-assisted gene flow than active mosquito movement on spatial genetic structure. A star-shaped mitochondrial haplotype network and a significant R(2) test statistic (R(2) = 0.0187, P = 0.001) support the hypothesis that Ae. aegypti in Yogyakarta originated from a small or homogeneous source and has undergone a relatively recent demographic expansion. We report the first insights into the spatio-temporal genetic structure and the underlying

  1. A Fundamental Approach to Developing Aluminium based Bulk Amorphous Alloys based on Stable Liquid Metal Structures and Electronic Equilibrium - 154041

    Science.gov (United States)

    2017-03-28

    AFRL-AFOSR-JP-TR-2017-0027 A Fundamental Approach to Developing Aluminium -based Bulk Amorphous Alloys based on Stable Liquid-Metal Structures and...to 16 Dec 2016 4.  TITLE AND SUBTITLE A Fundamental Approach to Developing Aluminium -based Bulk Amorphous Alloys based on Stable Liquid-Metal...Air Force Research Laboratory for accurately predicting compositions of new amorphous alloys specifically based on aluminium with properties superior

  2. Realization of EEC OON strategy for education in the interest of stable development on the regional level (on the example of elaboration of the system of ecological education at non-core educational institution of higher education

    OpenAIRE

    Melnikova, O.

    2011-01-01

    The paper deals with the historical prerequisites of forming EEC OON strategy for education in the interest of stable development. Ecological education in the light of the conception of stable development as an integrating factor of education in general is described. The example of the realization of the strategy on the regional level is given. The topicality of making the system of ecological education at non-core educational institution of higher education is shown.

  3. Magnetic, Structural, and Particle Size Analysis of Single- and Multi-Core Magnetic Nanoparticles

    DEFF Research Database (Denmark)

    Ludwig, Frank; Kazakova, Olga; Barquin, Luis Fernandez

    2014-01-01

    and the results are compared with each other. The presented results primarily focus on determining the particle size—both the hydrodynamic size and the individual magnetic core size—as well as magnetic and structural properties. The used analysis methods include transmission electron microscopy, static...

  4. Structural evaluation for the core sampling trucks, RMCS operations, 200 Area

    International Nuclear Information System (INIS)

    Islam, M.A.

    1996-01-01

    This report evaluates the structural adequacy and the integrity of the existing core sampling trucks to withstand impact should the trucks drop off the ramp, either onto the soft ground or onto a non-yielding surface due to operational error, wind, or earthquake. The report also addresses if the allowable tank dome load will be exceeded by the addition of the impact load

  5. Genetic structure of the rattan Calamus thwaitesii in core, buffer and ...

    Indian Academy of Sciences (India)

    In this paper, we evaluate whether protected areas can serve as refugia for genetic resources of economically important plants that are threatened due to extraction pressures. We examine the population structure and genetic diversity of an economically important rattan, Calamus thwaitesii, in the core, buffer and peripheral ...

  6. A simple approach to the construction of the core structure present

    Indian Academy of Sciences (India)

    A convenient route for the synthesis of oxacyclobutapentalene, the tricyclic bridged core structure present in bioactive marine diterpene bielschowskysin and the polyketide hippolachnin A, is reported. The key steps involve ring closing metathesis of a triene derived from D-mannitol to produce selectively the dihydrofuran ...

  7. Guided wave propagation in a honeycomb composite sandwich structure in presence of a high density core.

    Science.gov (United States)

    Sikdar, Shirsendu; Banerjee, Sauvik

    2016-09-01

    A coordinated theoretical, numerical and experimental study is carried out in an effort to interpret the characteristics of propagating guided Lamb wave modes in presence of a high-density (HD) core region in a honeycomb composite sandwich structure (HCSS). Initially, a two-dimensional (2D) semi-analytical model based on the global matrix method is used to study the response and dispersion characteristics of the HCSS with a soft core. Due to the complex structural characteristics, the study of guided wave (GW) propagation in HCSS with HD-core region inherently poses many challenges. Therefore, a numerical simulation of GW propagation in the HCSS with and without the HD-core region is carried out, using surface-bonded piezoelectric wafer transducer (PWT) network. From the numerical results, it is observed that the presence of HD-core significantly decreases both the group velocity and the amplitude of the received GW signal. Laboratory experiments are then conducted in order to verify the theoretical and numerical results. A good agreement between the theoretical, numerical and experimental results is observed in all the cases studied. An extensive parametric study is also carried out for a range of HD-core sizes and densities in order to study the effect due to the change in size and density of the HD zone on the characteristics of propagating GW modes. It is found that the amplitudes and group velocities of the GW modes decrease with the increase in HD-core width and density. Copyright © 2016 Elsevier B.V. All rights reserved.

  8. Structural and magnetic properties of multi-core nanoparticles analysed using a generalised numerical inversion method

    Science.gov (United States)

    Bender, P.; Bogart, L. K.; Posth, O.; Szczerba, W.; Rogers, S. E.; Castro, A.; Nilsson, L.; Zeng, L. J.; Sugunan, A.; Sommertune, J.; Fornara, A.; González-Alonso, D.; Barquín, L. Fernández; Johansson, C.

    2017-01-01

    The structural and magnetic properties of magnetic multi-core particles were determined by numerical inversion of small angle scattering and isothermal magnetisation data. The investigated particles consist of iron oxide nanoparticle cores (9 nm) embedded in poly(styrene) spheres (160 nm). A thorough physical characterisation of the particles included transmission electron microscopy, X-ray diffraction and asymmetrical flow field-flow fractionation. Their structure was ultimately disclosed by an indirect Fourier transform of static light scattering, small angle X-ray scattering and small angle neutron scattering data of the colloidal dispersion. The extracted pair distance distribution functions clearly indicated that the cores were mostly accumulated in the outer surface layers of the poly(styrene) spheres. To investigate the magnetic properties, the isothermal magnetisation curves of the multi-core particles (immobilised and dispersed in water) were analysed. The study stands out by applying the same numerical approach to extract the apparent moment distributions of the particles as for the indirect Fourier transform. It could be shown that the main peak of the apparent moment distributions correlated to the expected intrinsic moment distribution of the cores. Additional peaks were observed which signaled deviations of the isothermal magnetisation behavior from the non-interacting case, indicating weak dipolar interactions. PMID:28397851

  9. Structural and magnetic properties of multi-core nanoparticles analysed using a generalised numerical inversion method

    Science.gov (United States)

    Bender, P.; Bogart, L. K.; Posth, O.; Szczerba, W.; Rogers, S. E.; Castro, A.; Nilsson, L.; Zeng, L. J.; Sugunan, A.; Sommertune, J.; Fornara, A.; González-Alonso, D.; Barquín, L. Fernández; Johansson, C.

    2017-04-01

    The structural and magnetic properties of magnetic multi-core particles were determined by numerical inversion of small angle scattering and isothermal magnetisation data. The investigated particles consist of iron oxide nanoparticle cores (9 nm) embedded in poly(styrene) spheres (160 nm). A thorough physical characterisation of the particles included transmission electron microscopy, X-ray diffraction and asymmetrical flow field-flow fractionation. Their structure was ultimately disclosed by an indirect Fourier transform of static light scattering, small angle X-ray scattering and small angle neutron scattering data of the colloidal dispersion. The extracted pair distance distribution functions clearly indicated that the cores were mostly accumulated in the outer surface layers of the poly(styrene) spheres. To investigate the magnetic properties, the isothermal magnetisation curves of the multi-core particles (immobilised and dispersed in water) were analysed. The study stands out by applying the same numerical approach to extract the apparent moment distributions of the particles as for the indirect Fourier transform. It could be shown that the main peak of the apparent moment distributions correlated to the expected intrinsic moment distribution of the cores. Additional peaks were observed which signaled deviations of the isothermal magnetisation behavior from the non-interacting case, indicating weak dipolar interactions.

  10. Structural characterization of Pt-Pd core-shell nanoparticles by Cs-corrected STEM

    Energy Technology Data Exchange (ETDEWEB)

    Esparza, R., E-mail: resparza@fata.unam.mx [Universidad Nacional Autonoma de Mexico, Centro de Fisica Aplicada y Tecnologia Avanzada (Mexico); Garcia-Ruiz, Amado F. [UPIICSA-COFAA, Instituto Politecnico Nacional (Mexico); Velazquez Salazar, J. J. [University of Texas at San Antonio, Department of Physics and Astronomy (United States); Perez, R. [Universidad Nacional Autonoma de Mexico, Centro de Fisica Aplicada y Tecnologia Avanzada (Mexico); Jose-Yacaman, M. [The University of Texas at San Antonio, Department of Physics and Astronomy (United States)

    2013-01-15

    Pt-Pd core-shell nanoparticles were synthesized using a modified polyol method. A thermal method under refluxing, carrying on the reaction up to 285 Degree-Sign C, has been performed to reduce metallic salts using ethylene glycol as reducer and poly(N-vinyl-2-pyrrolidone) as protective reagent of the formed bimetallic nanoparticles. According to other works, this type of structure has been studied and utilized to successfully increase the catalytic properties of monometallic nanoparticles Pt or Pd. Core-shell bimetallic nanoparticles were structurally characterized using aberration-corrected scanning transmission electron microscopy (Cs-STEM) equipped with a high-angle annular dark field detector, energy-dispersive X-ray spectrometry (EDS), and electron energy-loss spectroscopy (EELS). The high-resolution elemental line scan and mappings were carried out using a combination of STEM-EDS and STEM-EELS. The obtained results show the growth of the Pd shell on the Pt core with polyhedral morphology. The average size of the bimetallic nanoparticles was 13.5 nm and the average size of the core was 8.5 nm; consequently, the thickness of the shell was around 2.5 nm. The growth of the Pd shell on the Pt core is layer by layer, suggesting a Frank-van der Merwe growth mechanism.

  11. Flexural Behavior of Sandwich Structures Consisting of Corrugated Composite Core with Different Geometries

    Directory of Open Access Journals (Sweden)

    Rahmat Allah Rahmani

    2015-08-01

    Full Text Available An Experimental and numerical study on the flexural behavior of new types of sandwich structures with glass-epoxy skins and a combinatorial core consisting of PVC foam and a corrugated composite was performed. The purpose of inserting a corrugated composite into the core was the reinforcement of the core and so of the sandwich structure without substantial increment in its weight. Samples were prepared by vacuum assisted resin transform molding industrial technique and tested using three-point bending load test according to ASTM C393 and then the load-deflection curves were obtained. The finite element analysis was performed using Abaqus software to determine the maximum deflection of the samples. In order to increase the precision of numerical results, the tensile test was carried out according to ASTM D3039 to obtain the mechanical properties of the skins and corrugated composite. In addition to a reference sample consisting of a simple foam core, three series of samples were prepared, which consisted of corrugated composites, with square, trapezoidal and triangular geometries, inserted in a PVC foam core. For each experiment, three samples were prepared and tested and the data were used as mean values. It was revealed that the highest and lowest increases in flexural stiffness and flexural stiffness-to-weight ratio were obtained for the samples with trapezoidal and triangular geometries, respectively. Finally, the experimental and numerical results were compared and a good agreement was observed in all samples.

  12. High-precision dual-inlet IRMS measurements of the stable isotopes of CO2 and the N2O / CO2 ratio from polar ice core samples

    Directory of Open Access Journals (Sweden)

    T. K. Bauska

    2014-11-01

    Full Text Available An important constraint on mechanisms of past carbon cycle variability is provided by the stable isotopic composition of carbon in atmospheric carbon dioxide (δ13C-CO2 trapped in polar ice cores, but obtaining very precise measurements has proven to be a significant analytical challenge. Here we describe a new technique to determine the δ13C of CO2 at very high precision, as well as measuring the CO2 and N2O mixing ratios. In this method, ancient air is extracted from relatively large ice samples (~400 g with a dry-extraction "ice grater" device. The liberated air is cryogenically purified to a CO2 and N2O mixture and analyzed with a microvolume-equipped dual-inlet IRMS (Thermo MAT 253. The reproducibility of the method, based on replicate analysis of ice core samples, is 0.02‰ for δ13C-CO2 and 2 ppm and 4 ppb for the CO2 and N2O mixing ratios, respectively (1σ pooled standard deviation. Our experiments show that minimizing water vapor pressure in the extraction vessel by housing the grating apparatus in a ultralow-temperature freezer (−60 °C improves the precision and decreases the experimental blank of the method to −0.07 ± 0.04‰. We describe techniques for accurate calibration of small samples and the application of a mass-spectrometric method based on source fragmentation for reconstructing the N2O history of the atmosphere. The oxygen isotopic composition of CO2 is also investigated, confirming previous observations of oxygen exchange between gaseous CO2 and solid H2O within the ice archive. These data offer a possible constraint on oxygen isotopic fractionation during H2O and CO2 exchange below the H2O bulk melting temperature.

  13. Fluid-structure coupled dynamic response of PWR core barrel during LOCA

    International Nuclear Information System (INIS)

    Lu, M.W.; Zhang, Y.G.; Shi, F.

    1991-01-01

    This paper is engaged in the Fluid-Structure Interaction LOCA analysis of the core barrel of PWR. The analysis is performed by a multipurpose computer code SANES. The FSI inside the pressure vessel is treated by a FEM code including some structural and acoustic elements. The transient in the primary loop is solved by a two-phase flow code. Both codes are coupled one another. Some interesting conclusions are drawn. (author)

  14. Thermal Stability of Co-Pt and Co-Au Core-Shell Structured Nanoparticles: Insights from Molecular Dynamics Simulations.

    Science.gov (United States)

    Wen, Yu-Hua; Huang, Rao; Shao, Gui-Fang; Sun, Shi-Gang

    2017-09-07

    Co-Pt and Co-Au core-shell nanoparticles were heated by molecular dynamics simulations to investigate their thermal stability. Two core structures, that is, hcp Co and fcc Co, have been addressed. The results demonstrate that the hcp-fcc phase transition happens in the hcp-Co-core/fcc-Pt-shell nanoparticle, while it is absent in the hcp-Co-core/fcc-Au-shell one. The stacking faults appear in both Pt and Au shells despite different structures of the Co core. The Co core and Pt shell concurrently melt and present an identical melting point in both Co-Pt core-shell nanoparticles. However, typical two-stage melting occurs in both Co-Au core-shell nanoparticles. Furthermore, the Au shell in the hcp-Co-core/fcc-Au-shell nanoparticle exhibits a lower melting point than that in the fcc-Co-core/fcc-Au-shell one, while the melting points are closely equal for both hcp and fcc Co cores. All of these observations suggest that their thermal stability strongly depends on the structure of the core and the element of the shell.

  15. Current status of restoration work for obstacle and upper core structure in reactor vessel of experimental fast reactor 'JOYO'. 2. Replacement of upper core structure

    International Nuclear Information System (INIS)

    Ushiki, Hiroshi; Ito, Hiromichi; Okuda, Eiji; Suzuki, Nobuhiro; Sasaki, Jun; Oota, Katsu; Kawahara, Hirotaka; Takamatsu, Misao; Nagai, Akinori; Okawa, Toshikatsu

    2015-01-01

    In the experimental fast reactor Joyo, it was confirmed that the top of the irradiation test sub-assembly of MARICO-2 (material testing rig with temperature control) had bent onto the in-vessel storage rack as an obstacle and had damaged the upper core structure (UCS) in 2007. As a part of the restoration work, UCS replacement was begun at March 24, 2014 and was completed at December 17. In-vessel repair (including observation) for sodium-cooled fast reactors (SFRs) is distinct from that for light water reactors and necessitates independent development. Application of developed in-vessel repair techniques to operation and maintenance of SFRs enhanced their safety and integrity. There is little UCS replacement experience in the world and this experience and insights, which were accumulated in the replacement work of in-vessel large structure (UCS) used for more than 30 years, are expected to improve the in-vessel repair techniques in SFRs. (author)

  16. Orientation of aromatic residues in amyloid cores: Structural insights into prion fiber diversity

    KAUST Repository

    Reymer, Anna

    2014-11-17

    Structural conversion of one given protein sequence into different amyloid states, resulting in distinct phenotypes, is one of the most intriguing phenomena of protein biology. Despite great efforts the structural origin of prion diversity remains elusive, mainly because amyloids are insoluble yet noncrystalline and therefore not easily amenable to traditional structural-biology methods. We investigate two different phenotypic prion strains, weak and strong, of yeast translation termination factor Sup35 with respect to angular orientation of tyrosines using polarized light spectroscopy. By applying a combination of alignment methods the degree of fiber orientation can be assessed, which allows a relatively accurate determination of the aromatic ring angles. Surprisingly, the strains show identical average orientations of the tyrosines, which are evenly spread through the amyloid core. Small variations between the two strains are related to the local environment of a fraction of tyrosines outside the core, potentially reflecting differences in fibril packing.

  17. Development of visual inspection technology for HTTR core support graphite structure

    International Nuclear Information System (INIS)

    Maruyama, So; Iyoku, Tatsuo; Inagaki, Yoshiyuki; Shiozawa, Shusaku; Masuma, Yoshitaka; Miki, Toshiya.

    1996-01-01

    The Japan Atomic Energy Research Institute is now constructing the High Temperature Engineering Test Reactor (HTTR), which employs a visual inspection of core support graphite structure, as an inservice inspection (ISI). In this inspection, TV camera will be used to investigate the alignment and integrity of the structure. Therefore, the ISI system, a combination of radiation tolerant TV camera and graphic processing system, is developed and examined its detectability and viewing angles using a simulated hot plenum of HTTR, which has artificial defects. As a result of a series of tests, it was confirmed that this system satisfied the requirements and was quite applicable for the ISI system of HTTR core support graphite structure. In addition, further improvement of the system, like a remote control procedure, will be investigated. (author)

  18. Lowering of ground state induced by core-shell structure in strontium titanate

    Science.gov (United States)

    Kiat, J. M.; Hehlen, B.; Anoufa, M.; Bogicevic, C.; Curfs, C.; Boyer, B.; Al-Sabbagh, M.; Porcher, F.; Al-Zein, A.

    2016-04-01

    A new ground state of textbook compound strontium titanate (SrTi O3) is obtained by inducing a specific core-shell structure of the particles. Using a combination of high energy synchrotron and neutron diffraction, we demonstrate a lowering of the ferroelastic ground state towards a new antiferrodistortive phase, accompanied with strong shifts of the critical temperature. This new phase is discussed within the Landau theory and compared with the situation in thin films and during pressure experiments. The crucial competition between particle shape anisotropy, surface tension, and shear strain is analyzed. Inducing a specific core-shell structure is therefore an easy way to tailor structural properties and to stabilize new phases that cannot exist in bulk material, just like film deposition on a substrate.

  19. The influence of inertial waves on the structure of vortex cores

    Science.gov (United States)

    Kozel, Vladimir; Vatistas, Georgios H.; Wang, Jian

    1992-01-01

    The paper reports on numerical results concerning the influence of waves in the hollow core of a liquid vortex produced inside a cylindrical container with a disk rotating at the bottom. The numerical algorithm used was based on the Los Alamos SOLA-VOF algorithm. The computations produced free-surface elevation profiles that agree closely with the experiments. The computed secondary toroidal vortex structures, taking place in the radial-azimuthal plane, and the vortex core wandering during the spin-up process correspond to experimental visualizations. Under prevailing conditions the numerical solutions show that the core surface is modulated by a single or the superposition of waves. In the future, the developed scheme might enable one to construct the state manifold.

  20. Biophysical investigation of type A PutAs reveals a conserved core oligomeric structure.

    Science.gov (United States)

    Korasick, David A; Singh, Harkewal; Pemberton, Travis A; Luo, Min; Dhatwalia, Richa; Tanner, John J

    2017-09-01

    Many enzymes form homooligomers, yet the functional significance of self-association is seldom obvious. Herein, we examine the connection between oligomerization and catalytic function for proline utilization A (PutA) enzymes. PutAs are bifunctional enzymes that catalyze both reactions of proline catabolism. Type A PutAs are the smallest members of the family, possessing a minimal domain architecture consisting of N-terminal proline dehydrogenase and C-terminal l-glutamate-γ-semialdehyde dehydrogenase modules. Type A PutAs form domain-swapped dimers, and in one case (Bradyrhizobium japonicum PutA), two of the dimers assemble into a ring-shaped tetramer. Whereas the dimer has a clear role in substrate channeling, the functional significance of the tetramer is unknown. To address this question, we performed structural studies of four-type A PutAs from two clades of the PutA tree. The crystal structure of Bdellovibrio bacteriovorus PutA covalently inactivated by N-propargylglycine revealed a fold and substrate-channeling tunnel similar to other PutAs. Small-angle X-ray scattering (SAXS) and analytical ultracentrifugation indicated that Bdellovibrio PutA is dimeric in solution, in contrast to the prediction from crystal packing of a stable tetrameric assembly. SAXS studies of two other type A PutAs from separate clades also suggested that the dimer predominates in solution. To assess whether the tetramer of B. japonicum PutA is necessary for catalytic function, a hot spot disruption mutant that cleanly produces dimeric protein was generated. The dimeric variant exhibited kinetic parameters similar to the wild-type enzyme. These results implicate the domain-swapped dimer as the core structural and functional unit of type A PutAs. Proline dehydrogenase (EC 1.5.5.2); l-glutamate-γ-semialdehyde dehydrogenase (EC 1.2.1.88). The atomic coordinates and structure factor amplitudes have been deposited in the Protein Data Bank under accession number 5UR2. The SAXS data have

  1. A stretch of residues within the protease-resistant core is not necessary for prion structure and infectivity.

    Science.gov (United States)

    Munoz-Montesino, Carola; Sizun, Christina; Moudjou, Mohammed; Herzog, Laetitia; Reine, Fabienne; Igel-Egalon, Angelique; Barbereau, Clément; Chapuis, Jérôme; Ciric, Danica; Laude, Hubert; Béringue, Vincent; Rezaei, Human; Dron, Michel

    2017-01-02

    Mapping out regions of PrP influencing prion conversion remains a challenging issue complicated by the lack of prion structure. The portion of PrP associated with infectivity contains the α-helical domain of the correctly folded protein and turns into a β-sheet-rich insoluble core in prions. Deletions performed so far inside this segment essentially prevented the conversion. Recently we found that deletion of the last C-terminal residues of the helix H2 was fully compatible with prion conversion in the RK13-ovPrP cell culture model, using 3 different infecting strains. This was in agreement with preservation of the overall PrP C structure even after removal of up to one-third of this helix. Prions with internal deletion were infectious for cells and mice expressing the wild-type PrP and they retained prion strain-specific characteristics. We thus identified a piece of the prion domain that is neither necessary for the conformational transition of PrP C nor for the formation of a stable prion structure.

  2. In Vitro-Assembled Alphavirus Core-Like Particles Maintain a Structure Similar to That of Nucleocapsid Cores in Mature Virus

    OpenAIRE

    Mukhopadhyay, Suchetana; Chipman, Paul R.; Hong, Eunmee M.; Kuhn, Richard J.; Rossmann, Michael G.

    2002-01-01

    In vitro-assembled core-like particles produced from alphavirus capsid protein and nucleic acid were studied by cryoelectron microscopy. These particles were found to have a diameter of 420 Å with 240 copies of the capsid protein arranged in a T=4 icosahedral surface lattice, similar to the nucleocapsid core in mature virions. However, when the particles were subjected to gentle purification procedures, they were damaged, preventing generation of reliable structural information. Similarly, pu...

  3. THE DEPENDENCE OF PRESTELLAR CORE MASS DISTRIBUTIONS ON THE STRUCTURE OF THE PARENTAL CLOUD

    International Nuclear Information System (INIS)

    Parravano, Antonio; Sánchez, Néstor; Alfaro, Emilio J.

    2012-01-01

    The mass distribution of prestellar cores is obtained for clouds with arbitrary internal mass distributions using a selection criterion based on the thermal and turbulent Jeans mass and applied hierarchically from small to large scales. We have checked this methodology by comparing our results for a log-normal density probability distribution function with the theoretical core mass function (CMF) derived by Hennebelle and Chabrier, namely a power law at large scales and a log-normal cutoff at low scales, but our method can be applied to any mass distributions representing a star-forming cloud. This methodology enables us to connect the parental cloud structure with the mass distribution of the cores and their spatial distribution, providing an efficient tool for investigating the physical properties of the molecular clouds that give rise to the prestellar core distributions observed. Simulated fractional Brownian motion (fBm) clouds with the Hurst exponent close to the value H = 1/3 give the best agreement with the theoretical CMF derived by Hennebelle and Chabrier and Chabrier's system initial mass function. Likewise, the spatial distribution of the cores derived from our methodology shows a surface density of companions compatible with those observed in Trapezium and Ophiucus star-forming regions. This method also allows us to analyze the properties of the mass distribution of cores for different realizations. We found that the variations in the number of cores formed in different realizations of fBm clouds (with the same Hurst exponent) are much larger than the expected root N statistical fluctuations, increasing with H.

  4. Exploration of stable compounds, crystal structures, and superconductivity in the Be-H system

    Directory of Open Access Journals (Sweden)

    Shuyin Yu

    2014-10-01

    Full Text Available Using first-principles variable-composition evolutionary methodology, we explored the high-pressure structures of beryllium hydrides between 0 and 400 GPa. We found that BeH2 remains the only stable compound in this pressure range. The pressure-induced transformations are predicted as I b a m → P 3 ̄ m 1 → R 3 ̄ m → C m c m → P 4 / n m m , which occur at 24, 139, 204 and 349 GPa, respectively. P 3 ̄ m 1 and R 3 ̄ m structures are layered polytypes based on close packings of H atoms with Be atoms filling all octahedral voids in alternating layers. Cmcm and P4/nmm contain two-dimensional triangular networks with each layer forming a kinked slab in the ab-plane. P 3 ̄ m 1 and R 3 ̄ m are semiconductors while Cmcm and P4/nmm are metallic. We have explored superconductivity of both metal phases, and found large electron-phonon coupling parameters of λ = 0.63 for Cmcm with a Tc of 32.1-44.1 K at 250 GPa and λ = 0.65 for P4/nmm with a Tc of 46.1-62.4 K at 400 GPa. The dependence of Tc on pressure indicates that Tc initially increases to a maximum of 45.1 K for Cmcm at 275 GPa and 97.0 K for P4/nmm at 365 GPa, and then decreases with increasing pressure for both phases.

  5. Analysis of Chemical Bonding and Structural Network of Gold Silicide in Core-Shell Silicon Nanowire

    Science.gov (United States)

    Swain, Bibhu P.; Swain, Bhabani S.

    2018-02-01

    The Au-catalyzed core-shell silicon nanowires (Si-NWs) were synthesized by chemical vapor deposition by using SiH4 and H2 precursor gases. The TEM and FTIR studies revealed that the Si-NWs consist of core silicon surrounded by a thick oxide sheath and Au distributed at the a-SiOx/Si interface. The x-ray photoelectron spectroscopy (XPS) was used to study the chemical composition and electronic environments of gold silicide in the a-SiO x /Si-NWs. The elemental analysis and chemical network of gold silicide of core-shell Si-NWs were explained on the basis of the random atomic distribution of Si, O and Au atoms. The Raman spectra and XRD peak reveal the crystalline core of Si-NWs. The individual contribution to the Au (4d) core orbital was deconvoluted to Au-Si-Au, Au-Si-O, Au-Au, Au-O-Au, Au-O-Si and Au=O/Au-O2 bonding structure. The analysis shows that the O linked with Si and Au has also contributed to growth of Si-NWs.

  6. Temperature and Size Dependence of Characteristic Hydrogen-Bonded Network Structures with Ion Core Switching in Protonated (Methanol)6-10-(Water)1Mixed Clusters: A Revisit.

    Science.gov (United States)

    Katada, Marusu; Hsu, Po-Jen; Fujii, Asuka; Kuo, Jer-Lai

    2017-07-27

    Hydrogen-bonded network structures and preferential ion core in the protonated methanol-water mixed clusters, H + (methanol) n -(water) 1 (n = 6-10), were explored by a combination of infrared spectroscopy and theoretical calculations. Infrared spectra of the OH stretch region of the clusters were measured at the two different temperature ranges by using Ar-tagging. Stable isomer structures of the clusters were searched by the multiscale modeling approach and temperature dependent infrared spectra were simulated based on the statistical populations of the isomers. The combined experimental and theoretical studies revealed that the characteristic multiring structures begin to form at n = 7 under the low temperature condition and they are preferential at the wide temperature range in n ≥ 8. It was also demonstrated that the preferential ion core type changes from methanol (MeOH 2 + ) to water (H 3 O + ) with increasing cluster size. In n ≤ 8, the observed infrared spectral features partly depend on the monitoring vibrational predissociation channel, and weak correlations between the hydrogen-bonded network structure and preferential dissociation channels were suggested. However, the ion core type does not necessarily correlate to the preferential dissociation channel. This implies that large rearrangement of the hydrogen-bonded network structure occurs prior to the dissociation.

  7. More Than Filaments and Cores: Statistical Study of Structure Formation and Dynamics in Nearby Molecular Clouds

    Science.gov (United States)

    Chen, How-Huan; Goodman, Alyssa

    2018-01-01

    In the past decade, multiple attempts at understanding the connection between filaments and star forming cores have been made using observations across the entire epectrum. However, the filaments and the cores are usually treated as predefined--and well-defined--entities, instead of structures that often come at different sizes, shapes, with substantially different dynamics, and inter-connected at different scales. In my dissertation, I present an array of studies using different statistical methods, including the dendrogram and the probability distribution function (PDF), of structures at different size scales within nearby molecular clouds. These structures are identified using observations of different density tracers, and where possible, in the multi-dimensional parameter space of key dynamic properties--the LSR velocity, the velocity dispersion, and the column density. The goal is to give an overview of structure formation in nearby star-forming clouds, as well as of the dynamics in these structures. I find that the overall statistical properties of a larger structure is often the summation/superposition of sub-structures within, and that there could be significant variations due to local physical processes. I also find that the star formation process within molecular clouds could in fact take place in a non-monolithic manner, connecting potentially merging and/or transient structures, at different scales.

  8. A novel approach to preparing magnetic protein microspheres with core-shell structure

    Energy Technology Data Exchange (ETDEWEB)

    Jiang Wei, E-mail: climentjw@126.co [National Special Superfine Powder Engineering Research Center, Nanjing University of Science and Technology, Nanjing 210094 (China); Sun Zhendong; Li Fengsheng [National Special Superfine Powder Engineering Research Center, Nanjing University of Science and Technology, Nanjing 210094 (China); Chen Kai; Liu Tianyu; Liu Jialing [Department of Physics, Nanjing University of Science and Technology, Nanjing 210094 (China); Zhou Tianle [Department of Materials Science and Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Guo Rui [Department of Mechanical Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China)

    2011-03-15

    Magnetic protein microspheres with core-shell structure were prepared through a novel approach based on the sonochemical method and the emulsion solvent evaporation method. The microspheres are composed of the oleic acid and undecylenic acid modified Fe{sub 3}O{sub 4} cores and coated with globular bovine serum albumin (BSA). Under an optimized condition, up to 57.8 wt% of approximately 10 nm superparamagnetic Fe{sub 3}O{sub 4} nanoparticles could be uniformly encapsulated into the BSA microspheres with the diameter of approximately 160 nm and the high saturation magnetization of 38.5 emu/g, besides of the abundant functional groups. The possible formation mechanism of magnetic microspheres was discussed in detail. - Research Highlights: Magnetic protein microspheres with core-shell structure were prepared through a novel approach based on the sonochemical method and the emulsion solvent evaporation method. The microspheres are composed of the oleic acid and undecylenic acid modified Fe{sub 3}O{sub 4} cores and coated with globular bovine serum albumin (BSA). 57.8 wt% of approximately 10 nm superparamagnetic Fe{sub 3}O{sub 4} nanoparticles could be uniformly encapsulated into the BSA microspheres with the diameter of approximately 160 nm and the high saturation magnetization of 38.5 emu/g, besides the abundant functional groups.

  9. A novel approach to preparing magnetic protein microspheres with core-shell structure

    International Nuclear Information System (INIS)

    Jiang Wei; Sun Zhendong; Li Fengsheng; Chen Kai; Liu Tianyu; Liu Jialing; Zhou Tianle; Guo Rui

    2011-01-01

    Magnetic protein microspheres with core-shell structure were prepared through a novel approach based on the sonochemical method and the emulsion solvent evaporation method. The microspheres are composed of the oleic acid and undecylenic acid modified Fe 3 O 4 cores and coated with globular bovine serum albumin (BSA). Under an optimized condition, up to 57.8 wt% of approximately 10 nm superparamagnetic Fe 3 O 4 nanoparticles could be uniformly encapsulated into the BSA microspheres with the diameter of approximately 160 nm and the high saturation magnetization of 38.5 emu/g, besides of the abundant functional groups. The possible formation mechanism of magnetic microspheres was discussed in detail. - Research Highlights: → Magnetic protein microspheres with core-shell structure were prepared through a novel approach based on the sonochemical method and the emulsion solvent evaporation method.→ The microspheres are composed of the oleic acid and undecylenic acid modified Fe 3 O 4 cores and coated with globular bovine serum albumin (BSA).→ 57.8 wt% of approximately 10 nm superparamagnetic Fe 3 O 4 nanoparticles could be uniformly encapsulated into the BSA microspheres with the diameter of approximately 160 nm and the high saturation magnetization of 38.5 emu/g, besides the abundant functional groups.

  10. Low-Velocity Impact Behavior of Sandwich Structures with Additively Manufactured Polymer Lattice Cores

    Science.gov (United States)

    Turner, Andrew J.; Al Rifaie, Mohammed; Mian, Ahsan; Srinivasan, Raghavan

    2018-04-01

    Sandwich panel structures are widely used in aerospace, marine, and automotive applications because of their high flexural stiffness, strength-to-weight ratio, good vibration damping, and low through-thickness thermal conductivity. These structures consist of solid face sheets and low-density cellular core structures, which are traditionally based upon honeycomb folded-sheet topologies. The recent advances in additive manufacturing (AM) or 3D printing process allow lattice core configurations to be designed with improved mechanical properties. In this work, the sandwich core is comprised of lattice truss structures (LTS). Two different LTS designs are 3D-printed using acrylonitrile butadiene styrene (ABS) and are tested under low-velocity impact loads. The absorption energy and the failure mechanisms of lattice cells under such loads are investigated. The differences in energy-absorption capabilities are captured by integrating the load-displacement curve found from the impact response. It is observed that selective placement of vertical support struts in the unit-cell results in an increase in the absorption energy of the sandwich panels.

  11. Dynamic reorganization of chromatin structure and selective DNA demethylation prior to stable enhancer complex formation during differentiation of primary hematopoietic cells in vitro.

    Science.gov (United States)

    Tagoh, Hiromi; Melnik, Svitlana; Lefevre, Pascal; Chong, Suyinn; Riggs, Arthur D; Bonifer, Constanze

    2004-04-15

    In order to gain insights in the true molecular mechanisms involved in cell fate decisions, it is important to study the molecular details of gene activation where such decisions occur, which is at the level of the chromatin structure of individual genes. In the study presented here we addressed this issue and examined the dynamic development of an active chromatin structure at the chicken lysozyme locus during the differentiation of primary myeloid cells from transgenic mouse bone marrow. Using in vivo footprinting we found that stable enhancer complex assembly and high-level gene expression are late events in cell differentiation. However, even before the onset of gene expression and stable transcription factor binding, specific chromatin alterations are observed. This includes changes in DNA topology and the selective demethylation of CpG dinucleotides located in the cores of critical transcription factor binding sites, but not in flanking DNA. These results firmly support the idea that epigenetic programs guiding blood cell differentiation are engraved into the chromatin of lineage-specific genes and that such chromatin changes are implemented before cell lineage specification.

  12. Efficient Design and Analysis of Lightweight Reinforced Core Sandwich and PRSEUS Structures

    Science.gov (United States)

    Bednarcyk, Brett A.; Yarrington, Phillip W.; Lucking, Ryan C.; Collier, Craig S.; Ainsworth, James J.; Toubia, Elias A.

    2012-01-01

    Design, analysis, and sizing methods for two novel structural panel concepts have been developed and incorporated into the HyperSizer Structural Sizing Software. Reinforced Core Sandwich (RCS) panels consist of a foam core with reinforcing composite webs connecting composite facesheets. Boeing s Pultruded Rod Stitched Efficient Unitized Structure (PRSEUS) panels use a pultruded unidirectional composite rod to provide axial stiffness along with integrated transverse frames and stitching. Both of these structural concepts are ovencured and have shown great promise applications in lightweight structures, but have suffered from the lack of efficient sizing capabilities similar to those that exist for honeycomb sandwich, foam sandwich, hat stiffened, and other, more traditional concepts. Now, with accurate design methods for RCS and PRSEUS panels available in HyperSizer, these concepts can be traded and used in designs as is done with the more traditional structural concepts. The methods developed to enable sizing of RCS and PRSEUS are outlined, as are results showing the validity and utility of the methods. Applications include several large NASA heavy lift launch vehicle structures.

  13. Effect of Fuel Structure Materials on Radiation Source Term in Reactor Core Meltdown

    International Nuclear Information System (INIS)

    Jeong, Hae Sun; Ha, Kwang Soon

    2014-01-01

    The fission product (Radiation Source) releases from the reactor core into the containment is obligatorily evaluated to guarantee the safety of Nuclear Power Plant (NPP) under the hypothetical accident involving a core meltdown. The initial core inventory is used as a starting point of all radiological consequences and effects on the subsequent results of accident assessment. Hence, a proper evaluation for the inventory can be regarded as one of the most important part over the entire procedure of accident analysis. The inventory of fission products is typically evaluated on the basis of the uranium material (e.g., UO2 and USi2) loaded in nuclear fuel assembly, except for the structure materials such as the end fittings, grids, and some kinds of springs. However, the structure materials are continually activated by the neutrons generated from the nuclear fission, and some nuclides of them (e.g., 14 C and 60 Co) can significantly influence on accident assessment. During the severe core accident, the structure components can be also melted with the melting points of temperature relatively lower than uranium material. A series of the calculation were performed by using ORIGEN-S module in SCALE 6.1 package code system. The total activity in each part of structure materials was specifically analyzed from these calculations. The fission product inventory is generally evaluated based on the uranium materials of fuel only, even though the structure components of the assembly are continually activated by the neutrons generated from the nuclear fission. In this study, the activation calculation of the fuel structure materials was performed for the initial source term assessment in the accident of reactor core meltdown. As a result, the lower end fitting and the upper plenum greatly contribute to the total activity except for the cladding material. The nuclides of 56 Mn, '5 1 Cr, 55 Fe, 58 Co, 54 Mn, and 60 Co are analyzed to mainly effect on the activity. This result

  14. Core-Cone Structured Monodispersed Mesoporous Silica Nanoparticles with Ultra-large Cavity for Protein Delivery.

    Science.gov (United States)

    Xu, Chun; Yu, Meihua; Noonan, Owen; Zhang, Jun; Song, Hao; Zhang, Hongwei; Lei, Chang; Niu, Yuting; Huang, Xiaodan; Yang, Yannan; Yu, Chengzhong

    2015-11-25

    A new type of monodispersed mesoporous silica nanoparticles with a core-cone structure (MSN-CC) has been synthesized. The large cone-shaped pores are formed by silica lamellae closely packed encircling a spherical core, showing a structure similar to the flower dahlia. MSN-CC has a large pore size of 45 nm and a high pore volume of 2.59 cm(3) g(-1). MSN-CC demonstrates a high loading capacity of large proteins and successfully delivers active β-galactosidase into cells, showing their potential as efficient nanocarriers for the cellular delivery of proteins with large molecular weights. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  15. Standard Test Method for Water Absorption of Core Materials for Structural Sandwich Constructions

    CERN Document Server

    American Society for Testing and Materials. Philadelphia

    2001-01-01

    1.1 This test method covers the determination of the relative amount of water absorption by various types of structural core materials when immersed or in a high relative humidity environment. This test method is intended to apply to only structural core materials; honeycomb, foam, and balsa wood. 1.2 The values stated in SI units are to be regarded as the standard. The inch-pound units given may be approximate. This standard does not purport to address all of the safety concerns, if any, associated with its use. It is the responsibility of the user of this standard to establish appropriate safety and health practices and determine the applicability of regulatory limitations prior to use.

  16. Cryo-EM Structure of the TOM Core Complex from Neurospora crassa.

    Science.gov (United States)

    Bausewein, Thomas; Mills, Deryck J; Langer, Julian D; Nitschke, Beate; Nussberger, Stephan; Kühlbrandt, Werner

    2017-08-10

    The TOM complex is the main entry gate for protein precursors from the cytosol into mitochondria. We have determined the structure of the TOM core complex by cryoelectron microscopy (cryo-EM). The complex is a 148 kDa symmetrical dimer of ten membrane protein subunits that create a shallow funnel on the cytoplasmic membrane surface. In the core of the dimer, the β-barrels of the Tom40 pore form two identical preprotein conduits. Each Tom40 pore is surrounded by the transmembrane segments of the α-helical subunits Tom5, Tom6, and Tom7. Tom22, the central preprotein receptor, connects the two Tom40 pores at the dimer interface. Our structure offers detailed insights into the molecular architecture of the mitochondrial preprotein import machinery. Copyright © 2017 Elsevier Inc. All rights reserved.

  17. Crystal Structure of the Protease-Resistant Core Domain of Yersinia Pestis Virulence Factor Yopr

    Energy Technology Data Exchange (ETDEWEB)

    Schubot,F.; Cherry, S.; Austin, B.; Tropea, J.; Waugh, D.

    2005-01-01

    Yersinia pestis, the causative agent of the plague, employs a type III secretion system (T3SS) to secrete and translocate virulence factors into the cytoplasm of mammalian host cells. One of the secreted virulence factors is YopR. Little is known about the function of YopR other than that it is secreted into the extracellular milieu during the early stages of infection and that it contributes to virulence. Hoping to gain some insight into the function of YopR, we determined the crystal structure of its protease-resistant core domain, which consists of residues 38--149 out of 165 amino acids. The core domain is composed of five {alpha}-helices that display unexpected structural similarity with one domain of YopN, a central regulator of type III secretion in Y. pestis. This finding raises the possibility that YopR may play a role in the regulation of type III secretion.

  18. Study of thermal diffusivity of nanofluids with bimetallic nanoparticles with Au(core)/Ag(shell) structure

    International Nuclear Information System (INIS)

    Gutierrez Fuentes, R.; Pescador Rojas, J.A.; Jimenez-Perez, J.L.; Sanchez Ramirez, J.F.; Cruz-Orea, A.; Mendoza-Alvarez, J.G.

    2008-01-01

    The thermal diffusivity of Au/Ag nanoparticles with core/shell structure, at different compositions (Au/Ag = 3/1, 1/1, 1/3, 1/6), was measured by using the mismatched mode of the dual-beam thermal lens (TL) technique. This study determines the effect of the bimetallic composition on the thermal diffusivity of the nanofluids. In these results we find a lineal increment of the nanofluid it thermal diffusivity when the Ag shell thickness is increased. Our results show that the nanoparticle structure is an important parameter to improve the heat transport in composites and nanofluids. These results could have importance for applications in therapies and photothermal deliberation of drugs. Complementary measurements with UV-vis spectroscopy and TEM, were used to characterize the Au(core)/Ag(shell) nanoparticles

  19. Core-Shell Structure in Doped Inorganic Nanoparticles: Approaches for Optimizing Luminescence Properties

    Directory of Open Access Journals (Sweden)

    Dini Xie

    2013-01-01

    Full Text Available Doped inorganic luminescent nanoparticles (NPs have been widely used in both research and application fields due to their distinctive properties. However, there is an urgent demand to improve their luminescence efficiency, which is greatly reduced by surface effects. In this paper, we review recent advances in optimizing luminescence properties of doped NPs based on core-shell structure, which are basically classified into two categories: one is by use of surface coating with nonmetal materials to weaken the influence of surface effect and the other is with metal shell via metal enhanced luminescence. Different materials used to coat NPs are surveyed, and their advantages and disadvantages are both commented on. Moreover, problems in current core-shell structured luminescent NPs are pointed out and strategies furthering the optimization of luminescence properties are suggested.

  20. Organic-Inorganic Hydrophobic Nanocomposite Film with a Core-Shell Structure

    Directory of Open Access Journals (Sweden)

    Peng Liu

    2016-12-01

    Full Text Available A method to prepare novel organic-inorganic hydrophobic nanocomposite films was proposed by a site-specific polymerization process. The inorganic part, the core of the nanocomposite, is a ternary SiO2–Al2O3–TiO2 nanoparticles, which is grafted with methacryloxy propyl trimethoxyl silane (KH570, and wrapped by fluoride and siloxane polymers. The synthesized samples are characterized by transmission electron microscopy (TEM, Fourier transform infrared (FTIR spectrscopy, X-ray diffractometry (XRD, contact angle meter (CA, and scanning electron microscope (SEM. The results indicate that the novel organic-inorganic hydrophobic nanocomposite with a core-shell structure was synthesized successfully. XRD analysis reveals the nanocomposite film has an amorphous structure, and FTIR analysis indicates the nanoparticles react with a silane coupling agent (methacryloxy propyl trimethoxyl silane KH570. Interestingly, the morphology of the nanoparticle film is influenced by the composition of the core. Further, comparing with the film synthesized by silica nanoparticles, the film formed from SiO2–Al2O3–TiO2 nanoparticles has higher hydrophobic performance, i.e., the contact angle is greater than 101.7°. In addition, the TEM analysis reveals that the crystal structure of the particles can be changed at high temperatures.

  1. Structure of Protein Phosphatase 2A Core Enzyme Bound to Tumor-Inducing Toxins

    Energy Technology Data Exchange (ETDEWEB)

    Xing,Y.; Xu, Y.; Chen, Y.; Jeffrey, P.; Chao, Y.; Lin, Z.; Li, Z.; Strack, S.; Stock, J.; Shi, Y.

    2006-01-01

    The serine/threonine phosphatase protein phosphatase 2A (PP2A) plays an essential role in many aspects of cellular functions and has been shown to be an important tumor suppressor. The core enzyme of PP2A comprises a 65 kDa scaffolding subunit and a 36 kDa catalytic subunit. Here we report the crystal structures of the PP2A core enzyme bound to two of its inhibitors, the tumor-inducing agents okadaic acid and microcystin-LR, at 2.6 and 2.8 {angstrom} resolution, respectively. The catalytic subunit recognizes one end of the elongated scaffolding subunit by interacting with the conserved ridges of HEAT repeats 11-15. Formation of the core enzyme forces the scaffolding subunit to undergo pronounced structural rearrangement. The scaffolding subunit exhibits considerable conformational flexibility, which is proposed to play an essential role in PP2A function. These structures, together with biochemical analyses, reveal significant insights into PP2A function and serve as a framework for deciphering the diverse roles of PP2A in cellular physiology.

  2. Identification of Protein Complexes Using Weighted PageRank-Nibble Algorithm and Core-Attachment Structure.

    Science.gov (United States)

    Peng, Wei; Wang, Jianxin; Zhao, Bihai; Wang, Lusheng

    2015-01-01

    Protein complexes play a significant role in understanding the underlying mechanism of most cellular functions. Recently, many researchers have explored computational methods to identify protein complexes from protein-protein interaction (PPI) networks. One group of researchers focus on detecting local dense subgraphs which correspond to protein complexes by considering local neighbors. The drawback of this kind of approach is that the global information of the networks is ignored. Some methods such as Markov Clustering algorithm (MCL), PageRank-Nibble are proposed to find protein complexes based on random walk technique which can exploit the global structure of networks. However, these methods ignore the inherent core-attachment structure of protein complexes and treat adjacent node equally. In this paper, we design a weighted PageRank-Nibble algorithm which assigns each adjacent node with different probability, and propose a novel method named WPNCA to detect protein complex from PPI networks by using weighted PageRank-Nibble algorithm and core-attachment structure. Firstly, WPNCA partitions the PPI networks into multiple dense clusters by using weighted PageRank-Nibble algorithm. Then the cores of these clusters are detected and the rest of proteins in the clusters will be selected as attachments to form the final predicted protein complexes. The experiments on yeast data show that WPNCA outperforms the existing methods in terms of both accuracy and p-value. The software for WPNCA is available at "http://netlab.csu.edu.cn/bioinfomatics/weipeng/WPNCA/download.html".

  3. Insert Design and Manufacturing for Foam-Core Composite Sandwich Structures

    Science.gov (United States)

    Lares, Alan

    Sandwich structures have been used in the aerospace industry for many years. The high strength to weight ratios that are possible with sandwich constructions makes them desirable for airframe applications. While sandwich structures are effective at handling distributed loads such as aerodynamic forces, they are prone to damage from concentrated loads at joints or due to impact. This is due to the relatively thin face-sheets and soft core materials typically found in sandwich structures. Carleton University's Uninhabited Aerial Vehicle (UAV) Project Team has designed and manufactured a UAV (GeoSury II Prototype) which features an all composite sandwich structure fuselage structure. The purpose of the aircraft is to conduct geomagnetic surveys. The GeoSury II Prototype serves as the test bed for many areas of research in advancing UAV technologies. Those areas of research include: low cost composite materials manufacturing, geomagnetic data acquisition, obstacle detection, autonomous operations and magnetic signature control. In this thesis work a methodology for designing and manufacturing inserts for foam-core sandwich structures was developed. The results of this research work enables a designer wishing to design a foam-core sandwich airframe structure, a means of quickly manufacturing optimized inserts for the safe introduction of discrete loads into the airframe. The previous GeoSury II Prototype insert designs (v.1 & v.2) were performance tested to establish a benchmark with which to compare future insert designs. Several designs and materials were considered for the new v.3 inserts. A plug and sleeve design was selected, due to its ability to effectively transfer the required loads to the sandwich structure. The insert material was chosen to be epoxy, reinforced with chopped carbon fibre. This material was chosen for its combination of strength, low mass and also compatibility with the face-sheet material. The v.3 insert assembly is 60% lighter than the

  4. An explication of the Graphite Structural Design Code of core components for the High Temperature Engineering Test Reactor

    International Nuclear Information System (INIS)

    Iyoku, Tatsuo; Ishihara, Masahiro; Toyota, Junji; Shiozawa, Shusaku

    1991-05-01

    The integrity evaluation of the core graphite components for the High Temperature Engineering Test Reactor (HTTR) will be carried out based upon the Graphite Structural Design Code for core components. In the application of this design code, it is necessary to make clear the basic concept to evaluate the integrity of core components of HTTR. Therefore, considering the detailed design of core graphite structures such as fuel graphite blocks, etc. of HTTR, this report explicates the design code in detail about the concepts of stress and fatigue limits, integrity evaluation method of oxidized graphite components and thermal irradiation stress analysis method etc. (author)

  5. Water-resistant, monodispersed and stably luminescent CsPbBr3/CsPb2Br5 core-shell-like structure lead halide perovskite nanocrystals

    Science.gov (United States)

    Qiao, Bo; Song, Pengjie; Cao, Jingyue; Zhao, Suling; Shen, Zhaohui; Gao, Di; Liang, Zhiqin; Xu, Zheng; Song, Dandan; Xu, Xurong

    2017-11-01

    Lead halide perovskite materials are thriving in optoelectronic applications due to their excellent properties, while their instability due to the fact that they are easily hydrolyzed is still a bottleneck for their potential application. In this work, water-resistant, monodispersed and stably luminescent cesium lead bromine perovskite nanocrystals coated with CsPb2Br5 were obtained using a modified non-stoichiometric solution-phase method. CsPb2Br5 2D layers were coated on the surface of CsPbBr3 nanocrystals and formed a core-shell-like structure in the synthetic processes. The stability of the luminescence of the CsPbBr3 nanocrystals in water and ethanol atmosphere was greatly enhanced by the photoluminescence-inactive CsPb2Br5 coating with a wide bandgap. The water-stable enhanced nanocrystals are suitable for long-term stable optoelectronic applications in the atmosphere.

  6. Effect of Ni Core Structure on the Electrocatalytic Activity of Pt-Ni/C in Methanol Oxidation

    Science.gov (United States)

    Kang, Jian; Wang, Rongfang; Wang, Hui; Liao, Shijun; Key, Julian; Linkov, Vladimir; Ji, Shan

    2013-01-01

    Methanol oxidation catalysts comprising an outer Pt-shell with an inner Ni-core supported on carbon, (Pt-Ni/C), were prepared with either crystalline or amorphous Ni core structures. Structural comparisons of the two forms of catalyst were made using transmission electron microscopy (TEM), X-ray diffraction (XRD) and X-ray photoelectron spectroscopy (XPS), and methanol oxidation activity compared using CV and chronoamperometry (CA). While both the amorphous Ni core and crystalline Ni core structures were covered by similar Pt shell thickness and structure, the Pt-Ni(amorphous)/C catalyst had higher methanol oxidation activity. The amorphous Ni core thus offers improved Pt usage efficiency in direct methanol fuel cells. PMID:28811402

  7. Effect of Ni Core Structure on the Electrocatalytic Activity of Pt-Ni/C in Methanol Oxidation

    Directory of Open Access Journals (Sweden)

    Vladimir Linkov

    2013-07-01

    Full Text Available Methanol oxidation catalysts comprising an outer Pt-shell with an inner Ni-core supported on carbon, (Pt-Ni/C, were prepared with either crystalline or amorphous Ni core structures. Structural comparisons of the two forms of catalyst were made using transmission electron microscopy (TEM, X-ray diffraction (XRD and X-ray photoelectron spectroscopy (XPS, and methanol oxidation activity compared using CV and chronoamperometry (CA. While both the amorphous Ni core and crystalline Ni core structures were covered by similar Pt shell thickness and structure, the Pt-Ni(amorphous/C catalyst had higher methanol oxidation activity. The amorphous Ni core thus offers improved Pt usage efficiency in direct methanol fuel cells.

  8. Structural studies on the glucose-heptose region of the Proteus mirabilis R core.

    Science.gov (United States)

    Radziejewska-Lebrecht, J; Feige, U; Jensen, M; Kotełko, K; Friebolin, H; Mayer, H

    1980-01-01

    Methylation analysis of the core oligosaccharide of the Proteus mirabilis mutant R4 (derived from serotype 028 was carried out in order to obtain information on the internal (glucose-heptose) region of the P. mirabilis R core. The isolated core oligosaccharide was composed of glucose, L-glycero-D-manno-heptose, 3-deoxy-D-manno-octulosonic acid (dOclA) and phosphorus in a molar ratio of about 1:2:1:1.4. It was methylated either directly or after dephosphorylation. To localize the position of the phosphate substituents, the permethylated product was dephosphorylated with hydrogen fluoride and the oligosaccharide obtained was remethylated using C2H3I. Location of phosphate at C-7 of the terminal heptose was shown by isolation of the sugar phosphate from partial hydrolysates and gas-liquid chromatography/mass spectrometry of the permethylated product. Combining the data of the methylation analysis with the data of an NMR study allows one to formulate the structure of the core oligosaccharide as folllows: (formula: see text).

  9. Strain-induced structural defects and their effects on the electrochemical performances of silicon core/germanium shell nanowire heterostructures.

    Science.gov (United States)

    Lin, Yung-Chen; Kim, Dongheun; Li, Zhen; Nguyen, Binh-Minh; Li, Nan; Zhang, Shixiong; Yoo, Jinkyoung

    2017-01-19

    We report on strain-induced structural defect formation in core Si nanowires of a Si/Ge core/shell nanowire heterostructure and the influence of the structural defects on the electrochemical performances in lithium-ion battery anodes based on Si/Ge core/shell nanowire heterostructures. The induced structural defects consisting of stacking faults and dislocations in the core Si nanowire were observed for the first time. The generation of stacking faults in the Si/Ge core/shell nanowire heterostructure is observed to prefer settling in either only the Ge shell region or in both the Ge shell and Si core regions and is associated with the increase of the shell volume fraction. The relaxation of the misfit strain in the [112] oriented core/shell nanowire heterostructure leads to subsequent gliding of Shockley partial dislocations, preferentially forming the twins. The observation of crossover of defect formation is of great importance for understanding heteroepitaxy in radial heterostructures at the nanoscale and for building three dimensional heterostructures for the various applications. Furthermore, the effect of the defect formation on the nanomaterial's functionality is investigated using electrochemical performance tests. The Si/Ge core/shell nanowire heterostructures enhance the gravimetric capacity of lithium ion battery anodes under fast charging/discharging rates compared to Si nanowires. However, the induced structural defects hamper lithiation of the Si/Ge core/shell nanowire heterostructure.

  10. The influence of anisotropy on the core structure of Shockley partial dislocations within FCC materials

    Science.gov (United States)

    Szajewski, B. A.; Hunter, A.; Luscher, D. J.; Beyerlein, I. J.

    2018-01-01

    Both theoretical and numerical models of dislocations often necessitate the assumption of elastic isotropy to retain analytical tractability in addition to reducing computational load. As dislocation based models evolve towards physically realistic material descriptions, the assumption of elastic isotropy becomes increasingly worthy of examination. We present an analytical dislocation model for calculating the full dissociated core structure of dislocations within anisotropic face centered cubic (FCC) crystals as a function of the degree of material elastic anisotropy, two misfit energy densities on the γ-surface ({γ }{{isf}}, {γ }{{usf}}) and the remaining elastic constants. Our solution is independent of any additional features of the γ-surface. Towards this pursuit, we first demonstrate that the dependence of the anisotropic elasticity tensor on the orientation of the dislocation line within the FCC crystalline lattice is small and may be reasonably neglected for typical materials. With this approximation, explicit analytic solutions for the anisotropic elasticity tensor {B} for both nominally edge and screw dislocations within an FCC crystalline lattice are devised, and employed towards defining a set of effective isotropic elastic constants which reproduce fully anisotropic results, however do not retain the bulk modulus. Conversely, Hill averaged elastic constants which both retain the bulk modulus and reasonably approximate the dislocation core structure are employed within subsequent numerical calculations. We examine a wide range of materials within this study, and the features of each partial dislocation core are sufficiently localized that application of discrete linear elasticity accurately describes the separation of each partial dislocation core. In addition, the local features (the partial dislocation core distribution) are well described by a Peierls-Nabarro dislocation model. We develop a model for the displacement profile which depends upon

  11. Discovery of protein complexes with core-attachment structures from Tandem Affinity Purification (TAP) data.

    Science.gov (United States)

    Wu, Min; Li, Xiao-Li; Kwoh, Chee-Keong; Ng, See-Kiong; Wong, Limsoon

    2012-09-01

    Many cellular functions involve protein complexes that are formed by multiple interacting proteins. Tandem Affinity Purification (TAP) is a popular experimental method for detecting such multi-protein interactions. However, current computational methods that predict protein complexes from TAP data require converting the co-complex relationships in TAP data into binary interactions. The resulting pairwise protein-protein interaction (PPI) network is then mined for densely connected regions that are identified as putative protein complexes. Converting the TAP data into PPI data not only introduces errors but also loses useful information about the underlying multi-protein relationships that can be exploited to detect the internal organization (i.e., core-attachment structures) of protein complexes. In this article, we propose a method called CACHET that detects protein complexes with Core-AttaCHment structures directly from bipartitETAP data. CACHET models the TAP data as a bipartite graph in which the two vertex sets are the baits and the preys, respectively. The edges between the two vertex sets represent bait-prey relationships. CACHET first focuses on detecting high-quality protein-complex cores from the bipartite graph. To minimize the effects of false positive interactions, the bait-prey relationships are indexed with reliability scores. Only non-redundant, reliable bicliques computed from the TAP bipartite graph are regarded as protein-complex cores. CACHET constructs protein complexes by including attachment proteins into the cores. We applied CACHET on large-scale TAP datasets and found that CACHET outperformed existing methods in terms of prediction accuracy (i.e., F-measure and functional homogeneity of predicted complexes). In addition, the protein complexes predicted by CACHET are equipped with core-attachment structures that provide useful biological insights into the inherent functional organization of protein complexes. Our supplementary material can

  12. Method of magnetic susceptibility mapping of drilled cores. Experimental measurements for geologic structures determination

    International Nuclear Information System (INIS)

    Delrive, C.

    1993-01-01

    The evaluation of the safety of a deep geologic repository for dangerous materials requires the knowledge of the interstitial system of the surrounding host rock. A method is proposed for the determination of geologic structures (in particular fractures) from the magnetic susceptibility mapping of drilled cores. The feasibility of the method has been demonstrated using a SQUID magneto-gradient meter. A measurement tool using a new magnetic susceptibility captor and a testing bench have been developed. This tool allows the measurement of rocks with a magnetic susceptibility greater than 10 -5 SI units and can generate magnetic susceptibility maps with 4 x 4 mm 2 pixels. A magnetic visibility criterion has been defined which allows to foresee if a structure is visible or not. According to the measurements done, it is shown that any centimeter-scale structure with a sufficient magnetic contrast (20%) with respect to the matrix is visible. Therefore, the dip and the orientation of such structure can be determined with a 3 degree and a 5 degree precision, respectively. The position of the structure along the core axis is known with a 4 mm precision. On the other hand, about half of the magnetic contrasts observed do not correspond to the visual analyses and can be explained by very small variations of the mineralogic composition. This last point offers some interesting ways for future research using magnetic susceptibility mapping. (J.S.). 31 refs., 90 figs., 18 tabs., 2 photos., 6 appends

  13. Nature-inspired design of tetraindoles: Optimization of the core structure and evaluation of structure-activity relationship.

    Science.gov (United States)

    Abdu-Allah, Hajjaj H M; Huang, Shih-Ting; Chang, Tzu Ting; Chen, Chia-Ling; Wu, Han-Chung; Li, Wen-Shan

    2016-09-15

    Building on the initial successful optimization of a novel series of tetraindoles, a second generation of the compounds with changes in the core phenyl ring was synthesized to improve anticancer properties. 17 new compounds with different rigidity, planarity, symmetry and degree of conjugation of their core structures to 5-hydroxyindole units were synthesized. All the compounds were fully characterized and tested against breast cancer cell line (MDA-MB-231). The results revealed that the core structure is required for activity and it should be aromatic, rigid, planar, symmetrical and conjugated for optimal activity. Compound 29, which has strong anticancer activity against various tumor-derived cell lines, including Mahlavu (hepatocellular), SK-HEP-1 (hepatic), HCT116 (colon), MIA PaCa-2 (pancreatic), H441 (lung papillary), A549 (lung), H460 (non-small cell lung) and CL1-5 (lung carcinoma) with IC50 values ranging from 0.19 to 3.50μM, was generated after series of successive optimizations. It was found to induce cell cycle arrest and apoptosis in vitro and inhibit tumor growth in the non-obese diabetic-severe combined immunodeficiency (NOD/SCID) mice bearing xenografted MIA PaCa-2 human pancreatic cancer. Copyright © 2016 Elsevier Ltd. All rights reserved.

  14. Structure and stability of nickel/nickel oxide core-shell nanoparticles

    International Nuclear Information System (INIS)

    D'Addato, S; Grillo, V; Valeri, S; Frabboni, S; Altieri, S; Tondi, R

    2011-01-01

    The results of a combined x-ray photoelectron spectroscopy (XPS) and high resolution transmission electron microscopy (HR-TEM) study of Ni nanoparticles (NP), before and after oxidation, are presented. An experimental set-up was realized for the preparation and study of pre-formed NP films, concentrating the attention on Ni NP in the diameter range between 4 and 8 nm. The XPS data were taken in situ from NPs after different stages of oxidation, including controlled dosing of O 2 gas in the experimental system and exposure to the atmosphere. The Ni 2p structure is a combination of spectra from metallic Ni in the NP core and from the oxide shell. The signal from the NP core was observed even for samples after exposure to air. From the comparison of HR-TEM experimental images with theoretical simulations, it was found that the Ni NP core has a regular multitwinned icosahedral structure, composed of single-crystal tetrahedra with (111) faces. The NiO phase is clearly observed forming islands on the NP surface.

  15. Effect of core-shell structure on optical properties of Au-Cu2O nanoparticles

    Science.gov (United States)

    Sai, Cong Doanh; Ngac, An Bang

    2018-03-01

    Solid Au-Cu2O core-shell nanoparticles were synthesized using gold nanoparticles of 16.6 nm in size as the core. The core-shell structure of the synthesized particles was confirmed and characterized by TEM and HRTEM images. Due to their similar crystal structure, the (111) planes of Cu2O are nucleated and grown epitaxially on the {111} facets of Au nanoparticles with the lattice mismatch of about 4.3% resulting in a polycrystallized Cu2O shell covering the Au nanocore. Due to the quantum confinement effect, the band gap energy Eg of the synthesized Cu2O shells is blue-shifted from 2.35 to 2.70 eV as the shell thickness decreases from of 24.6±3.6 to 9.0±1.7 nm. The localized SPR (Surface Plasmon Resonance) peak of the Au nanocore undergoes a large red shift of the order of a hundred of nm due to both the high refractive index and the increase of the thickness of Cu2O shell. Theoretical models within the Drude framework significantly underestimate the experimental data and predict a wrong rate of change of the SPR peak position with respect to the shell thickness.

  16. Preparation and characteristics of core-shell structure cobalt/silica nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Fu Wuyou [National Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); Yang Haibin [National Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China) and Henan Polytechnic University, Hennan Jiaozuo 454000 (China)]. E-mail: yanghb@jlu.edu.cn; Hari-Bala [College of Chemistry, Jilin University, Changchun 130023 (China); Liu Shikai [Henan Polytechnic University, Hennan Jiaozuo 454000 (China); Li, Minghui [National Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); Zou Guangtian [National Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China)

    2006-12-10

    The silica nanolayer with different thickness was coated on the spherical cobalt nanoparticles (an average diameter of 67 nm) to form core-shell structure by the controlled hydrolysis and condensation of tetraethyl orthosilicate (TEOS). This coating process was based on the use of silane coupling agent 3-mercaptopropyltrimethoxysilane (HS-(CH{sub 2}){sub 3}Si(OCH{sub 3}){sub 3}, MPTS) as a primer to render the cobalt surface vitreophilic, thus rendering cobalt surface compatible with silica. The control over the silica coating layer thickness can be achieved by varying the reaction time. The cobalt nanoparticles and the cobalt coated with silica shell were confirmed by transmission electron microscopy (TEM). X-ray photoelectron spectroscopy (XPS) was used to gain insight into the way in which the MPTS is bound to the surface of the cobalt nanoparticles. Result of the thermogravimetric analysis (TGA) and differential thermal analysis (DTA) indicate that the thermal stability of cobalt/silica is better than that of pure cobalt nanoparticles. Magnetic properties of these powders have been evaluated. These cobalt/silica core-shell nanoparticles can be utilized as precursors for making property-tunable magnetic nanoparticles, thin films, and multilayered core-shell structure nanocomposites.

  17. The impact of core-shell nanotube structures on fracture in ceramic nanocomposites

    International Nuclear Information System (INIS)

    Liang, Xin; Yang, Yingchao; Lou, Jun; Sheldon, Brian W.

    2017-01-01

    Multi-wall carbon nanotubes (MWCNTs) can be used to create ceramic nanocomposites with improved fracture toughness. In the present work, atomic layer deposition (ALD) was employed to deposit thin oxide layers on MWCNTs. These core-shell structures were then used to create nanocomposites by using a polymer derived ceramic (PDC) to produce the matrix. Variations in both the initial MWCNT structure and the oxide layers led to substantial differences in fiber-pullout behavior. Single tube pullout tests also showed that the oxide coatings led to stronger bonding with the ceramic matrix. With high defect density MWCNTs, this led to shorter pull-out lengths which is consistent with the conventional understanding of fracture in ceramic matrix composites. However, with low defect density MWCNTs longer pullout lengths were observed with the oxide layers. To interpret the different trends that were observed, we believe that the ALD coatings should not be viewed simply as a means of altering the interfacial properties. Instead, the coated MWCNTs should be viewed as more complex core-shell fibers where both interface and internal properties can be controlled with the ALD layers. - Graphical abstract: Fracture properties of core-shell nanotubes reinforced ceramic nanocomposites.

  18. Sizing Single Cantilever Beam Specimens for Characterizing Facesheet/Core Peel Debonding in Sandwich Structure

    Science.gov (United States)

    Ratcliffe, James G.

    2010-01-01

    This paper details part of an effort focused on the development of a standardized facesheet/core peel debonding test procedure. The purpose of the test is to characterize facesheet/core peel in sandwich structure, accomplished through the measurement of the critical strain energy release rate associated with the debonding process. The specific test method selected for the standardized test procedure utilizes a single cantilever beam (SCB) specimen configuration. The objective of the current work is to develop a method for establishing SCB specimen dimensions. This is achieved by imposing specific limitations on specimen dimensions, with the objectives of promoting a linear elastic specimen response, and simplifying the data reduction method required for computing the critical strain energy release rate associated with debonding. The sizing method is also designed to be suitable for incorporation into a standardized test protocol. Preliminary application of the resulting sizing method yields practical specimen dimensions.

  19. A phase transfer identification of core-shell structures in Au-Ru nanoparticles

    International Nuclear Information System (INIS)

    Yang, J.; Lee, Jim Yang; Too, Heng-Phon

    2005-01-01

    The difference between the transfer of citrate-stabilized Au and Ru nanoparticles from the aqueous phase to toluene was used to develop a simple experimental procedure that can positively identify the formation of bimetallic Au-Ru nanoparticles with the core-shell structure formed in the seed-mediated growth process. The procedure was independently verified by UV-vis spectroscopy, transmission electron microscopy (TEM), energy dispersive X-ray analysis (EDX) and X-ray photoelectron spectroscopy (XPS). The experimental results clearly showed that core-shell nanoparticles of Au-Ru were formed by the seed mediated growth method using Au nanoparticle seeds. The reverse order of using Ru nanoparticles as the seeds, on the contrary, could only produce a physical mixture of isolated nanoparticles of Ru and Au under the same experimental conditions

  20. A novel approach to preparing magnetic protein microspheres with core-shell structure

    Science.gov (United States)

    Jiang, Wei; Sun, Zhendong; Li, Fengsheng; Chen, Kai; Liu, Tianyu; Liu, Jialing; Zhou, Tianle; Guo, Rui

    2011-03-01

    Magnetic protein microspheres with core-shell structure were prepared through a novel approach based on the sonochemical method and the emulsion solvent evaporation method. The microspheres are composed of the oleic acid and undecylenic acid modified Fe 3O 4 cores and coated with globular bovine serum albumin (BSA). Under an optimized condition, up to 57.8 wt% of approximately 10 nm superparamagnetic Fe 3O 4 nanoparticles could be uniformly encapsulated into the BSA microspheres with the diameter of approximately 160 nm and the high saturation magnetization of 38.5 emu/g, besides of the abundant functional groups. The possible formation mechanism of magnetic microspheres was discussed in detail.

  1. Core structure of screw dislocations in Fe from first-principles

    International Nuclear Information System (INIS)

    Ventelon, L.

    2008-11-01

    The various methods appropriate for the simulation of dislocations within first-principles calculations have been set up, improved and compared between them. They have been applied to study screw dislocations in body-centered cubic iron using the SIESTA code. A non-degenerate core structure is obtained; its detailed analysis reveals a dilatation effect. Taking it into account in an anisotropic elasticity model, allows explaining the cell-size dependence of the energetics, obtained within the dipole approach. The Peierls potential obtained in ab initio suggests that the metastable core configuration at halfway position in the Peierls barrier, predicted by empirical potential, does not exist. We show how to construct tri-periodic cells optimized to study kinked dislocations. Using empirical potential, we demonstrate the feasibility of ab initio calculations of Peierls stress and kink formation. (author)

  2. Hypervelocity Impact Performance of Open Cell Foam Core Sandwich Panel Structures

    Science.gov (United States)

    Ryan, S.; Ordonez, E.; Christiansen, E. L.; Lear, D. M.

    2010-01-01

    Open cell metallic foam core sandwich panel structures are of interest for application in spacecraft micrometeoroid and orbital debris shields due to their novel form and advantageous structural and thermal performance. Repeated shocking as a result of secondary impacts upon individual foam ligaments during the penetration process acts to raise the thermal state of impacting projectiles ; resulting in fragmentation, melting, and vaporization at lower velocities than with traditional shielding configurations (e.g. Whipple shield). In order to characterize the protective capability of these structures, an extensive experimental campaign was performed by the Johnson Space Center Hypervelocity Impact Technology Facility, the results of which are reported in this paper. Although not capable of competing against the protection levels achievable with leading heavy shields in use on modern high-risk vehicles (i.e. International Space Station modules), metallic foam core sandwich panels are shown to provide a substantial improvement over comparable structural panels and traditional low weight shielding alternatives such as honeycomb sandwich panels and metallic Whipple shields. A ballistic limit equation, generalized in terms of panel geometry, is derived and presented in a form suitable for application in risk assessment codes.

  3. DNA-based stable isotope probing: a link between community structure and function

    Czech Academy of Sciences Publication Activity Database

    Uhlík, Ondřej; Ječná, K.; Leigh, M. B.; Macková, Martina; Macek, Tomáš

    2009-01-01

    Roč. 407, č. 12 (2009), s. 3611-3619 ISSN 0048-9697 Grant - others:GA MŠk(CZ) 2B08031 Program:2B Institutional research plan: CEZ:AV0Z40550506 Keywords : DNA-based stable isotope probing * microbial diversity * bioremediation Subject RIV: EI - Biotechnology ; Bionics Impact factor: 2.905, year: 2009

  4. High-resolution C and O stable isotope geochemistry of the early Aptian OAE1a at Cau (Prebetic Zone, Spain): Preliminary results from sediment core.

    Science.gov (United States)

    Alejandro Ruiz-Ortiz, Pedro; Aguado, Roque; Castro, José Manuel; Gallego, David; de Gea, Ginés Alfonso; Jarvis, Ian; Molina, José Miguel; Nieto, Luis Miguel; Pancost, Richard; Quijano, María Luisa; Reolid, Matías; Rodriguez, Rafael; Skelton, Peter; Weisser, Helmut

    2017-04-01

    correlation with previously defined and worldwide recognized C-isotope segments of Menegatti et al. [2]. Along with the C-isotope stratigraphy, correlated with previous biostratigraphic and geochemical data from outcrop studies, profiles of magnetic susceptibility data (measured from the core in the laboratory) and geophysical log profiles measured down-hole, are presented. Preliminary sedimentological analyses of the core have been completed, with a focus on lithology and sedimentary structures, including ichnofacies of bioturbated levels. The facies association is dominated by dark marlstones, displaying a cyclic vertical organization. These results confirm and refine previous data, and will be the base for ongoing analytical studies at a high-resolution scale, covering geochemical, biostratigraphic, sedimentological, ichnological and cyclostratigraphic analyses of the core. Acknowledgements: This work is a contribution of the research project CGL2014-55274-P (Gov. of Spain) and Research Group RNM-200 (PAIDI-JA). [1] Robinson et al. (2017). Sedimentology, 64, 1-15 [2] Menegatti et al. (1998). Paleoceanography 13, 530-545. [3] Gea et al. (2003) Palaeo3. 200, 207-219. [4] Quijano et al. (2012). Palaeo3. 365-366, 276-293. [5] Naafs et al. (2016). Nat. Geosc. 9 (2), 135-139. [6] Ruiz-Ortiz et al. (2016). Sci. Dril. 21, 41-46.

  5. Structural Metals in the Group I Intron: A Ribozyme with a Multiple Metal Ion Core

    Energy Technology Data Exchange (ETDEWEB)

    Stahley,M.; Adams, P.; Wang, J.; Strobel, S.

    2007-01-01

    Metal ions play key roles in the folding and function for many structured RNAs, including group I introns. We determined the X-ray crystal structure of the Azoarcus bacterial group I intron in complex with its 5' and 3' exons. In addition to 222 nucleotides of RNA, the model includes 18 Mg2+ and K+ ions. Five of the metals bind within 12 Angstroms of the scissile phosphate and coordinate the majority of the oxygen atoms biochemically implicated in conserved metal-RNA interactions. The metals are buried deep within the structure and form a multiple metal ion core that is critical to group I intron structure and function. Eight metal ions bind in other conserved regions of the intron structure, and the remaining five interact with peripheral structural elements. Each of the 18 metals mediates tertiary interactions, facilitates local bends in the sugar-phosphate backbone or binds in the major groove of helices. The group I intron has a rich history of biochemical efforts aimed to identify RNA-metal ion interactions. The structural data are correlated to the biochemical results to further understand the role of metal ions in group I intron structure and function.

  6. Genetic diversity and population structure analysis to construct a core collection from a large Capsicum germplasm.

    Science.gov (United States)

    Lee, Hea-Young; Ro, Na-Young; Jeong, Hee-Jin; Kwon, Jin-Kyung; Jo, Jinkwan; Ha, Yeaseong; Jung, Ayoung; Han, Ji-Woong; Venkatesh, Jelli; Kang, Byoung-Cheorl

    2016-11-14

    Conservation of genetic diversity is an essential prerequisite for developing new cultivars with desirable agronomic traits. Although a large number of germplasm collections have been established worldwide, many of them face major difficulties due to large size and a lack of adequate information about population structure and genetic diversity. Core collection with a minimum number of accessions and maximum genetic diversity of pepper species and its wild relatives will facilitate easy access to genetic material as well as the use of hidden genetic diversity in Capsicum. To explore genetic diversity and population structure, we investigated patterns of molecular diversity using a transcriptome-based 48 single nucleotide polymorphisms (SNPs) in a large germplasm collection comprising 3,821 accessions. Among the 11 species examined, Capsicum annuum showed the highest genetic diversity (H E  = 0.44, I = 0.69), whereas the wild species C. galapagoense showed the lowest genetic diversity (H E  = 0.06, I = 0.07). The Capsicum germplasm collection was divided into 10 clusters (cluster 1 to 10) based on population structure analysis, and five groups (group A to E) based on phylogenetic analysis. Capsicum accessions from the five distinct groups in an unrooted phylogenetic tree showed taxonomic distinctness and reflected their geographic origins. Most of the accessions from European countries are distributed in the A and B groups, whereas the accessions from Asian countries are mainly distributed in C and D groups. Five different sampling strategies with diverse genetic clustering methods were used to select the optimal method for constructing the core collection. Using a number of allelic variations based on 48 SNP markers and 32 different phenotypic/morphological traits, a core collection 'CC240' with a total of 240 accessions (5.2 %) was selected from within the entire Capsicum germplasm. Compared to the other core collections, CC240 displayed higher

  7. A chemically stable electrolyte with a novel sandwiched structure for proton-conducting solid oxide fuel cells (SOFCs)

    KAUST Repository

    Bi, Lei

    2013-11-01

    A chemically stable electrolyte structure was developed for proton-conducting SOFCs by using two layers of stable BaZr0.7Pr 0.1Y0.2O3 -δ to sandwich a highly-conductive but unstable BaCe0.8Y0.2O 3 -δ electrolyte layer. The sandwiched electrolyte structure showed good chemical stability in both CO2 and H2O atmosphere, indicating that the BZPY layers effectively protect the inner BCY electrolyte, while the BCY electrolyte alone decomposed completely under the same conditions. Fuel cell prototypes fabricated with the sandwiched electrolyte achieved a relatively high performance of 185 mW cm- 2 at 700 C, with a high electrolyte film conductivity of 4 × 10- 3 S cm- 1 at 600 C. © 2013 Elsevier B.V.

  8. Effects of lower plenum flow structure on core inlet flow of ABWR

    International Nuclear Information System (INIS)

    Watanabe, Shun; Abe, Yutaka; Kaneko, Akiko; Watanabe, Fumitoshi; Tezuka, Kenichi

    2010-01-01

    The evaluation of coolant flow structure at a lower plenum of an advanced boiling water reactor (ABWR) in which there are many structures is very important in order to improve generating power. Although the simulation results by CFD (Computational Fluid Dynamics) codes can predict such complicated flow in the lower plenum, it is required to establish the database of flow structure in lower plenum of ABWR experimentally for the benchmark of the CFD codes. In the model of the lower plenum, we measured velocity profiles with LDV and PIV. And differential pressure of constructed model is measured with differential pressure instrument. It was identified that the velocity and differential pressure profiles also showed the tendency to be flat in the core inlet. Moreover, vortexes were observed around side entry orifice by PIV measurement. (author)

  9. Closed Pore Structured NiCo2O4-Coated Nickel Foams for Stable and Effective Oil/Water Separation.

    Science.gov (United States)

    Li, Yan; Zheng, Xi; Yan, Zhanheng; Tian, Dongliang; Ma, Jianmin; Zhang, Xiaofang; Jiang, Lei

    2017-08-30

    To solve the serious problem caused by oily wastewater pollution, unique interface designs, for example, membranes with superwetting properties such as superhydrophobicity/superoleophilicity and superhydrophilicity/underwater superoleophobicity, provide a good way to achieve oil/water separation. Here, inspired by the liquid storage property of the honeycomb structure, we propose a strategy to fabricate NiCo 2 O 4 -coated nickel foams for stable and efficient oil/water separation. NiCo 2 O 4 with a closed-pore structure was formed by assembling nanoflakes with a micro/nanoscale hierarchical structure. Compared with nickel foam coated by NiCo 2 O 4 with an open-pore structure (NiCo 2 O 4 nanowires), the enclosed nanostructure of NiCo 2 O 4 nanoflakes can firmly hold water for a more stable superhydrophilic/underwater superoleophobic interface. As a consequence, the NiCo 2 O 4 -nanoflake-coated nickel foam has a larger oil breakthrough pressure than the NiCo 2 O 4 -nanowire-coated nickel foam because of a slightly larger oil advancing angle and a lower underwater oil adhesion force, which makes it more stable and efficient for oil/water separation. Moreover, the NiCo 2 O 4 -coated nickel foams have excellent chemical and mechanical stability, and they are reusable for oil-water separation. This work will be beneficial for the design and development of stable underwater superoleophobic self-cleaning materials and related device applications, such as oil/water separation.

  10. Probing molecular adsorbates with core-level spectroscopies: Electronic structure and bonding models

    Science.gov (United States)

    Fohlisch, Alexander

    Resonantly excited X-ray emission spectroscopy has been applied to study the valence electronic structure of molecular adsorbates in an atom specific and orbital symmetry selective manner. In combination with ab initio cluster calculations, electronic structure and bonding models have been derived. Existing models of surface chemical bonding have been reviewed and partially revised. Most notably, the bonding mechanism of carbon monoxide (CO) on transition and noble metals has been revised and is found to be the result of a strong covalent interaction between the CO orbitals and the metal bands within each orbital symmetry. A characteristic allylic configuration is found in the π system and strong polarization within the σ system. The equilibrium properties of adsorbed CO are the direct result of a balance between the repulsive σ-interaction and the attractive π-interaction both in terms of the total energy and the local bond properties. The bonding of ammonia (NH3) on the Cu(110) surface is found to be dominated by a large covalent interaction, which contrasts the previous model of a strong electrostatic interaction. Furthermore, adsorbate-adsorbate interaction leads to a tilted adsorption geometry. Ethylene (C2H4) on Cu(110) is adsorbed in the di-σ configuration, according to the generally accepted Dewar Chatt Duncanson model for hydrocarbon adsorption. The application and interpretation of resonantly excited X-ray emission on these systems also required a thorough discussion of the spectroscopic process. Another topic was the vibrational fine structure in the X-ray photoemission core-level main lines of adsorbed molecules. The observation of the vibrational fine structure in molecular adsorbates is remarkable, as it was previously thought impossible to observe due to solid state broadening contributions. A detailed analysis of the vibrational fine structure and the line profile makes it possible to study the electronic and geometric properties of the core

  11. Very Deep inside the SN 1987A Core Ejecta: Molecular Structures Seen in 3D

    Energy Technology Data Exchange (ETDEWEB)

    Abellán, F. J.; Marcaide, J. M. [Departamento de Astronomía y Astrofísica, Universidad de Valencia, C/Dr. Moliner 50, E-46100 Burjassot (Spain); Indebetouw, R.; Chevalier, R. [Department of Astronomy, University of Virginia, P.O. Box 400325, Charlottesville, VA 22904 (United States); Gabler, M.; Janka, H.-Th. [Max-Planck-Institut für Astrophysik, Karl-Schwarzschild-Straße 1, D-85748 Garching (Germany); Fransson, C.; Lundqvist, P. [Department of Astronomy, The Oskar Klein Centre, Stockholm University, Alba Nova University Centre, SE-106 91 Stockholm (Sweden); Spyromilio, J. [ESO, Karl-Schwarzschild-Straße 2, D-85748 Garching (Germany); Burrows, D. N. [Department of Astronomy and Astrophysics, The Pennsylvania State University, University Park, PA 16802 (United States); Cigan, P.; Gomez, H. L.; Matsuura, M. [School of Physics and Astronomy, Cardiff University, Queens Buildings, The Parade, Cardiff CF24 3AA (United Kingdom); Gaensler, B. M. [Dunlap Institute for Astronomy and Astrophysics, University of Toronto, Toronto, ON M5S 3H4 (Canada); Kirshner, R. [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Larsson, J. [KTH, Department of Physics, and the Oskar Klein Centre, AlbaNova, SE-106 91 Stockholm (Sweden); McCray, R. [Department of Astronomy, University of California, Berkeley, CA 94720-3411 (United States); Ng, C.-Y. [Department of Physics, The University of Hong Kong, Pokfulam Road, Hong Kong (China); Park, S. [Department of Physics, University of Texas at Arlington, 108 Science Hall, Box 19059, Arlington, TX 76019 (United States); Roche, P., E-mail: francisco.abellan@uv.es [Department of Physics, University of Oxford, Oxford OX1 3RH (United Kingdom); and others

    2017-06-20

    Most massive stars end their lives in core-collapse supernova explosions and enrich the interstellar medium with explosively nucleosynthesized elements. Following core collapse, the explosion is subject to instabilities as the shock propagates outward through the progenitor star. Observations of the composition and structure of the innermost regions of a core-collapse supernova provide a direct probe of the instabilities and nucleosynthetic products. SN 1987A in the Large Magellanic Cloud is one of very few supernovae for which the inner ejecta can be spatially resolved but are not yet strongly affected by interaction with the surroundings. Our observations of SN 1987A with the Atacama Large Millimeter/submillimeter Array are of the highest resolution to date and reveal the detailed morphology of cold molecular gas in the innermost regions of the remnant. The 3D distributions of carbon and silicon monoxide (CO and SiO) emission differ, but both have a central deficit, or torus-like distribution, possibly a result of radioactive heating during the first weeks (“nickel heating”). The size scales of the clumpy distribution are compared quantitatively to models, demonstrating how progenitor and explosion physics can be constrained.

  12. Role of core support material in veneer failure of brittle layer structures.

    Science.gov (United States)

    Hermann, Ilja; Bhowmick, Sanjit; Lawn, Brian R

    2007-07-01

    A study is made of veneer failure by cracking in all-ceramic crown-like layer structures. Model trilayers consisting of a 1 mm thick external glass layer (veneer) joined to a 0.5 mm thick inner stiff and hard ceramic support layer (core) by epoxy bonding or by fusion are fabricated for testing. The resulting bilayers are then glued to a thick compliant polycarbonate slab to simulate a dentin base. The specimens are subjected to cyclic contact (occlusal) loading with spherical indenters in an aqueous environment. Video cameras are used to record the fracture evolution in the transparent glass layer in situ during testing. The dominant failure mode is cone cracking in the glass veneer by traditional outer (Hertzian) cone cracks at higher contact loads and by inner (hydraulically pumped) cone cracks at lower loads. Failure is deemed to occur when one of these cracks reaches the veneer/core interface. The advantages and disadvantages of the alumina and zirconia core materials are discussed in terms of mechanical properties-strength and toughness, as well as stiffness. Consideration is also given to the roles of interface strength and residual thermal expansion mismatch stresses in relation to the different joining methods. Copyright 2006 Wiley Periodicals, Inc.

  13. Expansion of core melt within the concrete foundation - effects on the reactor building structure

    International Nuclear Information System (INIS)

    Hassmann, K.; Liphardt, W.; Bindseil, P.

    1983-01-01

    The effects of core melt expanding in the concrete fundament of underground-situated nuclear power plants on the structure of the reactor building have been investigated. The radial reduction of the foundation plate is not to exceed 12 m, in case limited additional internal pressure loads of more than 6 bar are to be covered. Greater reductions will endanger the stability of the building. For the assumed load cases, no penetrating cracks will occur. During the subject test, the limiting walls of the building remained leak-proof up to an internal pressure of 2.5 bar. (orig.) [de

  14. Role of wall-attached structures in the interface of the quiescent core region in turbulent pipe flow

    Science.gov (United States)

    Yang, Jongmin; Hwang, Jinyul; Sung, Hyung Jin

    2017-11-01

    The effects of low- and high-speed structures on the interface of the quiescent core region are explored using direct numerical simulation data of turbulent pipe flow. The quiescent core region is a uniform momentum zone located at the center of the pipe flow, which contains the highest streamwise momentum with a low level of turbulence. The interface of the quiescent core region can be identified from the probability density function of the streamwise modal velocity. In the vicinity of the interface of the quiescent core region, the streamwise velocity changes abruptly. The abrupt jump in velocity causes an increase of the velocity gradient. The interface of the quiescent core region is similar to the laminar superlayer in turbulent/non-turbulent interface. The interface of the quiescent core region contains the low- and high-speed structures. They can be classified into wall-attached and detached structures depending on the distance between the structures and the wall. The influence of the detached structures accounted for most of the number of detected structures is negligible due to its small volume. Conversely, the wall-attached structures adjacent to the interface have a huge influence on the statistical amount of the interface, such as entrainment characteristics. This work was supported by the Creative Research Initiatives (No. 2017-013369) program of the National Research Foundation of Korea (MSIP).

  15. A review of the bipolar see-saw from synchronized and high resolution ice core water stable isotope records from Greenland and East Antarctica

    NARCIS (Netherlands)

    Landais, A.; Masson-Delmotte, V.; Stenni, B.; Selmo, E.; Roche, D.M.V.A.P.; Jouzel, J.; Lambert, F.; Guillevic, M.; Bazin, L.; Arzel, O.; Vinther, B.; Gkinis, V.; Popp, T.

    2015-01-01

    Numerous ice core records are now available that cover the Last Glacial cycle both in Greenland and in Antarctica. Recent developments in coherent ice core chronologies now enable us to depict with a precision of a few centuries the relationship between climate records in Greenland and Antarctica

  16. Nonlinear Thermo-mechanical Finite Element Analysis of Polymer Foam Cored Sandwich Structures including Geometrical and Material Nonlinearity

    DEFF Research Database (Denmark)

    Palleti, Hara Naga Krishna Teja; Thomsen, Ole Thybo; Taher, Siavash Talebi

    In this paper, polymer foam cored sandwich structures with fibre reinforced composite face sheets subjected to combined mechanical and thermal loads will be analysed using the commercial FE code ABAQUS® incorporating both material and geometrical nonlinearity. Large displacements and rotations...

  17. Impact on breeding rate of different Molten Salt reactor core structures

    International Nuclear Information System (INIS)

    Wang Haiwei; Mei Longwei; Cai Xiangzhou; Chen Jingen; Guo Wei; Jiang Dazhen

    2013-01-01

    Background: Molten Salt Reactor (MSR) has several advantages over the other Generation IV reactor. Referred to the French CNRS research and compared to the fast reactor, super epithermal neutron spectrum reactor type is slightly lower and beading rate reaches 1.002. Purpose: The aim is to explore the best conversion zone layout scheme in the super epithermal neutron spectrum reactor. This study can make nuclear fuel as one way to solve the energy problems of mankind in future. Methods: Firstly, SCALE program is used for molten salt reactor graphite channel, molten salt core structure, control rods, graphite reflector and layer cladding structure. And the SMART modules are used to record the important actinides isotopes and their related reaction values of each reaction channel. Secondly, the thorium-uranium conversion rate is calculated. Finally, the better molten salt reactor core optimum layout scheme is studied comparing with various beading rates. Results: Breading zone layout scheme has an important influence on the breading rate of MSR. Central graphite channels in the core can get higher neutron flux irradiation. And more 233 Th can convert to 233 Pa, which then undergoes beta decay to become 233 U. The graphite in the breading zone gets much lower neutron flux irradiation, so the life span of this graphite can be much longer than that of others. Because neutron flux irradiation in the uranium molten salt graphite has nearly 10 times higher than the graphite in the breading zone, it has great impact on the thorium-uranium conversion rates. For the super epithermal neutron spectrum molten salt reactors, double salt design cannot get higher thorium-uranium conversion rates. The single molten salt can get the same thorium-uranium conversion rate, meanwhile it can greatly extend the life of graphite in the core. Conclusions: From the analysis of calculation results, Blanket breeding area in different locations in the core can change the breeding rates of thorium

  18. What does determine the sign of core in Magnetic Flux Rope structures of the Earth's magnetotail

    Directory of Open Access Journals (Sweden)

    D. V. Sarafopoulos

    2014-09-01

    Full Text Available This paper primarily examines the key factors being involved in precisely determining the sign of the core field in a magnetic flux rope (MFR like structure embedded in the tailward plasma flow associated with the Earth's magnetotail. Magnetic flux ropes are frequently detected by satellites moving smoothly northwards (upwards or southwards (downwards and crossing almost the whole plasma sheet; the sign of the rope's core is associated with the local tail's motion: If the tail is bending to an upward or downward direction, then the sign of the rope's core, being essentially an intense By deviation, will be positive or negative correspondingly. On the basis of this observational finding, a major question concerns the mechanism by which the tail's motion is dictated. The reconnection process acting in the tail will obviously produce symmetric structures of MFRs (with respect to the neutral sheet plane; therefore, the detected organized asymmetry may be an additional indication in the whole magnetotail' s dynamics. Moreover, we discuss the issue of the core's sign in cases without any significant magnetotail's motion. A model interpreting the diagnosed behavior is introduced: Once a tailward ion jet is produced in a thinned plasma sheet, it might form clockwise or counterclockwise ion vortices (i.e., loop-like ion currents providing the "magnetic core" with the appropriate sign. The crucial role of the interplanetary By deviation of the magnetic field (IMF is scrutinized and taken into account. The whole model is tested under the condition of long-lasting extraordinary events characterized by a persistent-intense By deviation with a duration up to 34 min. This work, based on Geotail single-satellite measurements, is not a statistical one; it is a first approach allowing the reconstruction of measurements in the whole range of the magnetotail's deflections, from negligible up to stronger significant magnetotail movements, and should be therefore

  19. Core-shell structure of degradable, thermosensitive polymeric micelles studied by small-angle neutron scattering.

    Science.gov (United States)

    Ramzi, Aissa; Rijcken, Cristianne J F; Veldhuis, Theo F J; Schwahn, Dietmar; Hennink, Wim E; van Nostrum, Cornelus F

    2008-01-24

    The structure of assemblies of block copolymers composed of thermosensitive, biodegradable poly(N-(2-hydroxypropyl) methacrylamide-dilactate) and poly(ethylene glycol) (pHPMAmDL-b-PEG) has been studied by small-angle neutron scattering (SANS). Three amphiphilic copolymers with a fixed PEG of 5 kDa and a partially deuterated pHPMAmDL(d) block of 6700, 10400, or 21200 Da were used to form micelles in aqueous media by heating the polymeric solution from below to above the cloud point temperature (around 10 degrees C) of the thermosensitive block. Simultaneous and quantitative analysis of the scattering cross sections obtained at three different solvent contrasts is expedited using core-shell model, which assumed a homogeneous core of uniform scattering length density. The mean core radius increased from 13 to 18.5 nm with the molecular weight of the pHPMAmDL(d) block, while the thickness of the stabilizing PEG layer was around 8 nm for the three investigated assemblies. In addition, the volume fraction values of the stabilizing PEG chains in the shell are low and decreased from 31% to 14% with increasing the size of pHPMAmDL(d) block which shows that the shell layer of the assemblies is highly hydrated. The corresponding PEG chain grafting densities decreased from 0.22 to 0.11 nm-2 and the distance between PEG chains on the nanoparticles surface increased from 2.4 to 3.4 nm. The pHPMAmDL-b-PEG micelles showed a controlled instability due to hydrolysis of the lactic acid side groups in the thermosensitive block; that is, an increase of the degradation time leads to an increase of the size of the core which becomes less hydrophobic and consequently more hydrated. Neutron experiments supplied accurate information on how the size of the core and the micelle's aggregation number changed with the incubation time. This feature and the initially small size and dense structure in aqueous solution make the polymeric micelles suitable as carriers for hydrophobic drugs.

  20. Core size determination and structural characterization of intravenous iron complexes by cryogenic transmission electron microscopy.

    Science.gov (United States)

    Wu, Yong; Petrochenko, Peter; Chen, Lynn; Wong, Sook Yee; Absar, Mohammad; Choi, Stephanie; Zheng, Jiwen

    2016-05-30

    Understanding physicochemical properties of intravenous (IV) iron drug products is essential to ensure the manufacturing process is consistent and streamlined. The history of physicochemical characterization of IV iron complex formulations stretches over several decades, with disparities in iron core size and particle morphology as the major source of debate. One of the main reasons for this controversy is room temperature sample preparation artifacts, which affect accurate determination of size, shape and agglomeration/aggregation of nanoscale iron particles. The present study is first to report the ultra-fine iron core structures of four IV iron complex formulations, sodium ferric gluconate, iron sucrose, low molecular weight iron dextran and ferumoxytol, using a cryogenic transmission electron microscopy (cryo-TEM) preservation technique, as opposed to the conventional room temperature (RT-TEM) technique. Our results show that room temperature preparation causes nanoparticle aggregation and deformation, while cryo-TEM preserves IV iron colloidal suspension in their native frozen-hydrated and undiluted state. In contrast to the current consensus in literature, all four IV iron colloids exhibit a similar morphology of their iron oxide cores with a spherical shape, narrow size distribution and an average size of 2nm. Moreover, out of the four tested formulations, ferumoxytol exhibits a cluster-like community of several iron carbohydrate particles which likely accounts for its large hydrodynamic size of 25nm, measured with dynamic light scattering. Our findings outline a suitable method for identifying colloidal nanoparticle core size in the native state, which is increasingly important for manufacturing and design control of complex drug formulations, such as IV iron drug products. Published by Elsevier B.V.

  1. Finding the Stable Structures of WxN1-x with an ab-initio High-Throughput Approach

    Science.gov (United States)

    2014-03-13

    properties must be energetically stable against decomposition into other compounds. This stability can only be found after the determination of the...polarized. However, in every structure the self-consistent magnetic moment was negligible, and the final calculations were all done assuming no moment. The...of NaCl) we looked at all 255 combinations. We found 34 unique structures, including NbO itself, CsCl, S3U4, ReO3,[59] cubic perovskite (with formula

  2. High cycle fatigue analysis of vortex suppression plate and secondary core support structures

    International Nuclear Information System (INIS)

    Xue Guohong; Li Yuan; Zhao Feiyun; Feng Shaodong; Yu Hao

    2013-01-01

    Background: Reactor internals are important equipment s in the reactor coolant system, its structure design needs high reliability in the entire lifetime, Reactor internals have occurred breakdown and the damage event due to flow induced vibrations in the domestic and foreign nuclear power plants, which make immediate influence on reactor safe operation and economic efficiency. Purpose: In this work, the dynamic response of reactor internals-vortex suppression plate and secondary core support structure (SCSS) under the loading from pump induced vibrations and flow induced vibrations are studied. Methods: Based on the finite element model of SCSS, Spectrum analysis and the harmonious analysis are performed, in order to get the response of the structure under flow induced vibrations. Then, the high fatigue of the structure is assessed according to the ASME B and PV Code. Results: The results indicate that alternate stresses of all the components satisfy the limiting value in the correlative requirements. Conclusions: The structure of SCSS could bear the vibration induced from the flow and the pump, and the method used in this article provides the reference for other reactor internals structure analysis like this. (authors)

  3. Molecular and Structural Analysis of the Helicobacter pylori cag Type IV Secretion System Core Complex.

    Science.gov (United States)

    Frick-Cheng, Arwen E; Pyburn, Tasia M; Voss, Bradley J; McDonald, W Hayes; Ohi, Melanie D; Cover, Timothy L

    2016-01-12

    Bacterial type IV secretion systems (T4SSs) can function to export or import DNA, and can deliver effector proteins into a wide range of target cells. Relatively little is known about the structural organization of T4SSs that secrete effector proteins. In this report, we describe the isolation and analysis of a membrane-spanning core complex from the Helicobacter pylori cag T4SS, which has an important role in the pathogenesis of gastric cancer. We show that this complex contains five H. pylori proteins, CagM, CagT, Cag3, CagX, and CagY, each of which is required for cag T4SS activity. CagX and CagY are orthologous to the VirB9 and VirB10 components of T4SSs in other bacterial species, and the other three Cag proteins are unique to H. pylori. Negative stain single-particle electron microscopy revealed complexes 41 nm in diameter, characterized by a 19-nm-diameter central ring linked to an outer ring by spoke-like linkers. Incomplete complexes formed by Δcag3 or ΔcagT mutants retain the 19-nm-diameter ring but lack an organized outer ring. Immunogold labeling studies confirm that Cag3 is a peripheral component of the complex. The cag T4SS core complex has an overall diameter and structural organization that differ considerably from the corresponding features of conjugative T4SSs. These results highlight specialized features of the H. pylori cag T4SS that are optimized for function in the human gastric mucosal environment. Type IV secretion systems (T4SSs) are versatile macromolecular machines that are present in many bacterial species. In this study, we investigated a T4SS found in the bacterium Helicobacter pylori. H. pylori is an important cause of stomach cancer, and the H. pylori T4SS contributes to cancer pathogenesis by mediating entry of CagA (an effector protein regarded as a "bacterial oncoprotein") into gastric epithelial cells. We isolated and analyzed the membrane-spanning core complex of the H. pylori T4SS and showed that it contains unique proteins

  4. Screw dislocations in complex, low symmetry oxides: core structures, energetics, and impact on crystal growth.

    Science.gov (United States)

    Shahsavari, Rouzbeh; Chen, Lu

    2015-02-04

    Determining the atomic structure and the influence of defects on properties of low symmetry oxides have long been an engineering pursuit. Here, we focus on five thermodynamically reversible monoclinic and orthorhombic polymorphs of dicalcium silicates (Ca2SiO3)-a key cement constituent-as a model system and use atomistic simulations to unravel the interplay between the screw dislocation core energies, nonplanar core structures, and Peierls stresses along different crystallographic planes. Among different polymorphs, we found that the α polymorphs (α-C2S) has the largest Peierls stress, corresponding to the most brittle polymorph, which make it attractive for grinding processes. Interestingly, our analyses indicate that this polymorphs has the lowest dislocation core energy, making it ideal for reactivity and crystal growth. Generally, we identified the following order in terms of grinding efficiency based on screw dislocation analysis, α-C2S > αH-C2S > αL-C2S > β-C2S > γ-C2S, and the following order in term of reactivity, α -C2S > αL-C2S > γ-C2S > αH-C2S > β-C2S. This information, combined with other deformation-based mechanisms, such as twinning and edge dislocation, can provide crucial insights and guiding hypotheses for experimentalists to tune the cement grinding mechanisms and reactivity processes for an overall optimum solution with regard to both energy consumption and performance. Our findings significantly broaden the spectrum of strategies for leveraging both crystallographic directions and crystal symmetry to concurrently modulate mechanics and crystal growth processes within an identical chemical composition.

  5. Fluid structure interaction in LMFBR cores modelling by an homogenization method

    International Nuclear Information System (INIS)

    Brochard, D.

    1988-01-01

    The upper plenum of the internals of PWR, the steam generator bundle, the nuclear reactor core, may be schematically represented by a beam bundle immersed in a fluid. The dynamical study of such a system needs to take into account fluid structure interaction. A refined model at the scale of the tubes can be used but leads to a very difficult problem to solve even on the largest computers. The homogenization method allows to have an approximation of the fluid structure interaction for the global behaviour of the bundle. It consists of replacing the heterogeneous physical medium (tubes and fluid) by an equivalent homogeneous medium whose characteristics are determined from the resolution of a set of problems on the elementary cell. The aim of this paper is to present the main steps of the determination of this equivalent medium in the case of small displacements (acoustic behaviour of the fluid). Then an application to LMFBR core geometry has been realised, which shows the lowering effect on eigenfrequencies due to the fluid. Some comparisons with test results will be presented. 6 refs, 7 figs, 2 tabs

  6. Relation between flow enhancement factor and structure for core-softened fluids inside nanotubes.

    Science.gov (United States)

    Bordin, José Rafael; Diehl, Alexandre; Barbosa, Marcia C

    2013-06-13

    The relationship between enhancement flow and structure of core-softened fluids confined inside nanotubes has been studied using nonequilibrium molecular dynamics simulation. The fluid was modeled with different types of attractive and purely repulsive two length scale potentials. Such potentials reproduce in bulk the anomalous behavior observed for liquid water. The dual control volume grand canonical molecular dynamics method was employed to create a pressure gradient between two reservoirs connected by a nanotube. We show how the nanotube radius affects the flow enhancement factor for each one of the interaction potentials. The connection between structural and dynamical properties of the confined fluid is discussed, and we show how attractive and purely repulsive fluids exhibit distinct behaviors. A continuum to subcontinuum flow transition was found for small nanotube radius. The behavior obtained for the core-softened fluids is similar to what was recently observed in all-atom molecular dynamics simulations for classical models of water and also in experimental studies. Our results are explained in the framework of the two length scale potentials.

  7. Mutagenicity in a Molecule: Identification of Core Structural Features of Mutagenicity Using a Scaffold Analysis.

    Directory of Open Access Journals (Sweden)

    Kuo-Hsiang Hsu

    Full Text Available With advances in the development and application of Ames mutagenicity in silico prediction tools, the International Conference on Harmonisation (ICH has amended its M7 guideline to reflect the use of such prediction models for the detection of mutagenic activity in early drug safety evaluation processes. Since current Ames mutagenicity prediction tools only focus on functional group alerts or side chain modifications of an analog series, these tools are unable to identify mutagenicity derived from core structures or specific scaffolds of a compound. In this study, a large collection of 6512 compounds are used to perform scaffold tree analysis. By relating different scaffolds on constructed scaffold trees with Ames mutagenicity, four major and one minor novel mutagenic groups of scaffold are identified. The recognized mutagenic groups of scaffold can serve as a guide for medicinal chemists to prevent the development of potentially mutagenic therapeutic agents in early drug design or development phases, by modifying the core structures of mutagenic compounds to form non-mutagenic compounds. In addition, five series of substructures are provided as recommendations, for direct modification of potentially mutagenic scaffolds to decrease associated mutagenic activities.

  8. Mutagenicity in a Molecule: Identification of Core Structural Features of Mutagenicity Using a Scaffold Analysis

    Science.gov (United States)

    Hsu, Kuo-Hsiang; Su, Bo-Han; Tu, Yi-Shu; Lin, Olivia A.; Tseng, Yufeng J.

    2016-01-01

    With advances in the development and application of Ames mutagenicity in silico prediction tools, the International Conference on Harmonisation (ICH) has amended its M7 guideline to reflect the use of such prediction models for the detection of mutagenic activity in early drug safety evaluation processes. Since current Ames mutagenicity prediction tools only focus on functional group alerts or side chain modifications of an analog series, these tools are unable to identify mutagenicity derived from core structures or specific scaffolds of a compound. In this study, a large collection of 6512 compounds are used to perform scaffold tree analysis. By relating different scaffolds on constructed scaffold trees with Ames mutagenicity, four major and one minor novel mutagenic groups of scaffold are identified. The recognized mutagenic groups of scaffold can serve as a guide for medicinal chemists to prevent the development of potentially mutagenic therapeutic agents in early drug design or development phases, by modifying the core structures of mutagenic compounds to form non-mutagenic compounds. In addition, five series of substructures are provided as recommendations, for direct modification of potentially mutagenic scaffolds to decrease associated mutagenic activities. PMID:26863515

  9. SANS study of PLA-mPEG core-shell structured nanoparticles for targeted drug delivery

    International Nuclear Information System (INIS)

    Wang, Yichao; Li, Puwang; Kong, Lingxue

    2009-01-01

    Full text: Colorectal cancer (CRC), referring to cancers that affect the colon and the rectum, is the third most common form of cancer and second leading cause of cancer-related death in the western world (Fortina et al 2007). Currently there are many therapeutic methods, however, most of the traditional methods have enormous side effects, partly because they significantly damage the healthy cells. Therefore, there is an urgent demand to develop a more effective drug delivery mechanism to alleviate these side effects. PLA-mPEG core-shell nanoparticles will be used to deliver the therapeutic agent to the specific area. Materials preparation will include the deuteration of L-Iactic acid monomer and ring opening polymerization to prepare the block copolymer. The drug loaded nanoparticles will be fabricated by double emulsion and solvent evaporation method. The processing parameters will be varied and optimized to maximize the encapsulation efficiency and drug loading. With SANS, we will identify the internal structure of PLA-mPEG nanoparticles with a diameter of 50- 1 00 n m, an important aspect to control the release of the drugs. At the same time, we will relate how the different process parameters affect the core size. The relationship between drug release profile and structure of the encapsulation materials will also be studied using the data from SANS.

  10. Synthesis of Core-shell Structured Amorphous Si Nanoparticles by Induction Thermal Plasmas

    Science.gov (United States)

    Okamoto, Daisuke; Kageyama, Takuya; Tanaka, Manabu; Sone, Hirotaka; Watanabe, Takayuki

    2015-09-01

    Core-shell structured amorphous Si nanoparticles were synthesized by induction thermal plasma. Crystalline Si powder with 3 μm of average diameter was injected into the induction thermal plasma at 4 MHz. The Si raw materials immediately evaporate in the high temperature plasma region and nanoparticles were produced through the quenching process. Counterflow quenching gas was injected from downstream of the torch with its direction against the plasma flow. The effect of the operating parameter such as flow rate of quenching gas and input power was investigated. Collected particles were characterized by X-ray diffraction, transmission electron microscopy, electron energy-loss spectroscopy, and Raman spectroscopy. Obtained results indicate that amorphization degree of the synthesized nanoparticles is more than 90% when additional quenching gas of 20 L/min is injected. The quenching rate of the prepared nanoparticles in the growth region have an important role on determining the amorphization degree. Moreover, EELS and Raman analyses showed the synthesized nanoparticles were coated by the SiO2 shell with thickness of 2-4 nm. These findings indicated that amorphous Si/SiO2 core-shell structured nanoparticles were successfully synthesized by induction thermal plasma in single step.

  11. Impact of structure and functionality of core polyol in highly functional biobased epoxy resins.

    Science.gov (United States)

    Pan, Xiao; Webster, Dean C

    2011-09-01

    Highly functional biobased epoxy resins were prepared using dipentaerythritol (DPE), tripentaerythritol (TPE), and sucrose as core polyols that were substituted with epoxidized soybean oil fatty acids, and the impact of structure and functionality of the core polyol on the properties of the macromolecular resins and their epoxy-anhydride thermosets was explored. The chemical structures, functional groups, molecular weights, and compositions of epoxies were characterized using nuclear magnetic resonance (NMR) spectroscopy, Fourier-transform infrared (FTIR) spectroscopy, gel permeation chromatography (GPC), and matrix-assisted laser desorption/ionization time-of-flight mass spectrometry (MALDI MS). The epoxies were also studied for their bulk viscosity, intrinsic viscosity, and density. Crosslinked with dodecenyl succinic anhydride (DDSA), epoxy-anhydride thermosets were evaluated using differential scanning calorimetry (DSC), dynamic mechanical analysis (DMA), tensile tests, and tests of coating properties. Epoxidized soybean oil (ESO) was used as a control. Overall, the sucrose-based thermosets exhibited the highest moduli, having the most rigid and ductile performance while maintaining the highest biobased content. DPE/TPE-based thermosets showed modestly better thermosetting performance than the control ESO thermoset. Copyright © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  12. A CFD Modeling Study for the Design of an Advanced HANARO Reactor Core Structure

    Energy Technology Data Exchange (ETDEWEB)

    Park, Jong-Hark; Chae, Hee-Teak; Park, Cheol; Kim, Heo-Nil [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2007-07-01

    AHR(Advanced HANARO Reactor) based on HANARO has been under a conceptually designed with new ideas to implement new findings, which have been revealed from twelve years operation of HANARO. For example, a perforated structure to reduce the FIV(Flow Induced Vibration) of a fuel assembly has been considered to install. And a change of dual outlets to a single outlet has also been investigated to promote the accessibility and to work easily in the reactor pool. Those investigations have been conducted by the CFD (Computational Fluid Dynamics) method, which can provide us with an good understanding of three dimensional flow fields influenced by design changes without an experiment. In this study a CFD modeling study for an AHR core structure design is described.

  13. Optimal design for crosstalk analysis in 12-core 5-LP mode homogeneous multicore fiber for different lattice structure

    Science.gov (United States)

    Kumar, Dablu; Ranjan, Rakesh

    2018-03-01

    12-Core 5-LP mode homogeneous multicore fibers have been proposed for analysis of inter-core crosstalk and dispersion, with four different lattice structures (circular, 2-ring, square lattice, and triangular lattice) having cladding diameter of 200 μm and a fixed cladding thickness of 35 μm. The core-to-core crosstalk impact has been studied numerically with respect to bending radius, core pitch, transmission distance, wavelength, and core diameter for all 5-LP modes. In anticipation of further reduction in crosstalk levels, the trench-assisted cores have been incorporated for all respective designs. Ultra-low crosstalk (-138 dB/100 km) has been achieved through the triangular lattice arrangement, with trench depth Δ2 = -1.40% for fundamental (LP01) mode. It has been noted that the impact of mode polarization on crosstalk behavior is minor, with difference in crosstalk levels between two polarized spatial modes as ≤0.2 dB. Moreover, the optimized cladding diameter has been obtained for all 5-LP modes for a target value of crosstalk of -50 dB/100 km, with all the core arrangements. The dispersion characteristic has also been analyzed with respect to wavelength, which is nearly 2.5 ps/nm km at operating wavelength 1550 nm. The relative core multiplicity factor (RCMF) for the proposed design is obtained as 64.

  14. Core-Shell Structuring of Pure Metallic Aerogels towards Highly Efficient Platinum Utilization for the Oxygen Reduction Reaction.

    Science.gov (United States)

    Cai, Bin; Hübner, René; Sasaki, Kotaro; Zhang, Yuanzhe; Su, Dong; Ziegler, Christoph; Vukmirovic, Miomir B; Rellinghaus, Bernd; Adzic, Radoslav R; Eychmüller, Alexander

    2018-03-05

    The development of core-shell structures remains a fundamental challenge for pure metallic aerogels. Here we report the synthesis of Pd x Au-Pt core-shell aerogels composed of an ultrathin Pt shell and a composition-tunable Pd x Au alloy core. The universality of this strategy ensures the extension of core compositions to Pd transition-metal alloys. The core-shell aerogels exhibited largely improved Pt utilization efficiencies for the oxygen reduction reaction and their activities show a volcano-type relationship as a function of the lattice parameter of the core substrate. The maximum mass and specific activities are 5.25 A mg Pt -1 and 2.53 mA cm -2 , which are 18.7 and 4.1 times higher than those of Pt/C, respectively, demonstrating the superiority of the core-shell metallic aerogels. The proposed core-based activity descriptor provides a new possible strategy for the design of future core-shell electrocatalysts. © 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  15. Genetic diversity and structure of core collection of winter mushroom (Flammulina velutipes) developed by genomic SSR markers.

    Science.gov (United States)

    Liu, Xiao Bin; Li, Jing; Yang, Zhu L

    2018-01-01

    A core collection is a subset of an entire collection that represents as much of the genetic diversity of the entire collection as possible. The establishment of a core collection for crops is practical for efficient management and use of germplasm. However, the establishment of a core collection of mushrooms is still in its infancy, and no established core collection of the economically important species Flammulina velutipes has been reported. We established the first core collection of F. velutipes , containing 32 strains based on 81 genetically different F. veltuipes strains. The allele retention proportion of the core collection for the entire collection was 100%. Moreover, the genetic diversity parameters (the effective number of alleles, Nei's expected heterozygosity, the number of observed heterozygosity, and Shannon's information index) of the core collection showed no significant differences from the entire collection ( p  > 0.01). Thus, the core collection is representative of the genetic diversity of the entire collection. Genetic structure analyses of the core collection revealed that the 32 strains could be clustered into 6 groups, among which groups 1 to 3 were cultivars and groups 4 to 6 were wild strains. The wild strains from different locations harbor their own specific alleles, and were clustered stringently in accordance with their geographic origins. Genetic diversity analyses of the core collection revealed that the wild strains possessed greater genetic diversity than the cultivars. We established the first core collection of F. velutipes in China, which is an important platform for efficient breeding of this mushroom in the future. In addition, the wild strains in the core collection possess favorable agronomic characters and produce unique bioactive compounds, adding value to the platform. More attention should be paid to wild strains in further strain breeding.

  16. Stable feature selection for clinical prediction: exploiting ICD tree structure using Tree-Lasso.

    Science.gov (United States)

    Kamkar, Iman; Gupta, Sunil Kumar; Phung, Dinh; Venkatesh, Svetha

    2015-02-01

    Modern healthcare is getting reshaped by growing Electronic Medical Records (EMR). Recently, these records have been shown of great value towards building clinical prediction models. In EMR data, patients' diseases and hospital interventions are captured through a set of diagnoses and procedures codes. These codes are usually represented in a tree form (e.g. ICD-10 tree) and the codes within a tree branch may be highly correlated. These codes can be used as features to build a prediction model and an appropriate feature selection can inform a clinician about important risk factors for a disease. Traditional feature selection methods (e.g. Information Gain, T-test, etc.) consider each variable independently and usually end up having a long feature list. Recently, Lasso and related l1-penalty based feature selection methods have become popular due to their joint feature selection property. However, Lasso is known to have problems of selecting one feature of many correlated features randomly. This hinders the clinicians to arrive at a stable feature set, which is crucial for clinical decision making process. In this paper, we solve this problem by using a recently proposed Tree-Lasso model. Since, the stability behavior of Tree-Lasso is not well understood, we study the stability behavior of Tree-Lasso and compare it with other feature selection methods. Using a synthetic and two real-world datasets (Cancer and Acute Myocardial Infarction), we show that Tree-Lasso based feature selection is significantly more stable than Lasso and comparable to other methods e.g. Information Gain, ReliefF and T-test. We further show that, using different types of classifiers such as logistic regression, naive Bayes, support vector machines, decision trees and Random Forest, the classification performance of Tree-Lasso is comparable to Lasso and better than other methods. Our result has implications in identifying stable risk factors for many healthcare problems and therefore can

  17. Sonochemical synthesis, structure and magnetic properties of air-stable Fe3O4/Au nanoparticles

    International Nuclear Information System (INIS)

    Wu Wei; He Quanguo; Chen Hong; Tang Jianxin; Nie Libo

    2007-01-01

    Air-stable nanoparticles of Fe 3 O 4 /Au were prepared via sonolysis of a solution mixture of hydrogen tetrachloroaureate(III) trihydrate (HAuCl 4 ) and (3-aminopropyl)triethoxysilane (APTES)-coated Fe 3 O 4 nanoparticles with further drop-addition of sodium citrate. The Fe 3 O 4 /Au nanoparticles were characterized by x-ray powder diffraction (XRD), ultraviolet-visible spectroscopy (UV-vis), scanning electron microscopy (SEM) with energy dispersive spectroscopy (EDS), transmission electron microscopy (TEM), x-ray photoelectron spectroscopy (XPS) and superconducting quantum interference device (SQUID) magnetometry. Nanoparticles of Fe 3 O 4 /Au obtained under appropriate conditions possess a very high saturation magnetization of about 63 emu g -1 and their average diameter is about 30 nm

  18. Structural response of reactor-core hexcan subassemblies subjected to dynamic overpressurization under accident conditions

    International Nuclear Information System (INIS)

    Pfeiffer, P.A.; Kulak, R.F.

    1993-01-01

    This paper presents a two-dimensional structural analysis for the evaluation of a single core subassembly due to internal overpressure associated with possible failure of fuel pins having high fission gas plenum pressure. Structural models are developed for the subassemblies and their surroundings with emphasis on the critical physical aspects of the problem. With these models the strains, deformations and the extent of permanent damage (plastic strain) to the subassemblies can be assessed. The nonlinear structural analyses was performed with a finite element program called STRAW (Structural Transient Response of Assembly Wrappers). This finite element program is applicable to nonlinear large displacement problems. The results of this study indicate that the permanent deformation (damage) is strongly influenced by the rise time (time to reach peak pressure) of the pressure pulse and the pressure in the fuel pin. The rise time is influenced by the opening time of the flow path for release of gas from the fuel pin plenum. Several examples are illustrated with various rise times and pressure magnitudes and the resulting permanent deformation of the hexcan wall

  19. Dynamic structural response of reactor-core subassemblies (hexcans) due to accident overpressurization

    International Nuclear Information System (INIS)

    Pfeiffer, P.A.; Kulak, R.F.

    1993-01-01

    This paper presents a two-dimensional structural analysis for the evaluation of a single core subassembly due to internal overpressure associated with possible failure of fuel pins having high fission gas plenum pressure. Structural models are developed for the subassemblies and their surroundings with emphasis on the critical physical aspects of the problem. With these models the strains, deformations and the extent of permanent damage (plastic strain) to the subassemblies can be assessed. The nonlinear structural analyses was performed with a finite element program called STRAW (Structural Transient Response of Assembly Wrappers). This finite element program is applicable to nonlinear large displacement problems. The results of this study indicate that the permanent deformation (damage) is strongly influenced by the rise time (time to reach peak pressure) of the pressure pulse and the pressure in the fuel pin. The rise time is influenced by the opening time of the flow path for release of gas from the fuel pin plenum. Several examples are illustrated with various rise times and pressure magnitudes and the resulting permanent deformation of the hexcan wall

  20. Dynamic structural response of reactor-core subassemblies (hexcans) due to accident overpressurization

    International Nuclear Information System (INIS)

    Pfeiffer, P.A.; Kulak, R.F.

    1993-01-01

    This paper presents a two-dimensional structural analysis for the evaluation of a single core subassembly due to internal overpressure associated with possible failure of fuel pins having high fission gas plenum pressure. Structural models are developed for the subassemblies and their surroundings with emphasis on the critical physical aspects of the problem. With these models the strains, deformations and the extent of permanent damage (plastic strain) to the subassemblies can be assessed. The nonlinear structural analyses was performed with a finite element program called STRAW (Structural Transient Response of Assembly Wrappers). This finite element program is applicable to nonlinear large displacement problems. The results of this study indicate that the permanent deformation (damage) is strongly influenced by the rise time (time to reach peak pressure) of the pressure pulse and the pressure in the fuel pin. The rise time is influenced by the opening time of the flow path for release of gas from the fuel pin plenum. Several examples are illustrated with various rise times and pressure magnitudes and the resulting permanent deformation of the hexcan wall. (author)

  1. The loadings and strength of nuclear power plant structures in core damage accidents

    International Nuclear Information System (INIS)

    Varpasuo, P.

    1994-01-01

    The reactor cavity of VVER-91 NPP is a thick-walled, cylindrical reinforced concrete structure. In case of molten core-water reaction during the severe reactor accident the load carrying capacity of the cavity structure is of interest against the short impulse type loading caused by the steam explosion phenomenon. The assumed size of the impulse was 20 kPa-s and the duration was 10 ms. This investigation was divided in several phases. First, the elastic response of the cavity was determined using the ABAQUS code. Next, the static response of the cavity was evaluated using elasto-plastic properties of reinforcement and concrete and also taking into account the cracking of the concrete. This analysis was done with the aid of ABAQUS/STANDARD and ANSYS codes and the obtained results agreed reasonably with each other. In order to obtain a qualitative picture of the behaviour of the structure under the impulse load a simplified single degree of freedorn model was developed. The hoop reinforcement of the cavity was taken as an elasto-plastic spring and the wall concrete acted as a mass. Using this model the suitable amount of hoop reinforcement was determined. In next phase, the dynamic analysis of the structure was attempted using elasto-plastic material properties and concrete cracking. (13 refs., 57 figs.)

  2. Estimation of photonic band gap in the hollow core cylindrical multilayer structure

    Science.gov (United States)

    Chourasia, Ritesh Kumar; Singh, Vivek

    2018-04-01

    The propagation characteristic of two hollow core cylindrical multilayer structures having high and low refractive index contrast of cladding regions have been studied and compared at two design wavelengths i.e. 1550 nm and 632.8 nm. With the help of transfer matrix method a relation between the incoming light wave and outgoing light wave has been developed using the boundary matching technique. In high refractive index contrast, small numbers of layers are sufficient to provide perfect band gap in both design wavelengths. The spectral position and width of band gap is highly depending on the optical path of incident light in all considered cases. For sensing application, the sensitivity of waveguide can be obtained either by monitoring the width of photonic band gap or by monitoring the spectral shift of photonic band gap. Change in the width of photonic band gap with the core refractive index is larger in high refractive index contrast of cladding materials. However, in the case of monitoring the spectral shift of band gap, the obtained sensitivity is large for low refractive index contrast of cladding materials and further it increases with increase of design wavelength.

  3. Structure analysis and core community detection of embodied resources networks among regional industries

    Science.gov (United States)

    He, Xijun; Dong, Yanbo; Wu, Yuying; Wei, Guodan; Xing, Lizhi; Yan, Jia

    2017-08-01

    To address the double pressure of scarce resources and regional industrial isomorphism, this paper applied the concepts of exergy and embodied resources based on economic input-output (I-O) data. We constructed the embodied resources networks among the regional industries of Beijing-Tianjin-Hebei (also known as Jing-Jin-Ji) in China. We analyzed the rules of embodied resources consumption in the area's industries, identified the core community structures, and studied the characteristics of industrial homogeneity through regional comparisons. The results showed that the dependence on scarce resources of industrial operations in Beijing was less than in Jin-Ji, while the dependence on finance, technology, information, and other service resources in Beijing was higher than in Jin-Ji. The I-O efficiency of embodied resources among industries and the agglomeration of correlation relationships in industries with large embodied resources were higher than in Jin-Ji. The industrial coincidence degree in the ;bridge; industries and in the core community in Jin-Ji was higher than in Jing-Jin and Jing-Ji, which means the industrial homogeneous competition of Jin-Ji was higher, too. This study makes a significant contribution toward promoting the dislocation development of regional industries, accelerating the coordination of resources, and reducing homogeneity competition.

  4. Dislocations in AlGaN: Core Structure, Atom Segregation, and Optical Properties.

    Science.gov (United States)

    Massabuau, Fabien C-P; Rhode, Sneha L; Horton, Matthew K; O'Hanlon, Thomas J; Kovács, András; Zielinski, Marcin S; Kappers, Menno J; Dunin-Borkowski, Rafal E; Humphreys, Colin J; Oliver, Rachel A

    2017-08-09

    We conducted a comprehensive investigation of dislocations in Al 0.46 Ga 0.54 N. Using aberration-corrected scanning transmission electron microscopy and energy dispersive X-ray spectroscopy, the atomic structure and atom distribution at the dislocation core have been examined. We report that the core configuration of dislocations in AlGaN is consistent with that of other materials in the III-Nitride system. However, we observed that the dissociation of mixed-type dislocations is impeded by alloying GaN with AlN, which is confirmed by our experimental observation of Ga and Al atom segregation in the tensile and compressive parts of the dislocations, respectively. Investigation of the optical properties of the dislocations shows that the atom segregation at dislocations has no significant effect on the intensity recorded by cathodoluminescence in the vicinity of the dislocations. These results are in contrast with the case of dislocations in In 0.09 Ga 0.91 N where segregation of In and Ga atoms also occurs but results in carrier localization limiting non-radiative recombination at the dislocation. This study therefore sheds light on why InGaN-based devices are generally more resilient to dislocations than their AlGaN-based counterparts.

  5. Structural implications of conserved aspartate residues located in tropomyosin's coiled-coil core.

    Science.gov (United States)

    Moore, Jeffrey R; Li, Xiaochuan; Nirody, Jasmine; Fischer, Stefan; Lehman, William

    2011-09-01

    Polar residues lying between adjacent α-helical chains of coiled-coils often contribute to coiled-coil curvature and flexibility, while more typical core hydrophobic residues anneal the chains together. In tropomyosins, ranging from smooth and skeletal muscle to cytoplasmic isoforms, a highly conserved Asp at residue 137 places negative charges within the tropomyosin coiled-coil core in a position which may affect the conformation needed for tropomyosin binding and regulatory movements on actin. Proteolytic susceptibility suggested that substituting a canonical Leu for the naturally occurring Asp at residue 137 increases inter-chain rigidity by stabilizing the tropomyosin coiled-coil. Using molecular dynamics, we now directly assess changes in coiled-coil curvature and flexibility caused by such mutants. Although the coiled-coil flexibility is modestly diminished near the residue 137 mutation site, as expected, a delocalized increase in flexibility along the overall coiled-coil is observed. Even though the average shape of the D137L tropomyosin is straighter than that of wild-type tropomyosin, it is still capable of binding actin due to this increase in flexibility. We conclude that the conserved, non-canonical Asp-137 destabilizes the local structure resulting in a local flexible region in the middle of tropomyosin that normally is important for tropomyosin steady-state equilibrium position on actin.

  6. Benthic Food Web Structure across the Canadian Arctic Ocean: Insights from stable isotopes and the IP25 biomarker

    Science.gov (United States)

    Friscourt, N.; Archambault, P.; Masse, G.; Nozais, C.

    2016-02-01

    In recent decades, the Arctic Ocean has undergone unprecedented changes, such as an increase in the surface temperature and a reduction of sea ice cover. These changes may cause variations in the intensity and spatial distribution of primary production and the nature of pelagic-benthic coupling. This could affect the amount and quality of organic matter that settles onto the seafloor, and the benthic communities that feed upon it. The objectives of this study were i) to describe the trophic structure and resilience of regional benthic food webs using stable carbon and nitrogen isotope analyses and ii) to evaluate the significance of ice algae in the diet of benthic communities using the sea ice proxy IP25. The study area extends from the North Water Polynya to the Chukchi Sea across five geographic regions (North Water Polynya, Canadian Archipelago, Amundsen Gulf, Beaufort Sea and Chukchi Sea) based on environmental factors. To reach these objectives, we collected particulate organic matter (POM), sediments and zoobenthic samples from July to October 2014 aboard the CCGS Amundsen. Stable isotope and IP25 data, the trophic structure within regions and comparison between regions will be presented. Potential impacts of climate change and human activities on benthic ecosystems in the Arctic are still difficult to assess because of the lack of baseline data. The baseline data once provided will enable us to make further predictions on how these changes may affect benthic food web structure.

  7. Soil structure stability and distribution of carbon in water-stable aggregates in different tilled and fertilized Haplic Luvisol

    Directory of Open Access Journals (Sweden)

    Vladimír Šimanský

    2012-01-01

    Full Text Available The influence of tillage and fertilization on soil structure stability and the distribution of carbon in water-stable aggregates of loamy Haplic Luvisol were studied. Soil samples from the locality of Dolná Malanta (experimental station of SUA Nitra were collected (in 2007–2009 from a depth of 0–0.2 m in two tillage variants: (1. conventional tillage, 2. minimal tillage and three treatments of fertilization: (1. without fertilization, 2. crop residues and NPK fertilizers, 3. NPK fertilizers. The minimal tillage system has a positive effect on both the aggregation processes and sequestration of carbon in size fractions of water-stable aggregates, as well as ploughing of crop residues together with NPK fertilizers. On the other hand, application of only NPK fertilizers had a negative effect on SOM content. Under the minimal tillage system and in treatment with crop residues together with NPK fertilizers, what has been observed is a statistically significant increase in the total organic carbon contents by increasing size fractions of water-stable aggregates. Organic carbon did not influence the aggregation processes with dependence on tillage systems. Under conventional tillage as well as in treatment with ploughing crop residues with NPK fertilizers, a very important effect on aggregation had bivalent cations Ca2+ and Mg2+.

  8. Pulse electrodeposition to prepare core-shell structured AuPt@Pd/C catalyst for formic acid fuel cell application

    Science.gov (United States)

    Lu, Xueyi; Luo, Fan; Song, Huiyu; Liao, Shijun; Li, Hualing

    2014-01-01

    A novel core-shell structured AuPt@Pd/C catalyst for the electrooxidation of formic acid is synthesized by a pulse electrodeposition process, and the AuPt core nanoparticles are obtained by a NaBH4 reduction method. The catalyst is characterized with X-ray powder diffraction and transmission electron microscopy, thermogravimetric analysis, cyclic voltammetry, CO stripping and X-ray photoelectron spectroscopy. The core-shell structure of the catalyst is revealed by the increase in particle size resulting from a Pd layer covering the AuPt core, and by a negative shift in the CO stripping peaks. The addition of a small amount of Pt improves the dispersion of Au and results in smaller core particles. The catalyst's activity is evaluated by cyclic voltammetry in formic acid solution. The catalyst shows excellent activity towards the anodic oxidation of formic acid, the mass activity reaches 4.4 A mg-1Pd and 0.83 A mg-1metal, which are 8.5 and 1.6 times that of commercial Pd/C. This enhanced electrocatalytic activity could be ascribed to the good dispersion of Au core particles resulting from the addition of Pt, as well as to the interaction between the Pd shell layer and the Au and Pt in the core nanoparticles.

  9. Using Powder Cored Tubular Wire Technology to Enhance Electron Beam Freeform Fabricated Structures

    Science.gov (United States)

    Gonzales, Devon; Liu, Stephen; Domack, Marcia; Hafley, Robert

    2016-01-01

    Electron Beam Freeform Fabrication (EBF3) is an additive manufacturing technique, developed at NASA Langley Research Center, capable of fabricating large scale aerospace parts. Advantages of using EBF3 as opposed to conventional manufacturing methods include, decreased design-to-product time, decreased wasted material, and the ability to adapt controls to produce geometrically complex parts with properties comparable to wrought products. However, to fully exploit the potential of the EBF3 process development of materials tailored for the process is required. Powder cored tubular wire (PCTW) technology was used to modify Ti-6Al-4V and Al 6061 feedstock to enhance alloy content, refine grain size, and create a metal matrix composite in the as-solidified structures, respectively.

  10. Interactions between tetrathiafulvalene units in dimeric structures – the influence of cyclic cores

    Directory of Open Access Journals (Sweden)

    Huixin Jiang

    2015-06-01

    Full Text Available A selection of cyclic and acyclic acetylenic scaffolds bearing two tetrathiafulvalene (TTF units was prepared by different metal-catalyzed coupling reactions. The bridge separating the two TTF units was systematically changed from linearly conjugated ethyne, butadiyne and tetraethynylethene (trans-substituted units to a cross-conjugated tetraethynylethene unit, placed in either acyclic or cyclic arrangements. The cyclic structures correspond to so-called radiaannulenes having both endo- and exocyclic double bonds. Interactions between two redox-active TTF units in these molecules were investigated by cyclic voltammetry, UV–vis–NIR and EPR absorption spectroscopical methods of the electrochemically generated oxidized species. The electron-accepting properties of the acetylenic cores were also investigated electrochemically.

  11. Nanofilms on Hollow Core Fiber-Based Structures: An Optical Study

    Science.gov (United States)

    Bravo, Javier; Matías, Ignacio R.; Del Villar, Ignacio; Corres, Jesús M.; Arregui, Francisco J.

    2006-05-01

    The optical characteristics of one multimode fiber (MMF)-hollow core fiber (HCF)-structure when a nanofilm is deposited on it has been theoretically and experimentally studied. The electrostatic self-assembly method has been used as the deposition technique, and the polymers chosen are polydiallyldimethylammonium and Poly R-478. Two different types of HCF have been used for the fabrication of the devices: 10/150 and 50/150 µm inner and outer diameters, respectively. Depending on several design parameters, the transmitted optical-power characteristic of the device experiences important changes that could be interesting towards development of several practical optical devices. The length and thickness of the HCF segment, the refractive index of the material deposited, the angle of the light when it reach the HCF section, and the wavelength of the light source will be analyzed.

  12. Effect of neutron radiation on mechanical properties of permanent near core structures

    International Nuclear Information System (INIS)

    Tavassoli, A.A.

    1988-01-01

    Several hundred specimens have been tested in order to assess the effects of low dose neutron radiation ( 0 C and ductility and toughness are primary design concerns, the changes provoked, by doses up to 1.3 dpa, in overall mechanical properties of welded joints are small. For upper core structure, where the operating temperature is about 550 0 C and fatigue and creep resistance are major design needs, the changes induced, through formation of up to about 2 appm helium, in conventional fatigue properties or fatigue with short hold times are negligible. With increasing hold time, intergranular rupture in irradiated specimens is enhanced but the limited number of tests does not allow definite conclusions to be drawn. 53 refs, 3 tabs, 9 figs

  13. The core and O-polysaccharide structure of the Caulobacter crescentus lipopolysaccharide.

    Science.gov (United States)

    Jones, Michael D; Vinogradov, Evgeny; Nomellini, John F; Smit, John

    2015-01-30

    Here we describe the analysis of the structure of the lipopolysaccharide (LPS) from Caulobacter crescentus strain JS1025, a derivative of C. crescentus CB15 NA1000 with an engineered amber mutation in rsaA, leading to the loss of the protein S-layer and gene CCNA_00471 encoding a putative GDP-L-fucose synthase. LPS was isolated using an aqueous membrane disruption method. Polysaccharide and core oligosaccharide were produced by mild acid hydrolysis and analyzed by nuclear magnetic resonance spectroscopy and chemical methods. Spectra revealed the presence of two polysaccharides, one of them, a rhamnan, could be removed using periodate oxidation. Another polymer, built from 4-amino-4-deoxy-D-rhamnose (perosamine), mannose, and 3-O-methyl-glucose, should be the O-chain of the LPS according to genetic data. The attribution of the rhamnan as a part of LPS or a separate polymer was not possible. Copyright © 2014 Elsevier Ltd. All rights reserved.

  14. Simulation of the thermalhydraulic behavior of a molten core within a structure, with the three dimensions three components TOLBIAC code

    Energy Technology Data Exchange (ETDEWEB)

    Spindler, B.; Moreau, G.M.; Pigny S. [Centre d`Etudes Nucleaires de Grenoble (France)

    1995-09-01

    The TOLBIAC code is devoted to the simulation of the behavior of a molten core within a structure (pressure vessel of core catcher), taking into account the relative position of the core components, the wall ablation and the crust formation. The code is briefly described: 3D model, physical properties and constitutive laws. wall ablation and crust model. Two results are presented: the simulation of the COPO experiment (natural convection with water in a 1/2 scale elliptic pressure vessel), and the simulation of the behavior of a corium in a PWR pressure vessel, with ablation and crust formation.

  15. Review of the SCDAP/RELAP5/MOD3.1 code structure and core T/H model before core damage

    International Nuclear Information System (INIS)

    Kim, See Darl; Kim, Dong Ha

    1998-04-01

    The SCDAP/RELAP5 code has been developed for best estimate transient simulation of light water reactor coolant systems during a severe accident. The code is being developed at the INEL under the primary sponsorship of the Office of Nuclear Regulatory Research of the U.S. NRC. As The current time, the SCDAP/RELAP5/MOD3.1 code is the result of merging the RELAP5/MOD3 and SCDAP models. The code models the coupled behavior of the reactor coolant system, core, fission product released during a severe accident transient as well as large and small break loss of coolant accidents, operational transients such as anticipated transient without SCRAM, loss of offsite power, loss of feedwater, and loss of flow. Major purpose of the report is to provide information about the characteristics of SCDAP/RELAP5/MOD3.1 core T/H models for an integrated severe accident computer code being developed under the mid/long-term project. This report analyzes the overall code structure which consists of the input processor, transient controller, and plot file handler. The basic governing equations to simulate the thermohydraulics of the primary system are also described. As the focus is currently concentrated in the core, core nodalization parameters of the intact geometry and the phenomenological subroutines for the damaged core are summarized for the future usage. In addition, the numerical approach for the heat conduction model is investigated along with heat convection model. These studies could provide a foundation for input preparation and model improvement. (author). 6 refs., 3 tabs., 4 figs

  16. Continuous one-pot synthesis of sandwich structured core-shell particles and transformation to yolk-shell particles.

    Science.gov (United States)

    Ko, You Na; Kang, Yun Chan; Park, Seung Bin

    2013-05-10

    Scalable continuous ultrasonic spray pyrolysis is used to develop a facile one-pot method of synthesizing sandwich structured core-shell particles consisting of a Pd core, a V2O5 inner layer, and a porous SiO2 outer layer. Pd@SiO2 yolk-shell particles are easily formed by removing the V2O5 inner layer.

  17. Late Quaternary lake-level changes constrained by radiocarbon and stable isotope studies on sediment cores from Lake Titicaca, South America

    Science.gov (United States)

    Rowe, Harold D.; Guilderson, Thomas P.; Dunbar, Robert B.; Southon, John R.; Seltzer, Geoffrey O.; Mucciarone, David A.; Fritz, Sherilyn C.; Baker, Paul A.

    2003-09-01

    We present and compare AMS- 14C geochronologies for sediment cores recovered from Lake Titicaca, South America. Radiocarbon dates from three core sites constrain the timing of late Quaternary paleoenvironmental changes in the Central Andes and highlight the site-specific factors that limit the radiocarbon geochronometer. With the exception of mid-Holocene sediments, all cores are generally devoid of macrophyte fragments, thus bulk organic fractions are used to build core chronologies. Comparisons of radiocarbon results for chemically defined fractions (bulk decalcified, humate, humin) suggest that ages derived from all fractions are generally coherent in the post-13,500 yr BP time interval. In the pre-13,500 yr BP time interval, ages derived from humate extracts are significantly younger (300-7000 years) than ages from paired humin residues. Gross age incoherencies between paired humate and humin sub-fractions in pre-13,500 yr BP sediments from all core sites probably reflect the net downward migration of humates. Ages derived from bulk decalcified fractions at our shallow water (90 m) and deep water (230 m) core sites consistently fall between ages derived from humate and humin sub-fractions in the pre-13,500 yr BP interval, reflecting that the bulk decalcified fraction is predominantly a mixture of humate and humin sub-fractions. Bulk decalcified ages from the pre-13,500 yr BP interval at our intermediate depth core site (150 m) are consistently older than humate (youngest) and humin sub-fractions. This uniform, reproducible pattern can be explained by the mobilization of a relatively older organic sub-fraction during and after the re-acidification step following the alkaline treatment of the bulk sediment. The inferred existence of this 'alkali-mobile, acid-soluble' sub-fraction implies a different depositional/post-depositional history that is potentially associated with a difference in source material. While internally consistent geochronologies can be

  18. DNA-based stable isotope probing: a link between community structure and function

    International Nuclear Information System (INIS)

    Uhlik, Ondrej; Jecna, Katerina; Leigh, Mary Beth; Mackova, Martina; Macek, Tomas

    2009-01-01

    DNA-based molecular techniques permit the comprehensive determination of microbial diversity but generally do not reveal the relationship between the identity and the function of microorganisms. The first direct molecular technique to enable the linkage of phylogeny with function is DNA-based stable isotope probing (DNA-SIP). Applying this method first helped describe the utilization of simple compounds, such as methane, methanol or glucose and has since been used to detect microbial communities active in the utilization of a wide variety of compounds, including various xenobiotics. The principle of the method lies in providing 13C-labeled substrate to a microbial community and subsequent analyses of the 13C-DNA isolated from the community. Isopycnic centrifugation permits separating 13C-labeled DNA of organisms that utilized the substrate from 12C-DNA of the inactive majority. As the whole metagenome of active populations is isolated, its follow-up analysis provides successful taxonomic identification as well as the potential for functional gene analyses. Because of its power, DNA-SIP has become one of the leading techniques of microbial ecology research. But from other point of view, it is a labor-intensive method that requires careful attention to detail during each experimental step in order to avoid misinterpretation of results.

  19. Conjugated organic framework with three-dimensionally ordered stable structure and delocalized π clouds

    Science.gov (United States)

    Guo, Jia; Xu, Yanhong; Jin, Shangbin; Chen, Long; Kaji, Toshihiko; Honsho, Yoshihito; Addicoat, Matthew A.; Kim, Jangbae; Saeki, Akinori; Ihee, Hyotcherl; Seki, Shu; Irle, Stephan; Hiramoto, Masahiro; Gao, Jia; Jiang, Donglin

    2013-01-01

    Covalent organic frameworks are a class of crystalline organic porous materials that can utilize π–π-stacking interactions as a driving force for the crystallization of polygonal sheets to form layered frameworks and ordered pores. However, typical examples are chemically unstable and lack intrasheet π-conjugation, thereby significantly limiting their applications. Here we report a chemically stable, electronically conjugated organic framework with topologically designed wire frameworks and open nanochannels, in which the π conjugation-spans the two-dimensional sheets. Our framework permits inborn periodic ordering of conjugated chains in all three dimensions and exhibits a striking combination of properties: chemical stability, extended π-delocalization, ability to host guest molecules and hole mobility. We show that the π-conjugated organic framework is useful for high on-off ratio photoswitches and photovoltaic cells. Therefore, this strategy may constitute a step towards realizing ordered semiconducting porous materials for innovations based on two-dimensionally extended π systems. PMID:24220603

  20. Cationic niosomes an effective gene carrier composed of novel spermine-derivative cationic lipids: effect of central core structures.

    Science.gov (United States)

    Opanasopit, Praneet; Leksantikul, Lalita; Niyomtham, Nattisa; Rojanarata, Theerasak; Ngawhirunpat, Tanasait; Yingyongnarongkul, Boon-Ek

    2017-05-01

    Cationic niosomes formulated from Span 20, cholesterol (Chol) and novel spermine-based cationic lipids of multiple central core structures (di(oxyethyl)amino, di(oxyethyl)amino carboxy, 3-amino-1,2-dioxypropyl and 2-amino-1,3-dioxypropyl) were successfully prepared for improving transfection efficiency in vitro. The niosomes composed of spermine cationic lipid with central core structure of di(oxyethyl)amino revealed the highest gene transfection efficiency. To investigate the factors affecting gene transfection and cell viability including differences in the central core structures of cationic lipids, the composition of vesicles, molar ratio of cationic lipids in formulations and the weight ratio of niosomes to DNA. Cationic niosomes composed of nonionic surfactants (Span20), cholesterol and spermine-based cationic lipids of multiple central core structures were formulated. Gene transfection and cell viability were evaluated on a human cervical carcinoma cell line (HeLa cells) using pDNA encoding green fluorescent protein (pEGFP-C2). The morphology, size and charge were also characterized. High transfection efficiency was obtained from cationic niosomes composed of Span20:Chol:cationic lipid at the molar ratio of 2.5:2.5:0.5 mM. Cationic lipids with di(oxyethyl)amino as a central core structure exhibited highest transfection efficiency. In addition, there was also no serum effect on transfection efficiency. These novel cationic niosomes may constitute a good alternative carrier for gene transfection.

  1. Fast defluorination and removal of norfloxacin by alginate/Fe@Fe3O4 core/shell structured nanoparticles.

    Science.gov (United States)

    Niu, Hongyun; Dizhang; Meng, Zhaofu; Cai, Yaqi

    2012-08-15

    Alginate-Fe(2+)/Fe(3+) polymer coated Fe(3)O(4) magnetic nanoparticles (Fe(3)O(4)@ALG/Fe MNPs) with core/shell structure are prepared and used as heterogeneous Fenton nanocatalyst to degrade norfloxacin (NOF). The Fenton-like process based on Fe(3)O(4)@ALG/Fe shows much higher efficiency on NOF degradation. Compared with Fe(3)O(4) nanoparticle-H(2)O(2) system, NOF degradation in Fe(3)O(4)@AlG/Fe-H(2)O(2) system can be conducted in a wide pH range (pH 3.5-6.5) and independent on temperature. With 0.98 mM H(2)O(2) and 0.4 g L(-1) Fe(3)O(4)@ALG/Fe, 100% of NOF and 90% of TOC is removed within 60 min, and the fluorine element in NOF molecule changes into F(-) ions within 1 min, indicating that NOF degradation in this Fenton-like reaction is performed through direct defluorination pathway. XPS analysis shows that TOC removal in reaction solution mainly results from the adsorption of NOF degradation intermediates on catalyst. Due to the paramagneticity and high saturation magnetization of Fe(3)O(4)@ALG/Fe, the used catalyst with adsorbed NOF intermediate is collected from aqueous solution by applying an external magnetic field, leading to complete removal of NOF from water samples. As being composed of inorganic materials and biopolymer, Fe(3)O(4)@ALG/Fe MNPs are robust, thermo-stable, nontoxic and environmentally friendly. These attractive features endow Fe(3)O(4)@ALG/Fe as a potent Fenton-like catalyst for fluoroquinolones degradation. Copyright © 2012 Elsevier B.V. All rights reserved.

  2. Structure of the protein core of the glypican Dally-like and localization of a region important for hedgehog signaling

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Min-Sung; Saunders, Adam M.; Hamaoka, Brent Y.; Beachy, Philip A.; Leahy, Daniel J. (Stanford-MED); (JHU)

    2011-09-20

    Glypicans are heparan sulfate proteoglycans that modulate the signaling of multiple growth factors active during animal development, and loss of glypican function is associated with widespread developmental abnormalities. Glypicans consist of a conserved, approximately 45-kDa N-terminal protein core region followed by a stalk region that is tethered to the cell membrane by a glycosyl-phosphatidylinositol anchor. The stalk regions are predicted to be random coil but contain a variable number of attachment sites for heparan sulfate chains. Both the N-terminal protein core and the heparan sulfate attachments are important for glypican function. We report here the 2.4-{angstrom} crystal structure of the N-terminal protein core region of the Drosophila glypican Dally-like (Dlp). This structure reveals an elongated, {alpha}-helical fold for glypican core regions that does not appear homologous to any known structure. The Dlp core protein is required for normal responsiveness to Hedgehog (Hh) signals, and we identify a localized region on the Dlp surface important for mediating its function in Hh signaling. Purified Dlp protein core does not, however, interact appreciably with either Hh or an Hh:Ihog complex.

  3. Measuring stable isotopes of hydrogen and oxygen in ice by means of laser spectrometry : The Bolling transition in the Dye-3 (south Greenland) ice core

    NARCIS (Netherlands)

    Trigt, R. van; Meijer, H.A.J.; Sveinbjornsdottir, A.E.; Johnsen, S.J.; Kerstel, E.R.Th.

    2002-01-01

    We report on the first application of a new technique in ice-core research, based on direct absorption infrared laser spectrometry (LS), for measuring H-2 O-17 and O-18 isotope ratios. The data are used to calculate the deuterium excess d (defined as delta(2)H - 8delta(18)O) for a section of the

  4. Optimized multi-step NMR-crystallography approach for structural characterization of a stable quercetin solvate.

    Science.gov (United States)

    Filip, Xenia; Miclaus, Maria; Martin, Flavia; Filip, Claudiu; Grosu, Ioana Georgeta

    2017-05-10

    Herein we report the preparation and solid state structural investigation of the 1,4-dioxane-quercetin solvate. NMR crystallography methods were employed for crystal structure determination of the solvate from microcrystalline powder. The stability of the compound relative to other reported quercetin solvates is discussed and found to be in perfect agreement with the hydrogen bonding networks/supra-molecular architectures formed in each case. It is also clearly shown that NMR crystallography represents an ideal analytical tool in such cases when hydrogen-bonding networks are required to be constrained at a high accuracy level. Copyright © 2017 Elsevier B.V. All rights reserved.

  5. Free energy and structure of dislocation cores in two-dimensional crystals

    NARCIS (Netherlands)

    Bladon, P.B.; Frenkel, D.

    2004-01-01

    The nature of the melting transition in two dimensions is critically dependent on the core energy of dislocations. In this paper, we report calculations of the core free energy and the core size of dislocations in two-dimensional solids of systems interacting via square well, hard disk, and r-12

  6. A hypoplastic constitutive model for clays with meta-stable structure

    Czech Academy of Sciences Publication Activity Database

    Mašín, David

    2007-01-01

    Roč. 44, č. 3 (2007), s. 363-375 ISSN 0008-3674 R&D Projects: GA AV ČR(CZ) IAA200710605 Institutional research plan: CEZ:AV0Z20710524 Keywords : constitutive relations * hypoplasticity * clays * structure of soils Subject RIV: JM - Building Engineering Impact factor: 0.542, year: 2007

  7. Structurally stable design of output regulation for a class of nonlinear systems

    Czech Academy of Sciences Publication Activity Database

    Villanueva-Novelo, C.; Čelikovský, Sergej; Castillo-Toledo, B.

    2001-01-01

    Roč. 37, č. 5 (2001), s. 517-561 ISSN 0023-5954 R&D Projects: GA ČR GA102/99/1368 Institutional research plan: AV0Z1075907 Keywords : nonlinear systems * structural stability * output regulation Subject RIV: BC - Control Systems Theory Impact factor: 0.316, year: 2001

  8. Atomic-scale structure and properties of highly stable antiphase boundary defects in Fe3O4.

    Science.gov (United States)

    McKenna, Keith P; Hofer, Florian; Gilks, Daniel; Lazarov, Vlado K; Chen, Chunlin; Wang, Zhongchang; Ikuhara, Yuichi

    2014-12-10

    The complex and intriguing properties of the ferrimagnetic half metal magnetite (Fe 3 O 4 ) are of continuing fundamental interest as well as being important for practical applications in spintronics, magnetism, catalysis and medicine. There is considerable speculation concerning the role of the ubiquitous antiphase boundary (APB) defects in magnetite, however, direct information on their structure and properties has remained challenging to obtain. Here we combine predictive first principles modelling with high-resolution transmission electron microscopy to unambiguously determine the three-dimensional structure of APBs in magnetite. We demonstrate that APB defects on the {110} planes are unusually stable and induce antiferromagnetic coupling between adjacent domains providing an explanation for the magnetoresistance and reduced spin polarization often observed. We also demonstrate how the high stability of the {110} APB defects is connected to the existence of a metastable bulk phase of Fe 3 O 4 , which could be stabilized by strain in films or nanostructures.

  9. Crystal Structure of the Core Region of Hantavirus Nucleocapsid Protein Reveals the Mechanism for Ribonucleoprotein Complex Formation

    Science.gov (United States)

    Guo, Yu; Wang, Wenming; Sun, Yuna; Ma, Chao; Wang, Xu; Wang, Xin; Liu, Pi; Shen, Shu; Li, Baobin; Lin, Jianping; Deng, Fei

    2015-01-01

    ABSTRACT Hantaviruses, which belong to the genus Hantavirus in the family Bunyaviridae, infect mammals, including humans, causing either hemorrhagic fever with renal syndrome (HFRS) or hantavirus cardiopulmonary syndrome (HCPS) in humans with high mortality. Hantavirus encodes a nucleocapsid protein (NP) to encapsidate the genome and form a ribonucleoprotein complex (RNP) together with viral polymerase. Here, we report the crystal structure of the core domains of NP (NPcore) encoded by Sin Nombre virus (SNV) and Andes virus (ANDV), which are two representative members that cause HCPS in the New World. The constructs of SNV and ANDV NPcore exclude the N- and C-terminal portions of full polypeptide to obtain stable proteins for crystallographic study. The structure features an N lobe and a C lobe to clamp RNA-binding crevice and exhibits two protruding extensions in both lobes. The positively charged residues located in the RNA-binding crevice play a key role in RNA binding and virus replication. We further demonstrated that the C-terminal helix and the linker region connecting the N-terminal coiled-coil domain and NPcore are essential for hantavirus NP oligomerization through contacts made with two adjacent protomers. Moreover, electron microscopy (EM) visualization of native RNPs extracted from the virions revealed that a monomer-sized NP-RNA complex is the building block of viral RNP. This work provides insight into the formation of hantavirus RNP and provides an understanding of the evolutionary connections that exist among bunyaviruses. IMPORTANCE Hantaviruses are distributed across a wide and increasing range of host reservoirs throughout the world. In particular, hantaviruses can be transmitted via aerosols of rodent excreta to humans or from human to human and cause HFRS and HCPS, with mortalities of 15% and 50%, respectively. Hantavirus is therefore listed as a category C pathogen. Hantavirus encodes an NP that plays essential roles both in RNP formation and

  10. Preparation, and Luminescence Properties of SiO2@Sm(MABA-Siphen Core-Shell Structure Nanometer Composite

    Directory of Open Access Journals (Sweden)

    Feng Li-Na

    2018-01-01

    Full Text Available A novel ternary samarium complex was prepared using HOOCC6H4N(CONH(CH23Si- (OCH2CH332 (MABA-Si as first ligand, and phen as second ligand. The corresponding SiO2@Sm(MABA-Siphen core-shell structure nanometer composite was synthesized as well, and the silica spheres was the core, and the ternary samarium complex was the shell layer. The ternary samarium complex has been characterized by element analysis, molar conductivity and IR spectra. The results show that the chemical formula of the complex is Sm(MABA-Si(phen2(ClO43·2H2O. The fluorescent spectra illustrat that the luminescence properties of the samarium complex are superior. The core-shell structure of SiO2@Sm(MABA-Siphen nanometer composite is characterized by SEM, TEM and IR spectra. The SiO2@Sm(MABA-Siphen core-shell structure composites exhibit stronger emission intensity than the ternary samarium complex. The fluorescence lifetime of the complex and core-shell structure composite is measured as well.

  11. Physical properties of the Yaxcopoil-1 deep drill core, Chicxulub impact structure, Mexico

    Science.gov (United States)

    Elbra, Tiiu; Pesonen, Lauri J.

    2011-11-01

    The Chicxulub structure in Mexico, one of the largest impact structures on Earth, was formed 65 Ma by a hypervelocity impact that led to the large mass extinction at the K-Pg boundary. The Chicxulub impact structure is well preserved, but is buried beneath a sequence of carbonate sediments and, thus, requires drilling to obtain subsurface information. The Chicxulub Scientific Drilling Program was carried out at Hacienda Yaxcopoil in the framework of the International Continental Scientific Drilling Program in 2001-2002. The structure was cored from 404 m down to 1511 m, through three intervals: 794 m of postimpact Tertiary sediments, a 100 m thick impactite sequence, and 616 m of preimpact Cretaceous rocks thought to represent a suite of megablocks. Physical property investigations show that the various lithologies, including the impactite units and the K-Pg boundary layer, can be characterized by their physical properties, which depend on either changes in fabric or on mineralogical variations. The magnetic properties show mostly dia- or paramagnetic behavior, with the exception of the impactite units that indicate the presence of ferromagnetic, probably hydrothermally deposited magnetite and pyrrhotite. The magnetic fraction contributes mainly to enhanced magnetization in the impactite lithologies and, in this way, to the observed magnetic anomalies. The shape and orientation of the magnetic grains are varied and reflect inhomogeneous fabric development and the influence of impact-related redeposition and hydrothermal activity. The Chicxulub impact occurred at the time of the reverse polarity geomagnetic chron 29R, and this finding is consistent with the age of the K-Pg boundary.

  12. Fabrication of Core-Shell Structural SiO2@H3[PM12O40] Material and Its Catalytic Activity

    Directory of Open Access Journals (Sweden)

    Xin Yang

    2014-01-01

    Full Text Available Through a natural tree grain template and sol-gel technology, the heterogeneous catalytic materials based on polyoxometalate compounds H3[PM12O40] encapsulating SiO2: SiO2@H3[PM12O40] (SiO2@PM12, M = W, Mo with core-shell structure had been prepared. The structure and morphology of the core-shell microspheres were characterized by the XRD, IR spectroscopy, UV-Vis absorbance, and SEM. These microsphere materials can be used as heterogeneous catalysts with high activity and stability for catalytic wet air oxidation of pollutant dyes safranine T (ST at room condition. The results show that the catalysts have excellent catalytic activity in treatment of wastewater containing 10 mg/L ST, and 94% of color can be removed within 60 min. Under different cycling runs, it is shown that the catalysts are stable under such operating conditions and the leaching tests show negligible leaching effect owing to the lesser dissolution.

  13. Structural changes, market concentration and vertical integration: would they lead to more stable markets

    International Nuclear Information System (INIS)

    Tahmassebi, H.

    1991-01-01

    This communication is concerned with three major developments that are likely to have significant impact on the future structure of world oil markets: oil company mergers and acquisitions, shift of exploration and production activity from the United States to overseas, and joint venture agreements between producing countries and oil companies aimed at further downstream integration by OPEC. The last two developments are likely to contribute substantially to price and market stability in the future

  14. Impact of Nonfullerene Acceptor Core Structure on the Photophysics and Efficiency of Polymer Solar Cells

    KAUST Repository

    Alamoudi, Maha

    2018-03-02

    Small-molecule “nonfullerene” acceptors are promising alternatives to fullerene (PC61/71BM) derivatives often used in bulk heterojunction (BHJ) organic solar cells; yet, the efficiency-limiting processes and their dependence on the acceptor structure are not clearly understood. Here, we investigate the impact of the acceptor core structure (cyclopenta-[2,1-b:3,4-b′]dithiophene (CDT) versus indacenodithiophene (IDTT)) of malononitrile (BM)-terminated acceptors, namely CDTBM and IDTTBM, on the photophysical characteristics of BHJ solar cells. Using PCE10 as donor polymer, the IDTT-based acceptor achieves power conversion efficiencies (8.4%) that are higher than those of the CDT-based acceptor (5.6%) because of a concurrent increase in short-circuit current and open-circuit voltage. Using (ultra)fast transient spectroscopy we demonstrate that reduced geminate recombination in PCE10:IDTTBM blends is the reason for the difference in short-circuit currents. External quantum efficiency measurements indicate that the higher energy of interfacial charge-transfer states observed for the IDTT-based acceptor blends is the origin of the higher open-circuit voltage.

  15. Structure-property relationship in core-shell rubber toughened epoxy nanocomposites

    Science.gov (United States)

    Gam, Ki Tak

    The structure-property relationships of epoxy nanocomposites with inorganic layer-structure nanofillers have been studied to obtain the fundamental understanding of the role of nanofillers and the physics of polymer nanocomposites in this dissertation. Several polymer nanocomposite systems with modified montmorillonite (MMT) or alpha-zirconium phosphate (ZrP) nanofillers were prepared with epoxy matrices of different ductility and properties. The successful nanofiller's exfoliations were confirmed with X-ray diffraction and transmission electronic microscopy (TEM). Dynamic mechanical analysis (DMA) on the prepared epoxy nanocomposites revealed the significant increase in rubbery plateau moduli of the epoxy nanocomposite systems above Tg, as high as 4.5 times, and tensile test results showed improved modulus by the nanofiller addition, while the fracture toughness was not affected or slightly decreased by nanofillers. The brittle epoxy nanocomposite systems were toughened with core shell rubber (CSR) particles and showed remarkable increase in fracture toughness (KIC) value up to 270%. The CSR toughening is more effective at ductile matrices, and TEM observation indicates that major toughening mechanisms induced by the CSR addition involve a large scale CSR cavitation, followed by massive shear deformation of the matrix.

  16. Fabrication and Testing of Durable Redundant and Fluted-Core Joints for Composite Sandwich Structures

    Science.gov (United States)

    Lin, Shih-Yung; Splinter, Scott C.; Tarkenton, Chris; Paddock, David A.; Smeltzer, Stanley S.; Ghose, Sayata; Guzman, Juan C.; Stukus, Donald J.; McCarville, Douglas A.

    2013-01-01

    The development of durable bonded joint technology for assembling composite structures is an essential component of future space technologies. While NASA is working toward providing an entirely new capability for human space exploration beyond low Earth orbit, the objective of this project is to design, fabricate, analyze, and test a NASA patented durable redundant joint (DRJ) and a NASA/Boeing co-designed fluted-core joint (FCJ). The potential applications include a wide range of sandwich structures for NASA's future launch vehicles. Three types of joints were studied -- splice joint (SJ, as baseline), DRJ, and FCJ. Tests included tension, after-impact tension, and compression. Teflon strips were used at the joint area to increase failure strength by shifting stress concentration to a less sensitive area. Test results were compared to those of pristine coupons fabricated utilizing the same methods. Tensile test results indicated that the DRJ design was stiffer, stronger, and more impact resistant than other designs. The drawbacks of the DRJ design were extra mass and complex fabrication processes. The FCJ was lighter than the DRJ but less impact resistant. With barely visible but detectable impact damages, all three joints showed no sign of tensile strength reduction. No compression test was conducted on any impact-damaged sample due to limited scope and resource. Failure modes and damage propagation were also studied to support progressive damage modeling of the SJ and the DRJ.

  17. Novel structural features of the immunocompetent ceramide phospho-inositol glycan core from Trichomonas vaginalis.

    Science.gov (United States)

    Heiss, Christian; Wang, Zhirui; Black, Ian; Azadi, Parastoo; Fichorova, Raina N; Singh, Bibhuti N

    2016-01-01

    The ceramide phosphoinositol glycan core (CPI-GC) of the lipophosphoglycan of Trichomonas vaginalis is a major virulent factor of this common genitourinary parasite. While its carbohydrate composition has been reported before, its structure has remained largely unknown. We isolated the glycan portions of CPI-GC by nitrous acid deamination and hydrofluoric acid treatment and investigated their structures by methylation analysis and 1- and 2-D NMR. We found that the α-anomer of galactose is a major constituent of CPI-GC. The β-anomer was found exclusively at the non-reducing end of CPI-GC side chains. Furthermore the data showed that the rhamnan backbone is more complex than previously thought and that the inositol residue at the reducing end is linked to a 4-linked α-glucuronic acid (GlcA) residue. This appears to be the most striking and novel feature of this GPI-anchor type molecule. Copyright © 2015 Elsevier Ltd. All rights reserved.

  18. Phase-change core/shell structured nanofibers based on eicosane/poly(vinylidene fluoride) for thermal storage applications

    Energy Technology Data Exchange (ETDEWEB)

    Do, Cong Van [Vietnam Academy of Science and Technology, Hanoi (Viet Nam); Nguyen, Thuy Thu Thi; Park, Jun Seo [Hankyong National University, Anseong (Korea, Republic of)

    2013-07-15

    We fabricated eicosane/poly(vinylidene fluoride) (PVDF) core/shell nanofibers by melt coaxial electrospinning as potential heat-storage applications. Eicosane, a hydrocarbon with melting point near the human body temperature and high latent heat, was chosen as the core material. Melted eicosane and PVDF solutions were coaxially electrospun using a double spinneret, in which melted eicosane was fed at 0.090-0.210 mL/h while the feeding rate of PVDF solution was maintained constant at 1.500 mL/h. The applied voltage and working distance were maintained constant at 12 kV and 17 cm, respectively. Good core/shell structure of nanofibers was observed at core feed rates of 0.090-0.180mL/h by transmission electron microscopy. Differential scanning calorimetry and thermogravimetric analysis values indicated good thermal stability and high energy-storage capacity of the obtained nanofibers. The highest amount of eicosane encapsulated in the electrospun core/shell nanofibers reached 32.5 wt% at core feed rate 0.180 mL/h and had a latent heat of 77 J/g at melting point 39.2 .deg. C. These shape-stabilized core/shell composite nanofibers showed good thermoregulating properties and had sufficiently high tensile strength for potential energy-storage applications, especially in smart textiles.

  19. Hegemonic Decline, West European Unification, and the Future Structure of the Core

    Directory of Open Access Journals (Sweden)

    Volker Bornschier

    1995-08-01

    Full Text Available This paper queries the applicability of hegemonic cycle theories to the emerging structure in the core of the world political economy and argues that we are likely, following this period of relative decline in American hegemony, to witness the emergence of hegemonic social practices in the absence, however, of a hegemonic state. Contrasting new beginnings with past patterns, we will suggest arguments why history will not be repeated. Drawing on our research on the Single European Act (SEA, we argue that the bargain struck between the Commission of the European Union and West European transnational corporations, which culminated in the SEA, represents more than a decisive step towards economic and political union. We see it, more significantly, as embodying Europe's response to its declining position through an attempt to articulate a new societal model capable of successfully replacing the disarticulated post-WWII Keynesian social-welfare model, and of competing with the Japanese and American societal models. In the future, it is very unlikely that power among the actors in the Triad will be so unevenly distributed as to permit the rise of a new hegemonic state. While it would seem, judging from historical experience, that the presence of a hegemonic state was functionally necessary for the establishment of hegemonic social practices in the core, we argue that another mechanism has now moved to the forefront. Due to pressures generated through increasing economic globalization, linked to demands associated with the quest for legitimacy on the part of democratic governments, we foresee, following a period of increased economic competition, the convergence of social practices around a single societal model.

  20. Core/shell nanostructured Na3V2(PO4)3/C/TiO2 composite nanofibers as a stable anode for sodium-ion batteries

    Science.gov (United States)

    Zhu, Qing; Wang, Man; Nan, Bo; Shi, Haohong; Zhang, Xinmei; Deng, Yonghong; Wang, Liping; Chen, Quanqi; Lu, Zhouguang

    2017-09-01

    Na3V2(PO4)3/C/TiO2 (NVP/C/TiO2) composite nanofibers with core/shell nanostructure are prepared by coaxial electrospinning plus heat treatment method. The physical and electrochemical performances of NVP/C/TiO2 nanofibers are investigated by X-ray diffraction, scanning electron microscopy, transmission electron microscopy and electrochemical tests. The results show that the composite nanofibers are made of TiO2/C nanoparticles shell and Na3V2(PO4)3/C nanofibers core with embedded TiO2/C nanoparticles. NVP/C/TiO2 nanofibers exhibite much better electrochemical performance than both TiO2/C and Na3V2(PO4)3/C nanofibers prepared by coaxial electrospinning method. The core-shelled NVP/C/TiO2 nanofibers delivere a reversible capacity of 196.1 mAh g-1 at 0.2C (35.6 mA g-1) in the voltage of 0.01-3.0 V (vs.Na+/Na), which is higher than the theoretical capacity of 178 mAh g-1 for Na3V2(PO4)3 and that of TiO2/C composite. NVP/C/TiO2 also displays excellent cycle stability and rate capability. Even at a high rate of 20C, it can still release a high reversible charge capacity of 109 mAh g-1 and retain a capacity of more than 70 mAh g-1 after 1500 cycles. The special microstructure and synergetic effects of Na3V2(PO4)3, conductive carbon and ultrafine TiO2 are responsible for the excellent electrochemical performance. This facile strategy exhibits superiority in fabricating core-shell nanostructured composite nanofibers as promising electrode materials for energy storage devices.

  1. One-pot reverse microemulsion synthesis of core-shell structured YVO4:Eu3+@SiO2 nanocomposites

    Science.gov (United States)

    Liu, Lina; Yue, Surong; Zhang, Yongsheng; Qin, Ruifei; Liu, Lishuang; Zhang, Dongmei; Sun, Ruirui; Chen, Linfeng

    2015-01-01

    Core-shell structured YVO4:Eu3+@SiO2 nanocomposite particles were synthesized using a one-pot reverse microemulsion method and characterized by X-ray diffraction (XRD), transmission electron microscopy (TEM), UV absorption spectra, and photoluminescent spectra. The nanocomposite particles are well-dispersed and about 20 nm in average size. The synthesis method is of one-pot, simplifying the preparation of this kind of core-shell structured nanocomposites. The formation process of these nanocomposite particles is suggested and the photoluminescence properties of them are studied and compared with those of uncoated YVO4:Eu3+ sample.

  2. Stable isotope evidence of long-term changes in North Sea food web structure

    DEFF Research Database (Denmark)

    Richardson, Katherine; Christensen, Jens Tang

    2008-01-01

    coast. Porpoises collected after ~1960 had significantly lower d15N than porpoises collected earlier. This change in d15N implies that fundamental changes in food web structure in, or nutrient availability to, the North Sea have taken place over the last ~150 yr and that most of the change occurred over...... reported here may be a reflection of a change in the isotope signature of nitrogen entering the food web. Regardless of its underlying cause, the recorded change in isotopic signature in harbour porpoises is noteworthy as it represents the first fisheries-independent documentation of a long-term temporal...

  3. Focused library with a core structure extracted from natural products and modified: application to phosphatase inhibitors and several biochemical findings.

    Science.gov (United States)

    Hirai, Go; Sodeoka, Mikiko

    2015-05-19

    Synthesis of a focused library is an important strategy to create novel modulators of specific classes of proteins. Compounds in a focused library are composed of a common core structure and different diversity structures. In this Account, we describe our design and synthesis of libraries focused on selective inhibitors of protein phosphatases (PPases). We considered that core structures having structural and electronic features similar to those of PPase substrates, phosphate esters, would be a reasonable choice. Therefore, we extracted core structures from natural products already identified as PPase inhibitors. Since many PPases share similar active-site structures, such phosphate-mimicking core structures should interact with many enzymes in the same family, and therefore the choice of diversity structures is pivotal both to increase the binding affinity and to achieve specificity for individual enzymes. Here we present case studies of application of focused libraries to obtain PPase inhibitors, covering the overall process from selection of core structures to identification and evaluation of candidates in the focused libraries. To synthesize a library focused on protein serine-threonine phosphatases (PPs), we chose norcantharidin as a core structure, because norcantharidin dicarboxylate shows a broad inhibition profile toward several PPs. From the resulting focused library, we identified a highly selective PP2B inhibitor, NCA-01. On the other hand, to find inhibitors of dual-specificity protein phosphatases (DSPs), we chose 3-acyltetronic acid extracted from natural product RK-682 as a core structure, because its structure resembles the transition state in the dephosphorylation reaction of DSPs. However, a highly selective inhibitor was not found in the resulting focused library. Furthermore, an inherent drawback of compounds having the highly acidic 3-acyltetronic acid as a core structure is very weak potency in cellulo, probably due to poor cell membrane

  4. Population structure and genetic diversity in a rice core collection (Oryza sativa L. investigated with SSR markers.

    Directory of Open Access Journals (Sweden)

    Peng Zhang

    Full Text Available The assessment of genetic diversity and population structure of a core collection would benefit to make use of these germplasm as well as applying them in association mapping. The objective of this study were to (1 examine the population structure of a rice core collection; (2 investigate the genetic diversity within and among subgroups of the rice core collection; (3 identify the extent of linkage disequilibrium (LD of the rice core collection. A rice core collection consisting of 150 varieties which was established from 2260 varieties of Ting's collection of rice germplasm were genotyped with 274 SSR markers and used in this study. Two distinct subgroups (i.e. SG 1 and SG 2 were detected within the entire population by different statistical methods, which is in accordance with the differentiation of indica and japonica rice. MCLUST analysis might be an alternative method to STRUCTURE for population structure analysis. A percentage of 26% of the total markers could detect the population structure as the whole SSR marker set did with similar precision. Gene diversity and MRD between the two subspecies varied considerably across the genome, which might be used to identify candidate genes for the traits under domestication and artificial selection of indica and japonica rice. The percentage of SSR loci pairs in significant (P<0.05 LD is 46.8% in the entire population and the ratio of linked to unlinked loci pairs in LD is 1.06. Across the entire population as well as the subgroups and sub-subgroups, LD decays with genetic distance, indicating that linkage is one main cause of LD. The results of this study would provide valuable information for association mapping using the rice core collection in future.

  5. Population structure and genetic diversity in a rice core collection (Oryza sativa L.) investigated with SSR markers.

    Science.gov (United States)

    Zhang, Peng; Li, Jinquan; Li, Xiaoling; Liu, Xiangdong; Zhao, Xingjuan; Lu, Yonggen

    2011-01-01

    The assessment of genetic diversity and population structure of a core collection would benefit to make use of these germplasm as well as applying them in association mapping. The objective of this study were to (1) examine the population structure of a rice core collection; (2) investigate the genetic diversity within and among subgroups of the rice core collection; (3) identify the extent of linkage disequilibrium (LD) of the rice core collection. A rice core collection consisting of 150 varieties which was established from 2260 varieties of Ting's collection of rice germplasm were genotyped with 274 SSR markers and used in this study. Two distinct subgroups (i.e. SG 1 and SG 2) were detected within the entire population by different statistical methods, which is in accordance with the differentiation of indica and japonica rice. MCLUST analysis might be an alternative method to STRUCTURE for population structure analysis. A percentage of 26% of the total markers could detect the population structure as the whole SSR marker set did with similar precision. Gene diversity and MRD between the two subspecies varied considerably across the genome, which might be used to identify candidate genes for the traits under domestication and artificial selection of indica and japonica rice. The percentage of SSR loci pairs in significant (P<0.05) LD is 46.8% in the entire population and the ratio of linked to unlinked loci pairs in LD is 1.06. Across the entire population as well as the subgroups and sub-subgroups, LD decays with genetic distance, indicating that linkage is one main cause of LD. The results of this study would provide valuable information for association mapping using the rice core collection in future.

  6. Core-Shell-Structured Copolyaniline-Coated Polymeric Nanoparticle Suspension and Its Viscoelastic Response under Various Electric Fields

    Directory of Open Access Journals (Sweden)

    Il-Jae Moon

    2015-08-01

    Full Text Available Semi-conducting poly(n-methylaniline (PNMA-coated poly(methyl methacrylate (PMMA composite nanoparticles were synthesized using cross-linked and grafted PMMA particles as a core, and then, the PNMA shell was coated via chemical oxidative polymerization on the surface of modified PMMA nanoparticles. Their electroresponsive electrorheological characteristics when dispersed in silicone were confirmed under applied electric fields using a rotational rheometer, focusing on their viscoelastic response. Using a frequency sweep test, the frequency dependence of both the storage and loss moduli was confirmed to increase upon increasing the electric field, with a stable plateau regime over the entire angular frequency range.

  7. Structural Rearrangement upon Fragmentation of the Stability Core of the ALS-Linked Protein TDP-43.

    Science.gov (United States)

    Morgan, Brittany R; Zitzewitz, Jill A; Massi, Francesca

    2017-08-08

    Amyotrophic lateral sclerosis (ALS) is the most common adult degenerative motor neuron disease. Experimental evidence indicates a direct role of transactive-response DNA-binding protein 43 (TDP-43) in the pathology of ALS and other neurodegenerative diseases. TDP-43 has been identified as a major component of cytoplasmic inclusions in patients with sporadic ALS; however, the molecular basis of the disease mechanism is not yet fully understood. Fragmentation within the second RNA recognition motif (RRM2) of TDP-43 has been observed in patient tissues and may play a role in the formation of aggregates in disease. To determine the structural and dynamical changes resulting from the truncation that could lead to aggregation and toxicity, we performed molecular dynamics simulations of the full-length RRM2 domain (the stability core of TDP-43) and of a truncated variant (where residues 189-207 are deleted to mimic a site of cleavage within RRM2 found in ALS patients). Our simulations show heterogeneous structural reorganization and decreased stability of the truncated RRM2 domain compared to the full-length domain, consistent with previous experimental results. The decreased stability and structural reorganization in the truncated RRM2 result in a higher probability of protein-protein interactions through altered electrostatic surface charges and increased accessibility of hydrophobic residues (including the nuclear export sequence), providing a rationale for the increased cytoplasmic aggregation of RRM2 fragments seen in sporadic ALS patients. Copyright © 2017 Biophysical Society. Published by Elsevier Inc. All rights reserved.

  8. Bacterioplankton communities of Crater Lake, OR: Dynamic changes with euphotic zone food web structure and stable deep water populations

    Science.gov (United States)

    Urbach, E.; Vergin, K.L.; Larson, G.L.; Giovannoni, S.J.

    2007-01-01

    The distribution of bacterial and archaeal species in Crater Lake plankton varies dramatically over depth and with time, as assessed by hybridization of group-specific oligonucleotides to RNA extracted from lakewater. Nonmetric, multidimensional scaling (MDS) analysis of relative bacterial phylotype densities revealed complex relationships among assemblages sampled from depth profiles in July, August and September of 1997 through 1999. CL500-11 green nonsulfur bacteria (Phylum Chloroflexi) and marine Group I crenarchaeota are consistently dominant groups in the oxygenated deep waters at 300 and 500 m. Other phylotypes found in the deep waters are similar to surface and mid-depth populations and vary with time. Euphotic zone assemblages are dominated either by ??-proteobacteria or CL120-10 verrucomicrobia, and ACK4 actinomycetes. MDS analyses of euphotic zone populations in relation to environmental variables and phytoplankton and zooplankton population structures reveal apparent links between Daphnia pulicaria zooplankton population densities and microbial community structure. These patterns may reflect food web interactions that link kokanee salmon population densities to community structure of the bacterioplankton, via fish predation on Daphnia with cascading consequences to Daphnia bacterivory and predation on bacterivorous protists. These results demonstrate a stable bottom-water microbial community. They also extend previous observations of food web-driven changes in euphotic zone bacterioplankton community structure to an oligotrophic setting. ?? 2007 Springer Science+Business Media B.V.

  9. ROLE OF NEUTRALS IN CORE FUELING AND PEDESTAL STRUCTURE IN H-MODE DIII-D DISCHARGES

    International Nuclear Information System (INIS)

    WOLF, NS; PETRIE, TW; PORTER, GD; ROGNLIEN, TD; GROEBNER, RJ; MAKOWSKI, MA

    2002-01-01

    OAK A271 ROLE OF NEUTRALS IN CORE FUELING AND PEDESTAL STRUCTURE IN H-MODE DIII-D DISCHARGES. The 2-D fluid code UEDGE was used to analyze DIII-D experiments to determine the role of neutrals in core fueling, core impurities, and also the H-mode pedestal structure. The authors compared the effects of divertor closure on the fueling rate and impurity density of high-triangularity, H-mode plasmas. UEDGE simulations indicate that the decrease in both deuterium core fueling (∼ 15%-20%) and core carbon density (∼ 15%-30%) with the closed divertor compared to the open divertor configuration is due to greater divertor screening of neutrals. They also compared UEDGE results with a simple analytic model of the H-mode pedestal structure. The model predicts both the width and gradient of the transport barrier in n e as a function of the pedestal density. The more sophisticated UEDGE simulations of H-mode discharges corroborate the simple analytic model, which is consistent with the hypothesis that fueling processes play a role in H-mode transport barrier formation

  10. Coaxial Electrospinning and Characterization of Core-Shell Structured Cellulose Nanocrystal Reinforced PMMA/PAN Composite Fibers

    Science.gov (United States)

    Li, Chao; Li, Qingde; Ni, Xiaohui; Liu, Guoxiang; Cheng, Wanli; Han, Guangping

    2017-01-01

    A modified coaxial electrospinning process was used to prepare composite nanofibrous mats from a poly(methyl methacrylate) (PMMA) solution with the addition of different cellulose nanocrystals (CNCs) as the sheath fluid and polyacrylonitrile (PAN) solution as the core fluid. This study investigated the conductivity of the as-spun solutions that increased significantly with increasing CNCs addition, which favors forming uniform fibers. This study discussed the effect of different CNCs addition on the morphology, thermal behavior, and the multilevel structure of the coaxial electrospun PMMA + CNCs/PAN composite nanofibers. A morphology analysis of the nanofibrous mats clearly demonstrated that the CNCs facilitated the production of the composite nanofibers with a core-shell structure. The diameter of the composite nanofibers decreased and the uniformity increased with increasing CNCs concentrations in the shell fluid. The composite nanofibrous mats had the maximum thermal decomposition temperature that was substantially higher than electrospun pure PMMA, PAN, as well as the core-shell PMMA/PAN nanocomposite. The BET (Brunauer, Emmett and Teller) formula results showed that the specific surface area of the CNCs reinforced core-shell composite significantly increased with increasing CNCs content. The specific surface area of the composite with 20% CNCs loading rose to 9.62 m2/g from 3.76 m2/g for the control. A dense porous structure was formed on the surface of the electrospun core-shell fibers. PMID:28772933

  11. Coaxial Electrospinning and Characterization of Core-Shell Structured Cellulose Nanocrystal Reinforced PMMA/PAN Composite Fibers.

    Science.gov (United States)

    Li, Chao; Li, Qingde; Ni, Xiaohui; Liu, Guoxiang; Cheng, Wanli; Han, Guangping

    2017-05-24

    A modified coaxial electrospinning process was used to prepare composite nanofibrous mats from a poly(methyl methacrylate) (PMMA) solution with the addition of different cellulose nanocrystals (CNCs) as the sheath fluid and polyacrylonitrile (PAN) solution as the core fluid. This study investigated the conductivity of the as-spun solutions that increased significantly with increasing CNCs addition, which favors forming uniform fibers. This study discussed the effect of different CNCs addition on the morphology, thermal behavior, and the multilevel structure of the coaxial electrospun PMMA + CNCs/PAN composite nanofibers. A morphology analysis of the nanofibrous mats clearly demonstrated that the CNCs facilitated the production of the composite nanofibers with a core-shell structure. The diameter of the composite nanofibers decreased and the uniformity increased with increasing CNCs concentrations in the shell fluid. The composite nanofibrous mats had the maximum thermal decomposition temperature that was substantially higher than electrospun pure PMMA, PAN, as well as the core-shell PMMA/PAN nanocomposite. The BET (Brunauer, Emmett and Teller) formula results showed that the specific surface area of the CNCs reinforced core-shell composite significantly increased with increasing CNCs content. The specific surface area of the composite with 20% CNCs loading rose to 9.62 m²/g from 3.76 m²/g for the control. A dense porous structure was formed on the surface of the electrospun core-shell fibers.

  12. Pyridine and phosphonate containing ligands for stable lanthanide complexation. An experimental and theoretical study to assess the solution structure.

    Science.gov (United States)

    Mato-Iglesias, Marta; Balogh, Edina; Platas-Iglesias, Carlos; Tóth, Eva; de Blas, Andrés; Rodríguez Blas, Teresa

    2006-12-07

    We report an experimental and theoretical study of the stability and solution structure of lanthanide complexes with two novel ligands containing pyridine units and phosphonate pendant arms on either ethane-1,2-diamine (L2) or cyclohexane-1,2-diamine (L3) backbones. Potentiometric studies have been carried out to determine the protonation constants of the ligands and the stability constants of the complexes with Gd(III) and the endogenous metal ions Zn(II) and Cu(II). While the stability constant of the GdL2 complex is too high to be determined by direct pH-potentiometric titrations, the cyclohexyl derivative GdL3 has a lower and assessable stability (log K(GdL3)=17.62). Due to the presence of the phosphonate groups, various protonated species can be detected up to pH approximately 8 for both ligands and all metal ions studied. The molecular clusters [Ln(L)(H2O)](3-).19H2O (Ln=La, Nd, Ho or Lu; L=L2 or L3) were characterized by theoretical calculations at the HF level. Our calculations provide two minimum energy geometries where the ligand adopts different conformations: twist-wrap (tw), in which the ligand wraps around the metal ion by twisting the pyridyl units relative to each other, and twist-fold (tf), where the slight twisting of the pyridyl units is accompanied by an overall folding of the two pyridine units towards one of the phosphonate groups. The relative free energies of the tw and tf conformations of [Ln(L)(H2O)]3- (L=L2, L3) complexes calculated in aqueous solution (C-PCM) by using the B3LYP model indicate that the tw form is the most stable one along the whole lanthanide series for the complexes of L3, while for those of L2 only the Gd(III) complex is more stable in the tf conformation by ca. 0.5 kcal mol-1. 1H NMR studies of the Eu(III) complex of L3 show the initial formation of the tf complex in aqueous solution, which slowly converts to the thermodynamically stable tw form. The structures calculated for the Nd(III) complexes are in reasonably

  13. Immobilization of cholesterol oxidase on magnetic fluorescent core-shell-structured nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Huang, Jun, E-mail: hjun@whut.edu.cn; Liu, Huichao; Zhang, Peipei; Zhang, Pengfei; Li, Mengshi; Ding, Liyun

    2015-12-01

    The magnetic fluorescent core-shell structured nanoparticles, Fe{sub 3}O{sub 4}@SiO{sub 2}(F)@meso–SiO{sub 2} nanoparticles, were prepared. Cholesterol oxidase (COD) was immobilized on their surface to form Fe{sub 3}O{sub 4}@SiO{sub 2}(F)@meso–SiO{sub 2}@COD nanoparticles. Optimal immobilization was achieved with 2.5% (v/v) APTES, 2.0% (v/v) GA, 10 mg COD (in 15 mg carrier) and solution pH of 7.0. Fe{sub 3}O{sub 4}@SiO{sub 2}(F)@meso–SiO{sub 2}@COD nanoparticles showed maximal catalytic activity at pH 7.0 and 50 °C. The thermal, storage and operational stabilities of COD were improved greatly after its immobilization. After the incubation at 50 °C for 5 h, the nanoparticles and free COD retained 80% and 46% of its initial activity, respectively. After kept at 4 °C for 30 days, the nanoparticles and free COD maintained 86% and 65% of initial activity, respectively. The nanoparticles retained 71% of its initial activity after 7 consecutive operations. Since Fe{sub 3}O{sub 4}@SiO{sub 2}(F)@meso–SiO{sub 2}@COD nanoparticles contained tris(2,2-bipyridyl)dichloro-ruthenium(II) hexahydrate (Ru(bpy){sub 3}Cl{sub 2}) and were optical sensitive to oxygen in solution, it might be used as the sensing material and has the application potential in multi parameter fiber optic biosensor based on enzyme catalysis and oxygen consumption. - Highlights: • COD was immobilized on magnetic fluorescent core-shell structured nanoparticles. • The nanoparticles were optical sensitive to oxygen in water solution. • The nanoparticles have remarkable improved stability compared with free COD. • The nanoparticles can probably be used in multi parameter fiber optic Biosensor.

  14. Formation of ZnO-Cd(OH){sub 2} core-shell nanoparticles by sol-gel method: An approach to modify surface chemistry for stable and enhanced green emission

    Energy Technology Data Exchange (ETDEWEB)

    Mishra, Rupali, E-mail: rupalimishra@rediffmail.co [Department of Physics, University of Allahabad, Allahabad-211002 (India); Nanophosphor Application Centre, University of Allahabad, Allahabad-211002 (India); Yadav, Raghvendra S.; Pandey, Avinash C. [Department of Physics, University of Allahabad, Allahabad-211002 (India); Nanophosphor Application Centre, University of Allahabad, Allahabad-211002 (India); Sanjay, Sharda. S. [Department of Chemistry, Ewing Christian College, Allahabad (India); Dar, Chitra [Department of Physics, University of Allahabad, Allahabad-211002 (India)

    2010-03-15

    We report the formation of highly stable and luminescent ZnO-Cd(OH){sub 2} core-shell nanoparticles by simple introduction of cadmium salt in the initial precursor solution, used to synthesize ZnO nanoparticles by sol-gel route. The cadmium to zinc salt concentration ratio has been also varied to control the growth of ZnO nanoparticles at the smaller particle size. Formation of ZnO-Cd(OH){sub 2} core-shell nanostructure has been confirmed by X-ray diffraction (XRD), energy dispersive analysis of X-rays (EDAX) and X-ray photoelectron spectroscopy (XPS). UV-vis absorption spectroscopy exhibits blue-shift in absorption edge on increasing cadmium concentrations. The photoluminescence emission spectra showed the remarkably stable and enhanced visible (green) emission from suspended ZnO-Cd(OH){sub 2} nanoparticles in comparison to bare ZnO nanoparticles. It is postulated that Cd(OH){sub 2} layer at the surface of ZnO nanoparticles prevents the agglomeration of nanoparticles and efficiently assists the trapping of hole at the surface site, a first step necessary for visible emission. The Fourier transform infrared spectroscopy (FTIR) also supports our assumption about surface chemistry.

  15. Global population structure of the stable fly (Stomoxys calcitrans) inferred by mitochondrial and nuclear sequence data.

    Science.gov (United States)

    Dsouli-Aymes, N; Michaux, J; De Stordeur, E; Couloux, A; Veuille, M; Duvallet, G

    2011-03-01

    Stomoxys calcitrans (Diptera: Muscidae: Stomoxyini), a synanthropic fly with a worldwide distribution, is recognized to have an important medical and veterinary impact. We conducted a phylogeographic analysis based on several populations from five major zoogeographic regions of the world in order to analyse population genetic structure of S. calcitrans and to trace its global dispersion. Results from mitochondrial (COI, Cyt-b and ND1-16S) and nuclear (ITS2) DNA show a substantial differentiation of Oriental populations (first lineage) from the Afrotropical, Palearctic, Nearctic, Neotropical and Oceanian populations (second lineage). The divergence time analyses suggest the separation between the two lineages approximately in mid-Pleistocene. Oriental populations are isolated and would not have participated in the colonization of other regions, unlike the Afrotropical one which seems to be the source of S. calcitrans dispersion towards other regions. Demographic analyses indicate that Oriental, Afrotropical and Palearctic regions have undergone a population expansion during late Pleistocene-early Holocene. The expansion time of this cosmopolitan species could have been influenced by continental human expansions and by animal domestication. Copyright © 2010 Elsevier B.V. All rights reserved.

  16. Peculiarities of the fundamental mode structure in stable-resonator lasers upon spatially inhomogeneous amplification

    International Nuclear Information System (INIS)

    Gorbunkov, Mikhail V; Kostryukov, P V; Telegin, L S; Tunkin, V G; Yakovlev, D V

    2007-01-01

    The structure of the fundamental mode of a laser is calculated by the iteration Fox-Li method in the case of inhomogeneous unsaturated amplification produced by axially symmetric longitudinal pumping. The calculation is performed for different parameters g 1 and g 2 of the resonator within the entire stability region. It is shown that in the case of inhomogeneous amplification, the fundamental mode considerably deviates from the Gaussian mode of an empty resonator only in the so-called critical configurations of the resonator, when the quantity [arccos(g 1 g 2 ) 1/2 ]/π is zero or takes a number of values expressed by irreducible fractions m/n. For the Fresnel number N F = 9, configurations with m/n = 1/2, 2/5, 3/8, 1/3, 3/10, 1/4, 1/5, 1/6, 1/8, and 1/10 are pronounced. As N F increases, the number of critical configurations increases. The expansion in a system of Laguerre-Gaussian beams shows that the fundamental mode in critical configurations is formed by a set of beams with certain radial indices p phased in the active medium. (resonators. modes)

  17. The structure of mAG, a monomeric mutant of the green fluorescent protein Azami-Green, reveals the structural basis of its stable green emission

    International Nuclear Information System (INIS)

    Ebisawa, Tatsuki; Yamamura, Akihiro; Kameda, Yasuhiro; Hayakawa, Kou; Nagata, Koji; Tanokura, Masaru

    2010-01-01

    The crystal structure of a monomeric mutant of Azami-Green (mAG) from G. fascicularis was determined at 2.2 Å resolution. Monomeric Azami-Green (mAG) from the stony coral Galaxea fascicularis is the first known monomeric green-emitting fluorescent protein that is not a variant of Aequorea victoria green fluorescent protein (avGFP). These two green fluorescent proteins are only 27% identical in their amino-acid sequences. mAG is more similar in its amino-acid sequence to four fluorescent proteins: Dendra2 (a green-to-red irreversibly photoconverting fluorescent protein), Dronpa (a bright-and-dark reversibly photoswitchable fluorescent protein), KikG (a tetrameric green-emitting fluorescent protein) and Kaede (another green-to-red irreversibly photoconverting fluorescent protein). To reveal the structural basis of stable green emission by mAG, the 2.2 Å crystal structure of mAG has been determined and compared with the crystal structures of avGFP, Dronpa, Dendra2, Kaede and KikG. The structural comparison revealed that the chromophore formed by Gln62-Tyr63-Gly64 (QYG) and the fixing of the conformation of the imidazole ring of His193 by hydrogen bonds and van der Waals contacts involving His193, Arg66 and Thr69 are likely to be required for the stable green emission of mAG. The crystal structure of mAG will contribute to the design and development of new monomeric fluorescent proteins with faster maturation, brighter fluorescence, improved photostability, new colours and other preferable properties as alternatives to avGFP and its variants

  18. Synthesis, structure and topological analysis of glycine templated highly stable cadmium sulfate framework: A New Lewis Acid catalyst

    Science.gov (United States)

    Paul, Avijit Kumar

    2018-04-01

    One new open-framework two-dimensional layer, [Cd(NH3CH2COO)(SO4)], I, has been synthesized using amino acid as templating agent. Single crystal structural analysis shows that the compound crystallizes in monoclinic cell with non-centrosymmetric space group P21, a = 4.9513(1) Å, b = 7.9763(2) Å, c = 8.0967(2) Å, β = 105.917(1)° and V = 307.504(12) Å3. The compound has connectivity between the Cd-centers and the sulfate units forming a two-dimensional layer structure. Sulfate unit is coordinated to metal center with η3, μ4 mode possessing a coordination free oxygen atom. The zwitterionic form of glycine molecule is present in the structure bridging with two metal centers through μ2-mode by carboxylate oxygens. The topological analysis reveals that the two-dimensional network is formed with a novel 4- and 6-connected binodal net of (32,42,52)(34,44,54,63) topology. Although one end of the glycine molecule is free from coordination, the structure is highly stable up to 350 °C. Strong N-H⋯ O hydrogen bonding interactions play an important role in the stabilization and formation of three-dimensional supramolecular structure. The cyanosilylation of imines using the present compounds as heterogeneous catalyst indicates good catalytic behavior. The present study illustrates the usefulness of the amino acid for the structure building in less studied sulfate based framework materials as well as designing of new heterogeneous catalysts for the broad application. The compound has also been characterized through elemental analysis, PXRD, IR, SEM and TG-DT studies.

  19. The effect of temperature on generic stable periodic structures in the parameter space of dissipative relativistic standard map

    Science.gov (United States)

    Horstmann, Ana C. C.; Albuquerque, Holokx A.; Manchein, Cesar

    2017-05-01

    In this work, we have characterized changes in the dynamics of a two-dimensional relativistic standard map in the presence of dissipation and specially when it is submitted to thermal effects modeled by a Gaussian noise reservoir. By the addition of thermal noise in the dissipative relativistic standard map (DRSM) it is possible to suppress typical stable periodic structures (SPSs) embedded in the chaotic domains of parameter space for large enough temperature strengths. Smaller SPSs are first affected by thermal effects, starting from their borders, as a function of temperature. To estimate the necessary temperature strength capable to destroy those SPSs we use the largest Lyapunov exponent to obtain the critical temperature (TC) diagrams. For critical temperatures the chaotic behavior takes place with the suppression of periodic motion, although the temperature strengths considered in this work are not so large to convert the deterministic features of the underlying system into a stochastic ones.

  20. Stable isotopes indicate population structuring in the southwest Atlantic population of right whales (Eubalaena australis.

    Directory of Open Access Journals (Sweden)

    Morgana Vighi

    Full Text Available From the early 17th century to the 1970s southern right whales, Eubalaena australis, were subject to intense exploitation along the Atlantic coast of South America. Catches along this coast recorded by whalers originally formed a continuum from Brazil to Tierra del Fuego. Nevertheless, the recovery of the population has apparently occurred fragmentarily, and with two main areas of concentration, one off southern Brazil (Santa Catarina and another off central Argentina (Peninsula Valdés. This pattern suggests some level of heterogeneity amongst the population, which is apparently contradicted by records that traced individuals moving throughout the whole geographical extension covered by the species in the Southwest Atlantic. To test the hypothesis of the potential occurrence of discrete subpopulations exploiting specific habitats, we investigated N, C and O isotopic values in 125 bone samples obtained from whaling factories operating in the early 1970s in southern Brazil (n=72 and from contemporary and more recent strandings occurring in central Argentina (n=53. Results indicated significant differences between the two sampling areas, being δ13C and δ18O values significantly higher in samples from southern Brazil than in those from central Argentina. This variation was consistent with isotopic baselines from the two areas, indicating the occurrence of some level of structure in the Southwest Atlantic right whale population and equally that whales more likely feed in areas commonly thought to exclusively serve as nursing grounds. Results aim at reconsidering of the units currently used in the management of the southern right whale in the Southwest Atlantic Ocean. In the context of the current die-off affecting the species in Peninsula Valdés, these results also highlight the necessity to better understand movements of individuals and precisely identify their feeding areas.

  1. Stable isotopes indicate population structuring in the southwest Atlantic population of right whales (Eubalaena australis).

    Science.gov (United States)

    Vighi, Morgana; Borrell, Asunción; Crespo, Enrique A; Oliveira, Larissa R; Simões-Lopes, Paulo C; Flores, Paulo A C; García, Néstor A; Aguilar, Alex; Aguilar, Alejandro

    2014-01-01

    From the early 17th century to the 1970s southern right whales, Eubalaena australis, were subject to intense exploitation along the Atlantic coast of South America. Catches along this coast recorded by whalers originally formed a continuum from Brazil to Tierra del Fuego. Nevertheless, the recovery of the population has apparently occurred fragmentarily, and with two main areas of concentration, one off southern Brazil (Santa Catarina) and another off central Argentina (Peninsula Valdés). This pattern suggests some level of heterogeneity amongst the population, which is apparently contradicted by records that traced individuals moving throughout the whole geographical extension covered by the species in the Southwest Atlantic. To test the hypothesis of the potential occurrence of discrete subpopulations exploiting specific habitats, we investigated N, C and O isotopic values in 125 bone samples obtained from whaling factories operating in the early 1970s in southern Brazil (n=72) and from contemporary and more recent strandings occurring in central Argentina (n=53). Results indicated significant differences between the two sampling areas, being δ13C and δ18O values significantly higher in samples from southern Brazil than in those from central Argentina. This variation was consistent with isotopic baselines from the two areas, indicating the occurrence of some level of structure in the Southwest Atlantic right whale population and equally that whales more likely feed in areas commonly thought to exclusively serve as nursing grounds. Results aim at reconsidering of the units currently used in the management of the southern right whale in the Southwest Atlantic Ocean. In the context of the current die-off affecting the species in Peninsula Valdés, these results also highlight the necessity to better understand movements of individuals and precisely identify their feeding areas.

  2. Structural improvement of unliganded simian immunodeficiency virus gp120 core by normal-mode-based X-ray crystallographic refinement

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Xiaorui [Graduate Program of Structural and Computational Biology and Molecular Biophysics, Baylor College of Medicine, One Baylor Plaza, BCM-125, Houston, TX 77030 (United States); Lu, Mingyang [Verna and Marrs McLean Department of Biochemistry and Molecular Biology, Baylor College of Medicine, One Baylor Plaza, BCM-125, Houston, TX 77030 (United States); Poon, Billy K. [Department of Bioengineering, Rice University, Houston, TX 77005 (United States); Wang, Qinghua [Verna and Marrs McLean Department of Biochemistry and Molecular Biology, Baylor College of Medicine, One Baylor Plaza, BCM-125, Houston, TX 77030 (United States); Ma, Jianpeng, E-mail: jpma@bcm.tmc.edu [Graduate Program of Structural and Computational Biology and Molecular Biophysics, Baylor College of Medicine, One Baylor Plaza, BCM-125, Houston, TX 77030 (United States); Verna and Marrs McLean Department of Biochemistry and Molecular Biology, Baylor College of Medicine, One Baylor Plaza, BCM-125, Houston, TX 77030 (United States); Department of Bioengineering, Rice University, Houston, TX 77005 (United States)

    2009-04-01

    The structural model of the unliganded and fully glycosylated simian immunodeficiency virus gp120 core determined to 4.0 Å resolution was substantially improved using a recently developed normal-mode-based anisotropic B-factor refinement method. The envelope protein gp120/gp41 of simian and human immunodeficiency viruses plays a critical role in viral entry into host cells. However, the extraordinarily high structural flexibility and heavy glycosylation of the protein have presented enormous difficulties in the pursuit of high-resolution structural investigation of some of its conformational states. An unliganded and fully glycosylated gp120 core structure was recently determined to 4.0 Å resolution. The rather low data-to-parameter ratio limited refinement efforts in the original structure determination. In this work, refinement of this gp120 core structure was carried out using a normal-mode-based refinement method that has been shown in previous studies to be effective in improving models of a supramolecular complex at 3.42 Å resolution and of a membrane protein at 3.2 Å resolution. By using only the first four nonzero lowest-frequency normal modes to construct the anisotropic thermal parameters, combined with manual adjustments and standard positional refinement using REFMAC5, the structural model of the gp120 core was significantly improved in many aspects, including substantial decreases in R factors, better fitting of several flexible regions in electron-density maps, the addition of five new sugar rings at four glycan chains and an excellent correlation of the B-factor distribution with known structural flexibility. These results further underscore the effectiveness of this normal-mode-based method in improving models of protein and nonprotein components in low-resolution X-ray structures.

  3. "Hot cores" in proteins: Comparative analysis of the apolar contact area in structures from hyper/thermophilic and mesophilic organisms

    Directory of Open Access Journals (Sweden)

    Bossa Francesco

    2008-02-01

    Full Text Available Abstract Background A wide variety of stabilizing factors have been invoked so far to elucidate the structural basis of protein thermostability. These include, amongst the others, a higher number of ion-pairs interactions and hydrogen bonds, together with a better packing of hydrophobic residues. It has been frequently observed that packing of hydrophobic side chains is improved in hyperthermophilic proteins, when compared to their mesophilic counterparts. In this work, protein crystal structures from hyper/thermophilic organisms and their mesophilic homologs have been compared, in order to quantify the difference of apolar contact area and to assess the role played by the hydrophobic contacts in the stabilization of the protein core, at high temperatures. Results The construction of two datasets was carried out so as to satisfy several restrictive criteria, such as minimum redundancy, resolution and R-value thresholds and lack of any structural defect in the collected structures. This approach allowed to quantify with relatively high precision the apolar contact area between interacting residues, reducing the uncertainty due to the position of atoms in the crystal structures, the redundancy of data and the size of the dataset. To identify the common core regions of these proteins, the study was focused on segments that conserve a similar main chain conformation in the structures analyzed, excluding the intervening regions whose structure differs markedly. The results indicated that hyperthermophilic proteins underwent a significant increase of the hydrophobic contact area contributed by those residues composing the alpha-helices of the structurally conserved regions. Conclusion This study indicates the decreased flexibility of alpha-helices in proteins core as a major factor contributing to the enhanced termostability of a number of hyperthermophilic proteins. This effect, in turn, may be due to an increased number of buried methyl groups in

  4. Structural improvement of unliganded simian immunodeficiency virus gp120 core by normal-mode-based X-ray crystallographic refinement

    International Nuclear Information System (INIS)

    Chen, Xiaorui; Lu, Mingyang; Poon, Billy K.; Wang, Qinghua; Ma, Jianpeng

    2009-01-01

    The structural model of the unliganded and fully glycosylated simian immunodeficiency virus gp120 core determined to 4.0 Å resolution was substantially improved using a recently developed normal-mode-based anisotropic B-factor refinement method. The envelope protein gp120/gp41 of simian and human immunodeficiency viruses plays a critical role in viral entry into host cells. However, the extraordinarily high structural flexibility and heavy glycosylation of the protein have presented enormous difficulties in the pursuit of high-resolution structural investigation of some of its conformational states. An unliganded and fully glycosylated gp120 core structure was recently determined to 4.0 Å resolution. The rather low data-to-parameter ratio limited refinement efforts in the original structure determination. In this work, refinement of this gp120 core structure was carried out using a normal-mode-based refinement method that has been shown in previous studies to be effective in improving models of a supramolecular complex at 3.42 Å resolution and of a membrane protein at 3.2 Å resolution. By using only the first four nonzero lowest-frequency normal modes to construct the anisotropic thermal parameters, combined with manual adjustments and standard positional refinement using REFMAC5, the structural model of the gp120 core was significantly improved in many aspects, including substantial decreases in R factors, better fitting of several flexible regions in electron-density maps, the addition of five new sugar rings at four glycan chains and an excellent correlation of the B-factor distribution with known structural flexibility. These results further underscore the effectiveness of this normal-mode-based method in improving models of protein and nonprotein components in low-resolution X-ray structures

  5. The core structure of a Frank dislocation in Ni3(Al,Nb)

    International Nuclear Information System (INIS)

    Bonnet, R.; Loubradou, M.; Derder, C.; Catana, A.

    1991-01-01

    This paper reports on the core structures of dislocations in L1 2 crystals, in view of understanding the anomalous yield behavior of strength with increasing temperature. Theoretical approaches have been proposed for explaining the dissociations of these dislocations, and experimental evidences have been reported for such dissociations using either the weak beam technique or more recently the HRTEM (High Resolution Transmission Electron Microscopy) technique. Recent HRTEM results show that for Ni 3 A1 the partial dislocations 1/2 left-angle 110 right-angle which limit an APB (Antiphase Boundary) lying on (001) are only split over 0.1 - 0.3 nm along (111) planes, producing very high energy CSF's (Complex Stacking Faults) which limit an SISF (superlattice Intrinsic Stacking Fault) extended on a (111) plane. Concerning the 1/2 left-angle 111 right-angle Frank dislocation, which limits an SESF (Superlattice Extrinsic Stacking Fault), there are no reported results yet. Let us note, however, that for aluminum HRTEM images of Frank dislocation loops have been studied. This lack of information in the L1 2 crystals motivated the present HRTEM study

  6. Reinforcement of Natural Rubber with Core-Shell Structure Silica-Poly(Methyl Methacrylate Nanoparticles

    Directory of Open Access Journals (Sweden)

    Qinghuang Wang

    2012-01-01

    Full Text Available A highly performing natural rubber/silica (NR/SiO2 nanocomposite with a SiO2 loading of 2 wt% was prepared by combining similar dissolve mutually theory with latex compounding techniques. Before polymerization, double bonds were introduced onto the surface of the SiO2 particles with the silane-coupling agent. The core-shell structure silica-poly(methyl methacrylate, SiO2-PMMA, nanoparticles were formed by grafting polymerization of MMA on the surface of the modified SiO2 particles via in situ emulsion, and then NR/SiO2 nanocomposite was prepared by blending SiO2-PMMA and PMMA-modified NR (NR-PMMA. The Fourier transform infrared spectroscopy results show that PMMA has been successfully introduced onto the surface of SiO2, which can be well dispersed in NR matrix and present good interfacial adhesion with NR phase. Compared with those of pure NR, the thermal resistance and tensile properties of NR/SiO2 nanocomposite are significantly improved.

  7. Hydrogen peroxide sensing using ultrathin platinum-coated gold nanoparticles with core@shell structure.

    Science.gov (United States)

    Li, Yongxin; Lu, Qiufang; Wu, Shengnan; Wang, Lun; Shi, Xianming

    2013-03-15

    Ultrathin platinum-coated gold (Pt@Au) nanoparticles with core@shell structure have been developed by under-potential deposition (UPD) redox replacement technique. A single UPD Cu replacement with Pt(2+) produced a uniform Pt monolayer on the surface of gold nanoparticles, which are immobilized on glassy carbon electrode (GCE) surface based on electrostatic interaction. The ultrathin Pt@Au nanoparticles were confirmed by cyclic voltammetry and X-ray photoelectron spectroscopy (XPS). Voltammetry and amperometric methodologies were used to evaluate the electrocatalytic activity of the Pt@Au nanoparticles modified electrode towards the reduction of hydrogen peroxide under the physiological condition. The present results show that ultrathin Pt coating greatly enhances the electrocatalytic activity towards the reduction of hydrogen peroxide, which can be utilized to fabricate the hydrogen peroxide sensor. Chronoamperometric experiments showed that at an applied potential of 0.08 V (vs. Ag/AgCl), the current reduction of hydrogen peroxide was linear to its concentration in the range of 1-450 μΜ, and the detection limit was found to be 0.18 μM (signal-to-noise ratio, S/N=3). Copyright © 2012 Elsevier B.V. All rights reserved.

  8. Comparison of prestellar core elongations and large-scale molecular cloud structures in the Lupus I region

    Energy Technology Data Exchange (ETDEWEB)

    Poidevin, Frédérick [UCL, KLB, Department of Physics and Astronomy, Gower Place, London WC1E 6BT (United Kingdom); Ade, Peter A. R.; Hargrave, Peter C.; Nutter, David [School of Physics and Astronomy, Cardiff University, Queens Buildings, The Parade, Cardiff CF24 3AA (United Kingdom); Angile, Francesco E.; Devlin, Mark J.; Klein, Jeffrey [Department of Physics and Astronomy, University of Pennsylvania, 209 South 33rd Street, Philadelphia, PA 19104 (United States); Benton, Steven J.; Netterfield, Calvin B. [Department of Physics, University of Toronto, 60 St. George Street, Toronto, ON M5S 1A7 (Canada); Chapin, Edward L. [XMM SOC, ESAC, Apartado 78, E-28691 Villanueva de la Canãda, Madrid (Spain); Fissel, Laura M.; Gandilo, Natalie N. [Department of Astronomy and Astrophysics, University of Toronto, 50 St. George Street, Toronto, ON M5S 3H4 (Canada); Fukui, Yasuo [Department of Physics, Nagoya University, Chikusa-ku, Nagoya, Aichi 464-8601 (Japan); Gundersen, Joshua O. [Department of Physics, University of Miami, 1320 Campo Sano Drive, Coral Gables, FL 33146 (United States); Korotkov, Andrei L. [Department of Physics, Brown University, 182 Hope Street, Providence, RI 02912 (United States); Matthews, Tristan G.; Novak, Giles [Department of Physics and Astronomy, Northwestern University, 2145 Sheridan Road, Evanston, IL 60208 (United States); Moncelsi, Lorenzo; Mroczkowski, Tony K. [California Institute of Technology, 1200 East California Boulevard, Pasadena, CA 91125 (United States); Olmi, Luca, E-mail: fpoidevin@iac.es [Physics Department, University of Puerto Rico, Rio Piedras Campus, Box 23343, UPR station, San Juan, PR 00931 (United States); and others

    2014-08-10

    Turbulence and magnetic fields are expected to be important for regulating molecular cloud formation and evolution. However, their effects on sub-parsec to 100 parsec scales, leading to the formation of starless cores, are not well understood. We investigate the prestellar core structure morphologies obtained from analysis of the Herschel-SPIRE 350 μm maps of the Lupus I cloud. This distribution is first compared on a statistical basis to the large-scale shape of the main filament. We find the distribution of the elongation position angle of the cores to be consistent with a random distribution, which means no specific orientation of the morphology of the cores is observed with respect to the mean orientation of the large-scale filament in Lupus I, nor relative to a large-scale bent filament model. This distribution is also compared to the mean orientation of the large-scale magnetic fields probed at 350 μm with the Balloon-borne Large Aperture Telescope for Polarimetry during its 2010 campaign. Here again we do not find any correlation between the core morphology distribution and the average orientation of the magnetic fields on parsec scales. Our main conclusion is that the local filament dynamics—including secondary filaments that often run orthogonally to the primary filament—and possibly small-scale variations in the local magnetic field direction, could be the dominant factors for explaining the final orientation of each core.

  9. Magnetic nanofibers with core (Fe3O4 nanoparticle suspension)/sheath (poly ethylene terephthalate) structure fabricated by coaxial electrospinning

    International Nuclear Information System (INIS)

    Sung, Yun Kyung; Ahn, Byung Wook; Kang, Tae Jin

    2012-01-01

    One-dimensional magnetic nanostructures have recently attracted much attention because of their intriguing properties that are not realized by their bulk or particle form. These nanostructures are potentially useful for the application to ultrahigh-density data storages, sensors and bulletproof vest. The magnetic particles in magnetic nanofibers of blend types cannot fully align along the external magnetic field because magnetic particles are arrested in solid polymer matrix. To improve the mobility of magnetic particles, we used magneto-rheological fluid (MRF), which has the good mobility and dispersibility. Superparamagnetic core/sheath composite nanofibers were obtained with MRF and poly (ethylene terephthalate) (PET) solution via a coaxial electrospinning technique. Coaxial electrospinning is suited for fabricating core/sheath nanofibers encapsulating MRF materials within a polymer sheath. The magnetic nanoparticles in MRF were dispersed within core part of the nanofibers. The core/sheath magnetic composite nanofibers exhibited superparamagnetic behavior at room temperature and the magnetic nanoparticles in MRF well responded to an applied magnetic field. Also, the mechanical properties of the nanofiber were improved in the magnetic field. This study aimed to fabricate core/sheath magnetic composite nanofibers using coaxial electrospinning and characterize the magnetic as well as mechanical properties of composite nanofibers. - Highlights: ► The composite nanofibers including the MRF and PET. ► The fabrication of core/sheath structured nanofibers using coaxial electrospinning. ► Superparamagnetic composite nanofibers.

  10. Nanospheres with a smectic hydrophobic core and an amorphous PEG hydrophilic shell: structural changes and implications for drug delivery

    Energy Technology Data Exchange (ETDEWEB)

    Murthy, N. Sanjeeva [New Jersey Center for Biomaterials; Rutgers; The State University of New Jersey; Piscataway; USA; Zhang, Zheng [New Jersey Center for Biomaterials; Rutgers; The State University of New Jersey; Piscataway; USA; Borsadia, Siddharth [New Jersey Center for Biomaterials; Rutgers; The State University of New Jersey; Piscataway; USA; Kohn, Joachim [New Jersey Center for Biomaterials; Rutgers; The State University of New Jersey; Piscataway; USA

    2018-01-01

    The structural changes in nanospheres with a crystalline core and an amorphous diffuse shell were investigated by small-angle neutron scattering (SANS), small-, medium-, and wide-angle X-ray scattering (SAXS, MAXS and WAXS), and differential scanning calorimetry (DSC).

  11. Ionic core–shell dendrimers with a polycationic core: structural aspects and host–guest binding properties

    NARCIS (Netherlands)

    van de Coevering, R.; Bruijnincx, P.C.A.; Lutz, M.; Spek, A.L.; van Koten, G.; Klein Gebbink, R.J.M.

    2007-01-01

    The structural aspects and host–guest binding properties of ionic core–shell dendrimers [1]Br8 and [2]Br4, which bear a polycationic core and a neutral shell of Fréchet-type poly(benzyl aryl ether) dendrons, have been investigated by means of dendritic wedges [3]Br2 and [4]Br, that resemble one of

  12. The key to the extraordinary thermal stability of P. furiosus holo-rubredoxin: iron binding-guided packing of a core aromatic cluster responsible for high kinetic stability of the native structure.

    Directory of Open Access Journals (Sweden)

    Satya Prakash

    Full Text Available Pyrococcus furiosus rubredoxin (PfRd, a small, monomeric, 53 residues-long, iron-containing, electron-transfer protein of known structure is sometimes referred to as being the most structurally-stable protein known to man. Here, using a combination of mutational and spectroscopic (CD, fluorescence, and NMR studies of differently made holo- and apo-forms of PfRd, we demonstrate that it is not the presence of iron, or even the folding of the PfRd chain into a compact well-folded structure that causes holo-PfRd to display its extraordinary thermal stability, but rather the correct iron binding-guided packing of certain residues (specifically, Trp3, Phe29, Trp36, and also Tyr10 within a tight aromatic cluster of six residues in PfRd's hydrophobic core. Binding of the iron atom appears to play a remarkable role in determining subtle details of residue packing, forcing the chain to form a hyper-thermally stable native structure which is kinetically stable enough to survive (subsequent removal of iron. On the other hand, failure to bind iron causes the same chain to adopt an equally well-folded native-like structure which, however, has a differently-packed aromatic cluster in its core, causing it to be only as stable as any other ordinary mesophile-derived rubredoxin. Our studies demonstrate, perhaps for the very first time ever that hyperthermal stability in proteins can owe to subtle differences in residue packing vis a vis mesostable proteins, without there being any underlying differences in either amino acid sequence, or bound ligand status.

  13. Pore - to - Core Modeling of Soil Organic Matter Decomposition in 3D Soil Structures

    Science.gov (United States)

    Falconer, R. E.; Battaia, G.; Baveye, P.; Otten, W.

    2013-12-01

    There is a growing body of literature supporting the need for microbial contributions to be considered explicitly in carbon-climate models. There is also overwhelming evidence that physical protection within aggregates can play a significant role in organic matter dynamics. Yet current models of soil organic matter dynamics divide soil organic matter into conceptual pools with distinct turnover times, assuming that a combination of biochemical and physical properties control decay without explicit description. Albeit robust in their application, such models are not capable to account for changes in soil structure or microbial populations, or accurately predict the effect of wetness or priming. A spatially explicit model is presented that accounts for microbial dynamics and physical processes, permitting consideration of the heterogeneity of the physical and chemical microenvironments at scales relevant for microbes. Exemplified for fungi, we investigate how micro-scale processes manifest at the core scale with particular emphasis on evolution of CO2 and biomass distribution. The microbial model is based upon previous (Falconer et al, 2012) and includes the following processes: uptake, translocation, recycling, enzyme production, growth, spread and respiration. The model is parameterised through a combination of literature data and parameter estimation (Cazelles et al., 2012).The Carbon model comprises two pools, particulate organic matter which through enzymatic activity is converted into dissolved organic matter. The microbial and carbon dynamics occur within a 3D soil structure obtained by X-ray CT. We show that CO2 is affected not only by the amount of Carbon in the soil but also by microbial dynamics, soil structure and the spatial distribution of OM. The same amount of OM can result in substantially different respiration rates, with surprisingly more CO2 with increased clustering of OM. We can explain this from the colony dynamics, production of enzymes and

  14. Crystal structure of Earth's inner core: A first-principles study

    Science.gov (United States)

    Moustafa, S. G.; Schultz, A. J.; Zurek, E.; Kofke, D. A.

    2017-12-01

    Since the detection of the Earth's solid inner core (IC) by Lehmann in 1936, its composition and crystal structure (which are essential to understand Earth's evolution) have been controversial. While seismological measurements (e.g. PREM) can give a robust estimation of the density, pressure, and elasticity of the IC, they cannot be directly used to determine its composition and/or crystal structure. Experimentally, reaching the extreme IC conditions ( 330 GPa and 6000 K) and getting reliable measurements is very challenging. First-principles calculations provide a viable alternative that can work as a powerful investigative tool. Although several attempts have been made to assess phase stability at IC conditions computationally, they often use a low level of theory for electronic structure (e.g., classical force-field), adopt approximate methods (e.g., quasiharmonic approximation, fixed hcp-c/a), or do not consider finite-size effects. The study of phase stability using accurate first-principles methods is hampered in part by the difficulty of computing the free energy (FE), the central thermodynamic quantity that determines stability, while including anharmonic and finite-size effects. Additional difficulty related to the IC in particular is introduced by the dynamical instability of one of the IC candidate structures (bcc) at low temperature. Recently [1-3], we introduced a novel method (denoted as "harmonically mapped averaging", or HMA) to efficiently measure anharmonic properties (e.g. FE, pressure, elastic modulus) by molecular simulation, yielding orders of magnitude CPU speedup compared to conventional methods. We have applied this method to the hcp candidate phase of iron at the IC conditions, obtaining first-principles anharmonic FE values with unprecedented accuracy and precision [4]. We have now completed and report HMA calculations to assess the phase stability of all IC candidate phases (fcc/hcp/bcc). This knowledge is the prerequisite for

  15. Method Of Bonding A Metal Connection To An Electrode Including A Core Having A Fiber Or Foam Type Structure For An Electrochemical Cell, An

    Science.gov (United States)

    Loustau, Marie-Therese; Verhoog, Roelof; Precigout, Claude

    1996-09-24

    A method of bonding a metal connection to an electrode including a core having a fiber or foam-type structure for an electrochemical cell, in which method at least one metal strip is pressed against one edge of the core and is welded thereto under compression, wherein, at least in line with the region in which said strip is welded to the core, which is referred to as the "main core", a retaining core of a type analogous to that of the main core is disposed prior to the welding.

  16. Functional and structural analysis of photosystem II core complexes from spinach with high oxygen evolution capacity

    NARCIS (Netherlands)

    Haag, Elisabeth; Irrgang, Klaus-D.; Boekema, Egbert J.; Renger, Gernot

    1990-01-01

    Oxygen-evolving photo system II core complexes were prepared from spinach by solubilizing photosystem II membrane fragments with dodecyl-β-D-maltoside. The core complexes consist of the intrinsic 47-kDa, 43-kDa, D1 and D2 polypeptides, the two subunits of cytochrome b559 and the extrinsic 33-kDa

  17. Core-shell structured titanium-nitrogen alloys with high strength, high thermal stability and good plasticity.

    Science.gov (United States)

    Zhang, Y S; Zhao, Y H; Zhang, W; Lu, J W; Hu, J J; Huo, W T; Zhang, P X

    2017-01-06

    Multifunctional materials with more than two good properties are widely required in modern industries. However, some properties are often trade-off with each other by single microstructural designation. For example, nanostructured materials have high strength, but low ductility and thermal stability. Here by means of spark plasma sintering (SPS) of nitrided Ti particles, we synthesized bulk core-shell structured Ti alloys with isolated soft coarse-grained Ti cores and hard Ti-N solid solution shells. The core-shell Ti alloys exhibit a high yield strength (~1.4 GPa) comparable to that of nanostructured states and high thermal stability (over 1100 °C, 0.71 of melting temperature), contributed by the hard Ti-N shells, as well as a good plasticity (fracture plasticity of 12%) due to the soft Ti cores. Our results demonstrate that this core-shell structure offers a design pathway towards an advanced material with enhancing strength-plasticity-thermal stability synergy.

  18. Thermal Stability of Platinum-Cobalt Bimetallic Nanoparticles: Chemically Disordered Alloys, Ordered Intermetallics, and Core-Shell Structures.

    Science.gov (United States)

    Huang, Rao; Shao, Gui-Fang; Zhang, Yang; Wen, Yu-Hua

    2017-04-12

    Pt-Co bimetallic nanoparticles are promising candidates for Pt-based nanocatalysts and magnetic-storage materials. By using molecular dynamics simulations, we here present a detailed examination on the thermal stabilities of Pt-Co bimetallic nanoparticles with three configurations including chemically disordered alloy, ordered intermetallics, and core-shell structures. It has been revealed that ordered intermetallic nanoparticles possess better structural and thermal stability than disordered alloyed ones for both Pt 3 Co and PtCo systems, and Pt 3 Co-Pt core-shell nanoparticles exhibit the highest melting points and the best thermal stability among Pt-Co bimetallic nanoparticles, although their meltings all initiate at the surface and evolve inward with increasing temperatures. In contrast, Co-Pt core-shell nanoparticles display the worst thermal stability compared with the aforementioned nanoparticles. Furthermore, their melting initiates in the core and extends outward surface, showing a typical two-stage melting mode. The solid-solid phase transition is discovered in Co core before its melting. This work demonstrates the importance of composition distribution to tuning the properties of binary nanoparticles.

  19. Enhancing oxidative stability in heated oils using core/shell structures of collagen and α-tocopherol complex.

    Science.gov (United States)

    Gim, Seo Yeong; Hong, Seungmi; Kim, Jisu; Kwon, YongJun; Kim, Mi-Ja; Kim, GeunHyung; Lee, JaeHwan

    2017-11-15

    In this study, collagen mesh structure was prepared by carrying α-tocopherol in the form of core/shell complex. Antioxidant properties of α-tocopherol loaded carriers were tested in moisture added bulk oils at 140°C. From one gram of collagen core/shell complex, 138mg α-tocopherol was released in medium chain triacylglycerol (MCT). α-Tocopherol was substantially protected against heat treatment when α-tocopherol was complexed in collagen core/shell. Oxidative stability in bulk oil was significantly enhanced by added collagen mesh structure or collagen core/shell complex with α-tocopherol compared to that in control bulk oils (pshell with α-tocopherol (p>0.05). Results of DPPH loss in methanol demonstrated that collagen core/shell with α-tocopherol had significantly (pshell complex is a promising way to enhance the stability of α-tocopherol and oxidative stability in oil-rich foods prepared at high temperature. Copyright © 2017 Elsevier Ltd. All rights reserved.

  20. Core – Shell structures in Sb – doped BaTiO3

    Directory of Open Access Journals (Sweden)

    Castro, M. S.

    2002-02-01

    Full Text Available In this work, fine – grained microstructures have been obtained after sintering BaTiO3 doped with an organic precursor of antimonium. In this compound, the development of a core – shell structure in the grains takes place influencing on the final grain size and electrical properties of the material. Samples were characterised by Scanning Electron Microscopy (SEM, X – ray diffraction (XRD analysis, and dielectric constant – temperature curves. Strong inhibition of the grain growth is observed in Sb-doped BaTiO3. Besides, dielectric constant vs temperature curves show the contribution of two regions, corresponding to the grain boundaries and the grain bulk. According to the observed properties, the contribution belonging to the shell region becomes more important as the dopant content and the sintering temperature rise.En el presente trabajo se han obtenido materiales de BaTiO3 dopados con antimonio a partir de un precursor orgánico que presentaron una microestructura homogénea y con tamaño de grano pequeño. En este compuesto se desarrolla una estructura de tipo “core-shell” en los granos que afecta tanto al tamaño de grano final como a las propiedades eléctricas del material. Las muestras fueron analizadas mediante Microscopía Electrónica de Barrido, difracción de rayos-X y la respuesta de la constante dieléctrica frente a la temperatura. Se observó una fuerte inhibición del crecimiento cristalino con la incorporación de antimonio. La respuesta de la constante dieléctrica frente a la temperatura presenta dos contribuciones, una asociada al borde de grano y otra al interior de grano. De acuerdo con las propiedades observadas, la contribución del borde de grano (región “shell” crece en importancia a medida que la concentración de dopante y la temperatura de sinterización aumentan.

  1. Reviving near infra-red emission of Ag2S nanoparticles using interfacial defects in the Ag2S@CdS core-shell structure.

    Science.gov (United States)

    Karimipour, M; Izadian, L; Molaei, M

    2018-02-01

    Ag 2 S@CdS core-shell particles were synthesized with different Cd source content as a measure of shell thickness using a pulsed microwave irradiation method. The particles were verified structurally using X-ray diffraction, energy dispersive X-ray analysis and transmission electron microscopy. Optical spectroscopy revealed that core-shells show an absorption peak at 750 nm and an emission peak located around 800 nm after 6 min of microwave irradiation. With continued microwave treatment, the NIR luminescence first vanished but it was revived after 12 min of irradiation, which was 100 nm red shifted. This new type of NIR emission in Ag 2 S with sizes greater than 5 nm is due to the proximity of a highly deficient CdS shell with strong red emission that was stable for more than 6 months in water. A mechanism has been suggested for this type of emission. Copyright © 2017 John Wiley & Sons, Ltd.

  2. Structural Flexibility of the Nucleosome Core Particle at Atomic Resolution studied by Molecular Dynamics Simulation.

    Energy Technology Data Exchange (ETDEWEB)

    Roccatano, Danilo; Barthel, Andre; Zacharias, Martin W.

    2007-01-24

    The research described in this product was performed in part in the Environmental Molecular Sciences Laboratory, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. Comparative explicit solvent molecular dynamics (MD) simulations have been performed on a complete nucleosome core particle with and without N-terminal histone tails for more than 20 ns. Main purpose of the simulations was to study the dynamics of mobile elements such as histone N-terminal tails and how packing and DNA-bending influences the fine structure and dynamics of DNA. Except for the tails, histone and DNA molecules stayed on average close to the crystallographic start structure supporting the quality of the current force field approach. Despite the packing strain, no increase of transitions to noncanonical nucleic acid backbone conformations compared to regular B-DNA was observed. The pattern of kinks and bends along the DNA remained close to the experiment overall. In addition to the local dynamics, the simulations allowed the analysis of the superhelical mobility indicating a limited relative mobility of DNA segments separated by one superhelical turn (mean relative displacement of approximately 60.2 nm, mainly along the superhelical axis). An even higher rigidity was found for relative motions (distance fluctuations) of segments separated by half a superhelical turn (approximately 60.1 nm). The N-terminal tails underwent dramatic conformational rearrangements on the nanosecond time scale toward partially and transiently wrapped states around the DNA. Many of the histone tail changes corresponded to coupled association and folding events from fully solvent-exposed states toward complexes with the major and minor grooves of DNA. The simulations indicate that the rapid conformational changes of the tails can modulate the DNA accessibility within a few nanoseconds

  3. Spatially-resolved study of the luminescence from ZnO/MgO core-shell nanocrystal structures

    International Nuclear Information System (INIS)

    Panin, Gennady; Baranov, Andrey; Kapitanova, Olesya; Kang, Taewon

    2012-01-01

    The luminescent properties of core-shell nanocrystal structures were investigated with high spatial resolution. The composites consisting of ZnO/MgO core/shell nanoheteroparticles showed an increase in the relative intensity of the green luminescence after annealing while a suppression of green luminescence from samples of ZnO tetrapods in a MgO nanoparticle matrix was observed. Combined spatially-resolved combined through-the-lens-detector (TLD) and cathodoluminescence (CL) measurements revealed that the depletion of electrons in the ZnO nanocrystals could lead to a suppression of the luminescence.

  4. Core/shell nano-structuring of metal oxide semiconductors and their photocatalytic studies

    Science.gov (United States)

    Balakumar, S.; Rakkesh, R. Ajay

    2013-02-01

    Core/Shell Nanostructures of Metal Oxide Semiconductors (MOS) have attracted much attention because of their most fascinating tunable applications. These core shell morphologies can be easily engineered to enhance the unique properties of the metal-oxide nanostructures, which make them suitable as photocatalyst due to their high catalytic activity, substantial stability, and brilliant perspective in applications. This paper provides an overview on our work on the synthesis of some interesting core/ shell nanostructures of MOS such as ZnO-TiO2, ZnO-MoO3, and V2O5-TiO2 using a low temperature wet chemical route and hydrothermal techniques and their photocatalytic properties from the aspects of different shell materials and shell thicknesses. The effect of process parameters such as pH, temperature, and ratio of core and shell materials, was systematically studied. Here the evidence for the core shell formation with different shell thicknesses came from the X-ray diffraction peak intensities. The shell thickness variation was also confirmed by Transmission Electron Microscopic studies. Effect of shell thickness on optical band gap of the core shell fabricated was also investigated using DRS UV-Visible spectroscopy. A comprehensive study was carried out for the photocatalytic efficiency of core shell nanostructures by evaluating the photo-degradation of Acridine Orange (AO) dye in aqueous solution under visible and solar light irradiations. These results offered simple approaches to the nanoscale engineering and synthesis of MOS hybrid systems to serve as better photocatalytic materials.

  5. On core stability and extendability

    OpenAIRE

    Shellshear, Evan

    2007-01-01

    This paper investigates conditions under which the core of a TU cooperative game is stable. In particular the author extends the idea of extendability to find new conditions under which the core is stable. It is also shown that these new conditions are not necessary for core stability.

  6. Stable phase CdS nanoparticles for optoelectronics: a study on surface morphology, structural and optical characterization

    Directory of Open Access Journals (Sweden)

    Kumar Suresh

    2016-06-01

    Full Text Available This work presents a study on the surface morphology, structure and optical behavior of stable phase cadmium sulphide (CdS nanoparticles synthesized via co-precipitation technique. Scanning electron microscopy (SEM analysis has been employed to study a cluster formation in the aggregated nanoparticles. An image analysis approach using ImageJ has been used to measure the size of nanoparticles from the SEM micrographs. Fourier transform infrared spectroscopic (FT-IR analysis identified absorption peaks of Cd–S stretching along with moisture content. X-ray diffraction (XRD analysis showed that CdS nanoparticles crystallized in wurtzite structure with a preferential orientation along (0 0 2 plane. The particle size, microstrain and lattice constants have been evaluated using XRD data. The lattice parameters of these nanoparticles were found to be shorter than the bulk value which led to lattice contraction. The optical absorption study showed a blue shift in the fundamental absorption edge indicating a quantum size effect.

  7. Impact of forest harvesting on trophic structure of eastern Canadian Boreal Shield lakes: insights from stable isotope analyses.

    Directory of Open Access Journals (Sweden)

    Patricia Glaz

    Full Text Available Perturbations on ecosystems can have profound immediate effects and can, accordingly, greatly alter the natural community. Land-use such as forestry activities in the Canadian Boreal region have increased in the last decades, raising concerns about their potential impact on aquatic ecosystems. The objective of this study was to evaluate the impact of forest harvesting on trophic structure in eastern Canadian Boreal Shield lakes. We measured carbon and nitrogen stable isotopes values for aquatic primary producers, terrestrial detritus, benthic macroinvertebrates, zooplankton and brook trout (Salvelinus fontinalis over a three-year period in eight eastern Boreal Shield lakes. Four lakes were studied before, one and two years after forest harvesting (perturbed lakes and compared with four undisturbed reference lakes (unperturbed lakes sampled at the same time. Stable isotope mixing models showed leaf-litter to be the main food source for benthic primary consumers in both perturbed and unperturbed lakes, suggesting no logging impact on allochthonous subsidies to the littoral food web. Brook trout derived their food mainly from benthic predatory macroinvertebrates in unperturbed lakes. However, in perturbed lakes one year after harvesting, zooplankton appeared to be the main contributor to brook trout diet. This change in brook trout diet was mitigated two years after harvesting. Size-related diet shift were also observed for brook trout, indicating a diet shift related to size. Our study suggests that carbon from terrestrial habitat may be a significant contribution to the food web of oligotrophic Canadian Boreal Shield lakes. Forest harvesting did not have an impact on the diet of benthic primary consumers. On the other hand, brook trout diet composition was affected by logging with greater zooplankton contribution in perturbed lakes, possibly induced by darker-colored environment in these lakes one year after logging.

  8. Impact of forest harvesting on trophic structure of eastern Canadian Boreal Shield lakes: insights from stable isotope analyses.

    Science.gov (United States)

    Glaz, Patricia; Sirois, Pascal; Archambault, Philippe; Nozais, Christian

    2014-01-01

    Perturbations on ecosystems can have profound immediate effects and can, accordingly, greatly alter the natural community. Land-use such as forestry activities in the Canadian Boreal region have increased in the last decades, raising concerns about their potential impact on aquatic ecosystems. The objective of this study was to evaluate the impact of forest harvesting on trophic structure in eastern Canadian Boreal Shield lakes. We measured carbon and nitrogen stable isotopes values for aquatic primary producers, terrestrial detritus, benthic macroinvertebrates, zooplankton and brook trout (Salvelinus fontinalis) over a three-year period in eight eastern Boreal Shield lakes. Four lakes were studied before, one and two years after forest harvesting (perturbed lakes) and compared with four undisturbed reference lakes (unperturbed lakes) sampled at the same time. Stable isotope mixing models showed leaf-litter to be the main food source for benthic primary consumers in both perturbed and unperturbed lakes, suggesting no logging impact on allochthonous subsidies to the littoral food web. Brook trout derived their food mainly from benthic predatory macroinvertebrates in unperturbed lakes. However, in perturbed lakes one year after harvesting, zooplankton appeared to be the main contributor to brook trout diet. This change in brook trout diet was mitigated two years after harvesting. Size-related diet shift were also observed for brook trout, indicating a diet shift related to size. Our study suggests that carbon from terrestrial habitat may be a significant contribution to the food web of oligotrophic Canadian Boreal Shield lakes. Forest harvesting did not have an impact on the diet of benthic primary consumers. On the other hand, brook trout diet composition was affected by logging with greater zooplankton contribution in perturbed lakes, possibly induced by darker-colored environment in these lakes one year after logging.

  9. Population-Level Metrics of Trophic Structure Based on Stable Isotopes and Their Application to Invasion Ecology

    Science.gov (United States)

    Jackson, Michelle C.; Donohue, Ian; Jackson, Andrew L.; Britton, J. Robert; Harper, David M.; Grey, Jonathan

    2012-01-01

    Biological invasions are a significant driver of human-induced global change and many ecosystems sustain sympatric invaders. Interactions occurring among these invaders have important implications for ecosystem structure and functioning, yet they are poorly understood. Here we apply newly developed metrics derived from stable isotope data to provide quantitative measures of trophic diversity within populations or species. We then use these to test the hypothesis that sympatric invaders belonging to the same functional feeding group occupy a smaller isotopic niche than their allopatric counterparts. Two introduced, globally important, benthic omnivores, Louisiana swamp crayfish (Procambarus clarkii) and carp (Cyprinus carpio), are sympatric in Lake Naivasha, Kenya. We applied our metrics to an 8-year data set encompassing the establishment of carp in the lake. We found a strong asymmetric interaction between the two invasive populations, as indicated by inverse correlations between carp abundance and measures of crayfish trophic diversity. Lack of isotopic niche overlap between carp and crayfish in the majority of years indicated a predominantly indirect interaction. We suggest that carp-induced habitat alteration reduced the diversity of crayfish prey, resulting in a reduction in the dietary niche of crayfish. Stable isotopes provide an integrated signal of diet over space and time, offering an appropriate scale for the study of population niches, but few isotope studies have retained the often insightful information revealed by variability among individuals in isotope values. Our population metrics incorporate such variation, are robust to the vagaries of sample size and are a useful additional tool to reveal subtle dietary interactions among species. Although we have demonstrated their applicability specifically using a detailed temporal dataset of species invasion in a lake, they have a wide array of potential ecological applications. PMID:22363724

  10. Structural elucidation of a novel core oligosaccharide backbone of the lipopolysaccharide from the new bacterial species Agrobacterium larrymoorei.

    Science.gov (United States)

    Molinaro, Antonio; De Castro, Cristina; Lanzetta, Rosa; Parrilli, Michelangelo; Raio, Aida; Zoina, Astolfo

    2003-11-14

    Agrobacterium larrymoorei is a Gram-negative phytopathogenic bacterium, which produces tumours on Ficus benjamina plants and differs from other Agrobacteria both genetically and biochemically. The lipopolysaccharide (LPS) plays an important role in the pathogenesis of Agrobacteria. The present paper is the first report on the molecular primary structure of the core region of an Agrobacterium LPS. The following structure of the core and lipid A carbohydrate backbone of an R-form LPS of A. larrymoorei was determined by chemical degradations and 1D and 2D NMR spectroscopy: [carbohydrate structure: see text] All sugars are alpha-D-pyranoses if not stated otherwise, Kdo is 3-deoxy-D-manno-oct-2-ulosonic acid, Qui3NAcyl is 3,6-dideoxy-3-(3-hydroxy-2,3-dimethyl-5-oxoprolylamino)glucose, GlcAN and GalAN are amides of GlcA and GalA.

  11. Meisoindigo, but not its core chemical structure indirubin, inhibits zebrafish interstitial leukocyte chemotactic migration.

    Science.gov (United States)

    Ye, Baixin; Xiong, Xiaoxing; Deng, Xu; Gu, Lijuan; Wang, Qiongyu; Zeng, Zhi; Gao, Xiang; Gao, Qingping; Wang, Yueying

    2017-12-01

    Inflammatory disease is a big threat to human health. Leukocyte chemotactic migration is required for efficient inflammatory response. Inhibition of leukocyte chemotactic migration to the inflammatory site has been shown to provide therapeutic targets for treating inflammatory diseases. Our study was designed to discover effective and safe compounds that can inhibit leukocyte chemotactic migration, thus providing possible novel therapeutic strategy for treating inflammatory diseases. In this study, we used transgenic zebrafish model (Tg:zlyz-EGFP line) to visualize the process of leukocyte chemotactic migration. Then, we used this model to screen the hit compound and evaluate its biological activity on leukocyte chemotactic migration. Furthermore, western blot analysis was performed to evaluate the effect of the hit compound on the AKT or ERK-mediated pathway, which plays an important role in leukocyte chemotactic migration. In this study, using zebrafish-based chemical screening, we identified that the hit compound meisoindigo (25 μM, 50 μM, 75 μM) can significantly inhibit zebrafish leukocyte chemotactic migration in a dose-dependent manner (p = 0.01, p = 0.0006, p migration (p = 0.43). Furthermore, our results unexpectedly showed that indirubin, the core structure of meisoindigo, had no significant effect on zebrafish leukocyte chemotactic migration (p = 0.6001). Additionally, our results revealed that meisoindigo exerts no effect on the Akt or Erk-mediated signalling pathway. Our results suggest that meisoindigo, but not indirubin, is effective for inhibiting leukocyte chemotactic migration, thus providing a potential therapeutic agent for treating inflammatory diseases.

  12. Mars Internal Structure: Seismic Predictions for Core Phase Arrivals in Anticipation of the InSight Mission

    Science.gov (United States)

    Weber, R. C.; Banerdt, W. B.; Lognonne, P. H.; Hempel, S.; Panning, M. P.; Schmerr, N. C.; Garcia, R.; Shiro, B.; Gudkova, T.

    2016-12-01

    We present a methodology to constrain the seismic structure of the Martian core in preparation for the return of data from the InSight mission. Expected amplitudes for marsquakes assuming a medium seismicity model support the likely observation of core reflections of P and S energy for events with magnitude greater than MW 4.5. For the mission duration, we would expect to record on the order of 10 events of at least this magnitude. Our method predicts the ray density of core reflected (PcP, ScS) and transmitted (PKP, SKS) phases for various core sizes with core-mantle boundary depths between 1650 and 2100 km. Ray density is defined as the fraction of rays in a small source-receiver interval normalized by the total number of rays over a great circle slice through the planet. The ray density of a given phase is scaled by predicted amplitudes calculated considering attenuation, geometric spreading and reflection/transmission coefficients at discontinuities along the ray path. Maximum PcP/ScS amplitudes are expected at epicentral distances of 40-100 degrees. Thus, if present, strong seismicity in the Hellas and Tharsis region may facilitate core detection. For events with MW above 4.5, ScS and SKS signals are expected to lie above the lander noise, but PcP and PKP signals may barely be visible. The resolution of these phases can be improved by applying stacking techniques to account for expected background noise, scattering, and interfering seismic phases. These techniques were successfully applied to Apollo seismograms to infer the radial structure of the lunar core. Even if source depth and location have large uncertainties during a single-station mission to Mars, different phases can be distinguished by their slownesses. Prior to the summation of the traces of individual events, signals are aligned to a reference phase, e.g. the PcP onset assuming various core radii. A maximum in signal coherency corresponds to the best fitting core radius. In the case of lunar

  13. An affected core drives network integration deficits of the structural connectome in 22q11.2 deletion syndrome

    Directory of Open Access Journals (Sweden)

    František Váša

    2016-01-01

    Full Text Available Chromosome 22q11.2 deletion syndrome (22q11DS is a genetic disease known to lead to cerebral structural alterations, which we study using the framework of the macroscopic white-matter connectome. We create weighted connectomes of 44 patients with 22q11DS and 44 healthy controls using diffusion tensor magnetic resonance imaging, and perform a weighted graph theoretical analysis. After confirming global network integration deficits in 22q11DS (previously identified using binary connectomes, we identify the spatial distribution of regions responsible for global deficits. Next, we further characterize the dysconnectivity of the deficient regions in terms of sub-network properties, and investigate their relevance with respect to clinical profiles. We define the subset of regions with decreased nodal integration (evaluated using the closeness centrality measure as the affected core (A-core of the 22q11DS structural connectome. A-core regions are broadly bilaterally symmetric and consist of numerous network hubs — chiefly parietal and frontal cortical, as well as subcortical regions. Using a simulated lesion approach, we demonstrate that these core regions and their connections are particularly important to efficient network communication. Moreover, these regions are generally densely connected, but less so in 22q11DS. These specific disturbances are associated to a rerouting of shortest network paths that circumvent the A-core in 22q11DS, “de-centralizing” the network. Finally, the efficiency and mean connectivity strength of an orbito-frontal/cingulate circuit, included in the affected regions, correlate negatively with the extent of negative symptoms in 22q11DS patients, revealing the clinical relevance of present findings. The identified A-core overlaps numerous regions previously identified as affected in 22q11DS as well as in schizophrenia, which approximately 30–40% of 22q11DS patients develop.

  14. Defining the Core Citrus Leaf- and Root-Associated Microbiota: Factors Associated with Community Structure and Implications for Managing Huanglongbing (Citrus Greening) Disease.

    Science.gov (United States)

    Blaustein, Ryan A; Lorca, Graciela L; Meyer, Julie L; Gonzalez, Claudio F; Teplitski, Max

    2017-06-01

    Stable associations between plants and microbes are critical to promoting host health and productivity. The objective of this work was to test the hypothesis that restructuring of the core microbiota may be associated with the progression of huanglongbing (HLB), the devastating citrus disease caused by Liberibacter asiaticus , Liberibacter americanus , and Liberibacter africanus The microbial communities of leaves ( n = 94) and roots ( n = 79) from citrus trees that varied by HLB symptom severity, cultivar, location, and season/time were characterized with Illumina sequencing of 16S rRNA genes. The taxonomically rich communities contained abundant core members (i.e., detected in at least 95% of the respective leaf or root samples), some overrepresented site-specific members, and a diverse community of low-abundance variable taxa. The composition and diversity of the leaf and root microbiota were strongly associated with HLB symptom severity and location; there was also an association with host cultivar. The relative abundance of Liberibacter spp. among leaf microbiota positively correlated with HLB symptom severity and negatively correlated with alpha diversity, suggesting that community diversity decreases as symptoms progress. Network analysis of the microbial community time series identified a mutually exclusive relationship between Liberibacter spp. and members of the Burkholderiaceae , Micromonosporaceae , and Xanthomonadaceae This work confirmed several previously described plant disease-associated bacteria, as well as identified new potential implications for biological control. Our findings advance the understanding of (i) plant microbiota selection across multiple variables and (ii) changes in (core) community structure that may be a precondition to disease establishment and/or may be associated with symptom progression. IMPORTANCE This study provides a comprehensive overview of the core microbial community within the microbiomes of plant hosts that vary

  15. Experimental and numerical analysis of fluid - structure interaction effects in a fast reactor core

    International Nuclear Information System (INIS)

    Martelli, A.; Forni, M.; Melloni, R.; Paoluzzi, R.; Bonacina, G.; Castoldi, A.; Zola, M.

    1990-01-01

    Dynamic experiments in air and water (simulating liquid sodium) were performed by ISMES, on behalf of ENEA, on various core element groups of the Italian PEC fast reactor. Bundles of one, seven and nineteen mock-ups reproducing fuel, reflecting and neutron shield elements in full scale were analysed on shaking tables. Tests concerned both groups of equal elements and mixed configurations which corresponded to real core parts. The effects of PEC core-restraint ring were also studied. Seismic excitations of up to 2.5 g were applied to core diagrid. Test results were analysed by use of the one-dimensional program CORALIE and the two-dimensional program CLASH. The study allowed the fluid effects in the PEC core to be evaluated; it also contributed to validation of the above mentioned programs for their general use for fast reactor core analysis. This paper presents the main features of the experimental and the numerical studies and reports comparisons between calculations and measurements. (author)

  16. Integral manifolding structure for fuel cell core having parallel gas flow

    Science.gov (United States)

    Herceg, Joseph E.

    1984-01-01

    Disclosed herein are manifolding means for directing the fuel and oxidant gases to parallel flow passageways in a fuel cell core. Each core passageway is defined by electrolyte and interconnect walls. Each electrolyte and interconnect wall consists respectively of anode and cathode materials layered on the opposite sides of electrolyte material, or on the opposite sides of interconnect material. A core wall projects beyond the open ends of the defined core passageways and is disposed approximately midway between and parallel to the adjacent overlaying and underlying interconnect walls to define manifold chambers therebetween on opposite sides of the wall. Each electrolyte wall defining the flow passageways is shaped to blend into and be connected to this wall in order to redirect the corresponding fuel and oxidant passageways to the respective manifold chambers either above or below this intermediate wall. Inlet and outlet connections are made to these separate manifold chambers respectively, for carrying the fuel and oxidant gases to the core, and for carrying their reaction products away from the core.

  17. Size dependent structural, vibrational and magnetic properties of BiFeO3 and core-shell structured BiFeO3@SiO2 nanoparticles

    International Nuclear Information System (INIS)

    Chauhan, Sunil; Kumar, Manoj; Chhoker, Sandeep; Katyal, S. C.

    2014-01-01

    Bulk BiFeO 3 , BiFeO 3 nanoparticles and core-shell structured BiFeO 3 @SiO 2 nanoparticles were synthesized by solid state reaction method, sol-gel and Stöber process (SiO 2 shell) respectively. Transmission electron microscopy image confirmed the core-shell structure of BiFeO 3 @SiO 2 nanoparticles with BiFeO3 core ∼50-90 nm and SiO 2 shell ∼16 nm. X-ray diffraction and FTIR spectroscopy results showed the presence of distorted rhombohedral structure with R3c space group in all three samples. The magnetic measurement indicated the existence of room-temperature weak ferromagnetism in core-shell BiFeO 3 @SiO 2 nanoparticles and BiFeO3 nanoparticles, whereas bulk BiFeO 3 showed antiferromagnteic nature. Electron Spin Resonance results confirmed the enhancement in magnetic properties of coreshell structured BiFeO 3 @SiO 2 nanoparticles in comparison with BiFeO 3 nanoparticles and bulk BiFeO 3

  18. Controllable dielectric and electrical performance of polymer composites with novel core/shell-structured conductive particles through biomimetic method

    International Nuclear Information System (INIS)

    Yang, Dan; Tian, Ming; Wang, Wencai; Li, Dongdong; Li, Runyuan; Liu, Haoliang; Zhang, Liqun

    2013-01-01

    Highlights: ► Conductive core/shell-structured particles were synthesized by biomimetic method. ► These particles with silica/poly(dopamine)/silver core and poly(dopamine) shell. ► Dielectric composites were prepared with resulted particles and silicone elastomer. ► The dielectric properties of the composites can be controlled by shell thickness. ► This biomimetic method is simple, nontoxic, efficient and easy to control. - Abstract: Novel silica/poly(dopamine)/silver (from inner to outer) (denoted as SiO 2 /PDA/Ag) conductive micro-particles were first synthesized by biomimetic poly(dopamine) coating. These micro-particles were then coated with a poly(dopamine) layer to form core/shell-structured particles, with silica/poly(dopamine)/silver core and poly(dopamine) shell (denoted as SiO 2 /PDA/Ag/PDA). This multilayer core/shell micro-particles were confirmed by scanning electron microscopy, X-ray photoelectron spectroscopy, X-ray diffraction, and transmission electron microscope. Polymer composites were then prepared by mechanical blending of poly(dimethyl siloxane) and the core/shell-structured particles. It was found that the silver layer and the poly(dopamine) shell had good adhesion with substrate and they kept intact even under violent shearing stress during mechanical mixing. The effect of the thickness of outermost poly(dopamine) shell as well as the loading amount of this filler on the dielectric and electrical properties of the composites was further studied. The results showed that the dielectric constant, dielectric loss, and conductivity of the composites decreased with increasing shell thickness (10–53 nm) at the same loading level. And the maximal dielectric constant of composites was achieved in the composites filled with SiO 2 /PDA/Ag/PDA (with 10–15 nm PDA shell) particles, which was much larger than that of the composite filled with SiO 2 /PDA/Ag particles without insulative PDA shell. At the same time, the composites can change

  19. Trophic structure of mesopelagic fishes in the Gulf of Mexico revealed by gut content and stable isotope analyses

    Science.gov (United States)

    McClain-Counts, Jennifer P.; Demopoulos, Amanda W.J.; Ross, Steve W.

    2017-01-01

    Mesopelagic fishes represent an important component of the marine food web due to their global distributions, high abundances and ability to transport organic material throughout a large part of the water column. This study combined stable isotope (SIAs) and gut content analyses (GCAs) to characterize the trophic structure of mesopelagic fishes in the North-Central Gulf of Mexico. Additionally, this study examined whether mesopelagic fishes utilized chemosynthetic energy from cold seeps. Specimens were collected (9–25 August 2007) over three deep (>1,000 m) cold seeps at discrete depths (surface to 1,503 m) over the diurnal cycle. GCA classified 31 species (five families) of mesopelagic fishes into five feeding guilds: piscivores, large crustacean consumers, copepod consumers, generalists and mixed zooplanktivores. However, these guilds were less clearly defined based on stable isotope mixing model (MixSIAR) results, suggesting diets may be more mixed over longer time periods (weeks–months) and across co-occurring species. Copepods were likely important for the majority of mesopelagic fishes, consistent with GCA (this study) and previous literature. MixSIAR results also identified non-crustacean prey items, including salps and pteropods, as potentially important prey items for mesopelagic fishes, including those fishes not analysed in GCA (Sternoptyx spp. and Melamphaidae). Salps and other soft-bodied species are often missed in GCAs. Mesopelagic fishes had δ13C results consistent with particulate organic matter serving as the baseline organic carbon source, fueling up to three trophic levels. Fishes that undergo diel vertical migration were depleted in 15N relative to weak migrators, consistent with depth-specific isotope trends in sources and consumers, and assimilation of 15N-depleted organic matter in surface waters. Linear correlations between fish size and δ15N values suggested ontogenetic changes in fish diets for several species. While there was

  20. Atomic-scale structure relaxation, chemistry and charge distribution of dislocation cores in SrTiO3.

    Science.gov (United States)

    Gao, Peng; Ishikawa, Ryo; Feng, Bin; Kumamoto, Akihito; Shibata, Naoya; Ikuhara, Yuichi

    2018-01-01

    By using the state-of-the-art microscopy and spectroscopy in aberration-corrected scanning transmission electron microscopes, we determine the atomic arrangements, occupancy, elemental distribution, and the electronic structures of dislocation cores in the 10° tilted SrTiO 3 bicrystal. We identify that there are two different types of oxygen deficient dislocation cores, i.e., the SrO plane terminated Sr 0.82 Ti 0.85 O 3-x (Ti 3.67+ , 0.48 ≤ x ≤ 0.91) and TiO 2 plane terminated Sr 0.63 Ti 0.90 O 3-y (Ti 3.60+ , 0.57 ≤ y ≤ 1). They have the same Burgers vector of a[100] but different atomic arrangements and chemical properties. Besides the oxygen vacancies, Sr vacancies and rocksalt-like titanium oxide reconstruction are also identified in the dislocation core with TiO 2 plane termination. Our atomic-scale study reveals the true atomic structures and chemistry of individual dislocation cores, providing useful insights into understanding the properties of dislocations and grain boundaries. Copyright © 2017 Elsevier B.V. All rights reserved.

  1. Facile Synthesis of Yolk/Core-Shell Structured TS-1@Mesosilica Composites for Enhanced Hydroxylation of Phenol

    KAUST Repository

    Zou, Houbing

    2015-12-14

    © 2015 by the authors. In the current work, we developed a facile synthesis of yolk/core-shell structured TS-1@mesosilica composites and studied their catalytic performances in the hydroxylation of phenol with H2O2 as the oxidant. The core-shell TS-1@mesosilica composites were prepared via a uniform coating process, while the yolk-shell TS-1@mesosilica composite was prepared using a resorcinol-formaldehyde resin (RF) middle-layer as the sacrificial template. The obtained materials were characterized by X-ray diffraction (XRD), N2 sorption, Fourier transform infrared spectoscopy (FT-IR) UV-Visible spectroscopy, scanning electron microscopy (SEM) and transmission electron microscopy (TEM). The characterization results showed that these samples possessed highly uniform yolk/core-shell structures, high surface area (560–700 m2 g−1) and hierarchical pore structures from oriented mesochannels to zeolite micropores. Importantly, owing to their unique structural properties, these composites exhibited enhanced activity, and also selectivity in the phenol hydroxylation reaction.

  2. Étude expérimentale de structures stables en turbulence bidimensionnelle, comparaison avec une théorie de mécanique statistique

    OpenAIRE

    DENOIX , Marie-Alice

    1992-01-01

    We create two-dimensional flows within a thin layer of mercury, horizontal and subjected to a vertical uniform magnetic field. The fluid is set in motion by injecting electrical currents. We are interested in the inertial organization into stable structures of two-dimensional turbulence. With the experimental conditions in two areas of initial vorticity, we get axisymmetric structures, elliptical, or eccentric. We study these structures using visualizations and also measurements by potential ...

  3. Core-shell structure in (La/Ce)CrO3 nanoparticles: evidences from macroscopic, microscopic and mesoscopic studies

    International Nuclear Information System (INIS)

    Manna, P.K.; Yusuf, S.M.; Mukadam, M.D.; Kohlbrecher, J.

    2013-01-01

    The fundamental properties of a magnetic material vary considerably at the nanoscale as compared to its bulk counterpart. This is often ascribed to the presence of disordered spins at the surface of the nanoparticles. The magnetic behavior of these surface-spins is different from the core-spins, and hence we can consider such nanoparticles as a core-shell type. However, it is difficult to get an evidence of this shell in a 'bare' nanoparticle system, because the magnetization-contributions of core and shell become indistinguishable in most cases. We have used a combination of microscopic neutron diffraction, mesoscopic polarized neutron small angle scattering (SANSPOL), and macroscopic dc-magnetization techniques to investigate core-shell structure in 'bare' La 0.2 Ce 0.8 CrO 3 nanoparticles, synthesized by using a two-step method. It is noteworthy to mention here that, in our study, the La 0.2 Ce 0.8 CrO 3 nanoparticles showed a novel coexistence of magnetization and exchange-bias-field sign-reversal, which might have an application in designing volatile and thermally assisted magnetic memory elements. The first evidence of a possible core-shell structure was obtained from the presence of surface roughness/defects in the high resolution transmission electron microscopy images. Microscopic neutron diffraction study depicted that these nanoparticles are antiferromagnetic in nature. However, the SANSPOL data at 2.5 K under a 3.5-T magnetic field show the presence of a pronounced asymmetric scattering in the iso-intensity plot signifying the presence of a strong interference between nuclear and magnetic scattering amplitudes. It has been argued that the presence of such asymmetric scattering in the SANSPOL data of these antiferromagnetic nanoparticles arises from the shell. The mean core diameter and shell thickness are found to be 12.3 ± 1.1, and 2.8 ± 0.4 nm, respectively. The net magnetization (observed from the dc magnetization study), arising from the shell of

  4. The effect of graded glass-zirconia structure on the bond between core and veneer in layered zirconia restorations.

    Science.gov (United States)

    Liu, Ruoyu; Sun, Ting; Zhang, Yanli; Zhang, Yaokun; Jiang, Danyu; Shao, Longquan

    2015-06-01

    The aim of this study was to test the hypothesis that a graded glass-zirconia structure can strengthen the core-veneer bond in layered zirconia materials. A graded glass-zirconia structure was fabricated by infiltrating glass compositions developed in our laboratory into a presintered yttria tetrahedral zirconia polycrystal (Y-TZP) substrate by the action of capillary forces. The wettability of the infiltrated glass and Y-TZP substrate was investigated by the sessile drop technique. The microstructures of the graded glass-zirconia structure were examined by scanning electron microscopy (SEM). The phase structure characterization in the graded glass-zirconia structure were identified by X-ray diffraction (XRD) analysis. The elastic modulus and hardness of the graded glass-zirconia structure were evaluated from nanoindentations. Further, the shear bond strength (SBS) of the graded glass-zirconia structure and veneering porcelain was also evaluated. SEM images confirmed the formation of the graded glass-zirconia structure. Glass frits wet the Y-TZP substrate at 1200 °C with a contact angle of 43.2°. Only a small amount of t-m transformation was observed in as-infiltrated Y-TZP specimens. Nanoindentation studies of the glass-zirconia graded structure showed that the elastic modulus and hardness of the surface glass layer were higher than those of the dense Y-TZP layer. The mean SBS values for the graded glass-zirconia structure and veneering porcelain (24.35 ± 0.40 MPa) were statistically higher than those of zirconia and veneering porcelain (9.22 ± 0.20 MPa) (Pzirconia structure can be fabricated by the glass infiltration/densification technique, and this structure exhibits a strong core-veneer bond. Copyright © 2015 Elsevier Ltd. All rights reserved.

  5. The geology and gravity field in the central core of the Vredefort structure

    Science.gov (United States)

    Stepto, D.

    1990-01-01

    The centre of the Vredefort structure in South Africa comprises an uplifted granitic basement with an associated 300 g.u. gravity high ringed by upturned sedimentary strata. Detailed geological mapping of the basement core has delineated a three-fold concentric zoning of Outer Granite Gneisses (OGG), Steynskraal Formation (SF) and Inlandsee Leucogranofels (ILG). An increase in metamorphic grade occurs toward the centre of the structure from greenschist relics on the basement perimeter to upper amphibolite and granulite facies in the SF and granulite facies in the ILG. A marked lithological change occurs within the SF in which perimeter greenschists and inner amphibolites give way to paragneisses. In the ILG, paragneiss and mafic granulite relics predominate. These divisions are consistent with the "standing-on-edge" model for the basement 1. Three regional metamorphic episodes and two thermal events have been recognised. M1 and M3 both attained granulite facies at low-medium load pressures in the ILG. M1 granulite-facies assemblages extended into the OGG, but the M3 facies was restricted to the ILG. M2 was a K-metasomatism event limited to the OGG. An extensive thermal episode, M4 a, is provisionally correlated with the collar metamorphism. Pyroxene hornfels facies ( T = ± 800 ° C) was attained in the centre as opposed to conditions of P = 4-5 kbar and T = 650° C for alkali granite stocks in the sedimentary collar 2. This event was thus pre- or syn-uplift, but not post-uplift. A high-level, high-temperature ( P collar and were intruded syn- to post- M4 a in several episodes of decreasing basicity. "Shock" metamorphic features, granitic breccias and pseudotachylite are linked to the late-stage history of the structure and a case is presented for a dynamic metamorphic "front" advancing outward and upward from the centre in response to unroofing of the basement. The central gravity high 3 is delineated by 1239 new gravity stations at 1 km and 0.5 km intervals. A

  6. Structurally Deformed MoS2 for Electrochemically Stable, Thermally Resistant, and Highly Efficient Hydrogen Evolution Reaction.

    Science.gov (United States)

    Chen, Yen-Chang; Lu, Ang-Yu; Lu, Ping; Yang, Xiulin; Jiang, Chang-Ming; Mariano, Marina; Kaehr, Bryan; Lin, Oliver; Taylor, André; Sharp, Ian D; Li, Lain-Jong; Chou, Stanley S; Tung, Vincent

    2017-11-01

    The emerging molybdenum disulfide (MoS 2 ) offers intriguing possibilities for realizing a transformative new catalyst for driving the hydrogen evolution reaction (HER). However, the trade-off between catalytic activity and long-term stability represents a formidable challenge and has not been extensively addressed. This study reports that metastable and temperature-sensitive chemically exfoliated MoS 2 (ce-MoS 2 ) can be made into electrochemically stable (5000 cycles), and thermally robust (300 °C) while maintaining synthetic scalability and excellent catalytic activity through physical-transformation into 3D structurally deformed nanostructures. The dimensional transition enabled by a high throughput electrohydrodynamic process provides highly accessible, and electrochemically active surface area and facilitates efficient transport across various interfaces. Meanwhile, the hierarchically strained morphology is found to improve electronic coupling between active sites and current collecting substrates without the need for selective engineering the electronically heterogeneous interfaces. Specifically, the synergistic combination of high strain load stemmed from capillarity-induced-self-crumpling and sulfur (S) vacancies intrinsic to chemical exfoliation enables simultaneous modulation of active site density and intrinsic HER activity regardless of continuous operation or elevated temperature. These results provide new insights into how catalytic activity, electrochemical-, and thermal stability can be concurrently enhanced through the physical transformation that is reminiscent of nature, in which properties of biological materials emerge from evolved dimensional transitions. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  7. Structural, physiological, and stable carbon isotopic evidence that the enigmatic Paleozoic fossil Prototaxites formed from rolled liverwort mats.

    Science.gov (United States)

    Graham, Linda E; Cook, Martha E; Hanson, David T; Pigg, Kathleen B; Graham, James M

    2010-02-01

    New structural, nutritional, and stable carbon isotope data may resolve a long-standing mystery-the biological affinities of the fossil Prototaxites, the largest organism on land during the Late Silurian to Late Devonian (420-370 Ma). The tree trunk-shaped specimens, of varying dimensions but consistent tubular anatomy, first formed prior to vascular plant dominance. Hence, Prototaxites has been proposed to represent giant algae, fungi, or lichens, despite incompatible biochemical and anatomical observations. Our comparative analyses instead indicate that Prototaxites formed from partially degraded, wind-, gravity-, or water-rolled mats of mixotrophic liverworts having fungal and cyanobacterial associates, much like the modern liverwort genus Marchantia. We propose that the fossil body is largely derived from abundant, highly degradation-resistant, tubular rhizoids of marchantioid liverworts, intermixed with tubular microbial elements. Our concept explains previously puzzling fossil features and is consistent with evidence for liverworts and microbial associates in Ordovician-Devonian deposits, extensive ancient and modern marchantioid mats, and modern associations of liverworts with cyanobacteria and diverse types of fungi. Our interpretation indicates that liverworts were important components of Devonian ecosystems, that some macrofossils and microfossils previously attributed to "nematophytes" actually represent remains of ancient liverworts, and that mixotrophy and microbial associations were features of early land plants.

  8. Structurally Deformed MoS2 for Electrochemically Stable, Thermally Resistant, and Highly Efficient Hydrogen Evolution Reaction

    KAUST Repository

    Chen, Yen-Chang

    2017-10-12

    The emerging molybdenum disulfide (MoS2) offers intriguing possibilities for realizing a transformative new catalyst for driving the hydrogen evolution reaction (HER). However, the trade-off between catalytic activity and long-term stability represents a formidable challenge and has not been extensively addressed. This study reports that metastable and temperature-sensitive chemically exfoliated MoS2 (ce-MoS2) can be made into electrochemically stable (5000 cycles), and thermally robust (300 °C) while maintaining synthetic scalability and excellent catalytic activity through physical-transformation into 3D structurally deformed nanostructures. The dimensional transition enabled by a high throughput electrohydrodynamic process provides highly accessible, and electrochemically active surface area and facilitates efficient transport across various interfaces. Meanwhile, the hierarchically strained morphology is found to improve electronic coupling between active sites and current collecting substrates without the need for selective engineering the electronically heterogeneous interfaces. Specifically, the synergistic combination of high strain load stemmed from capillarity-induced-self-crumpling and sulfur (S) vacancies intrinsic to chemical exfoliation enables simultaneous modulation of active site density and intrinsic HER activity regardless of continuous operation or elevated temperature. These results provide new insights into how catalytic activity, electrochemical-, and thermal stability can be concurrently enhanced through the physical transformation that is reminiscent of nature, in which properties of biological materials emerge from evolved dimensional transitions.

  9. Highly transparent, stable, and superhydrophobic coatings based on gradient structure design and fast regeneration from physical damage

    Science.gov (United States)

    Chen, Zao; Liu, Xiaojiang; Wang, Yan; Li, Jun; Guan, Zisheng

    2015-12-01

    Optical transparency, mechanical flexibility, and fast regeneration are important factors to expand the application of superhydrophobic surfaces. Herein, we fabricated highly transparent, stable, and superhydrophobic coatings through a novel gradient structure design by versatile dip-coating of silica colloid particles (SCPs) and diethoxydimethysiliane cross-linked silica nanoparticles (DDS-SNPs) on polyethylene terephthalate (PET) film and glass, followed by the modification of octadecyltrichlorosiliane (OTCS). When the DDS concentration reached 5 wt%, the modified SCPs/DDS-SNPs coating exhibited a water contact angle (WCA) of 153° and a sliding angle (SA) superhydrophobic coating on PET film and glass was increased by 2.7% and 1% in the visible wavelength, respectively. This superhydrophobic coating also showed good robustness and stability against water dropping impact, ultrasonic damage, and acid solution. Moreover, the superhydrophobic PET film after physical damage can quickly regain the superhydrophobicity by one-step spray regenerative solution of dodecyltrichlorosilane (DTCS) modified silica nanoparticles at room temperature. The demonstrated method for the preparation and regeneration of superhydrophobic coating is available for different substrates and large-scale production at room temperature.

  10. Experimental investigations and finite element analysis of composite sandwich structures with honeycomb core – Evaluation for strength and quality

    Directory of Open Access Journals (Sweden)

    S. A. Abdul Sukkur

    2016-03-01

    Full Text Available Honeycomb cores in composite sandwich structures are economical and appropriate scheme to absorb impact in engineering applications. Hexagonal honeycomb that are conventionally being used displays greater Poisson’s ratio and are typically used for their light weight and higher axial stiffness. Auxetic honeycombs exhibit contradictory properties such as high in plane shear stiffness and shows negative Poisson’s ratio with lateral extension instead of contraction when axially stretched. The research reports suggests the need for greater research evolutions in the field of honeycomb composites structures still considered to be in its naïve state. This study involves analysis of the dynamic response of an aluminum composite panel with a honeycomb core constrained within two thin face subjected to impact with a rigid ball. Parametric analysis and finite element analysis are performed to investigate the governing factors, their interdependencies and the deformations occurring for various loads.

  11. Nitrite sensing composite systems based on a core-shell emissive-superamagnetic structure: Construction, characterization and sensing behavior.

    Science.gov (United States)

    Yang, Yan; Liu, Liang; Zha, Jianhua; Yuan, Ningyi

    2017-04-15

    Two recyclable nitrite sensing composite samples were designed and constructed through a core-shell structure, with Fe 3 O 4 nanoparticles as core, silica molecular sieve MCM-41 as shell and two rhodamine derivatives as chemosensors, respectively. These samples and their structure were identified with their electron microscopy images, N 2 adsorption/desorption isotherms, magnetic response, IR spectra and thermogravimetric analysis. Their nitrite sensing behavior was discussed based on emission intensity quenching, their limit of detection was found as low as 1.2μM. Further analysis suggested a static sensing mechanism between nitrite and chemosensors through an additive reaction between NO + and chemosensors. After finishing their nitrite sensing, these composite samples and their emission could be recycled and recovered by sulphamic acid. Copyright © 2017 Elsevier B.V. All rights reserved.

  12. Structure and chemistry in the northwestern condensation of the Serpens molecular cloud core

    Science.gov (United States)

    Mcmullin, Joseph P.; Mundy, Lee G.; Wilking, Bruce A.; Hezel, T.; Blake, Geoff A.

    1994-01-01

    We present single-dish and interferometric observations of gas and dust in the core of the Serpens molecular cloud, focusing on the northwestern condensation. Single-dish molecular line observations are used to probe the structure and chemistry of the condensation while high-resolution images of CS and CH30H are combined with continuum observations from lambda = 1.3 mm to lambda = 3.5 cm to study the subcondensations and overall distribution of dust. For the northwestern condensation, we derive a characteristic density of 3 x 10(exp 5)/ cu cm and an estimated total mass of approximately 70 solar mass. We find compact molecular emission associated with the far-infrared source S68 FIRS 1, and with a newly detected subcondensation named S68 N. Comparison of the large-and small-scale emission reveals that most of the material in the northwest condensation is not directly associated with these compact sources, suggesting a youthful age for this region. CO J = 1 approaches 0 observations indicate widespread outflow activity. However, no unique association of embedded objects with outflows is possible with our observations. The SiO emission is found to be extended with the overall emission centered about S68 FIRS 1; the offset of the peak emission from all of the known continuum sources and the coincidence between the blueshifted SiO emission and blueshifted high-velocity gas traced by CO and CS is consistent with formation of SiO in shocks. Derived abundances of CO and HCO(+) are consistent with quiescent and other star-forming regions while CS, HCN, and H2CO abundances indicate mild depletions within the condensation. Spectral energy distribution fits to S68 FIRS 1 indicate a modest luminosity (50-60 solar luminosity), implying that it is a low-mass (0.5-3 solar mass) young stellar object. Radio continuum observations of the triple source toward S68 FIRS 1 indicate that the lobe emission is varying on timescales less than or equal to 1 yr while the central component is

  13. Comparing Jupiter interior structure models to Juno gravity measurements and the role of a dilute core

    Science.gov (United States)

    Wahl, S. M.; Hubbard, W. B.; Militzer, B.; Guillot, T.; Miguel, Y.; Movshovitz, N.; Kaspi, Y.; Helled, R.; Reese, D.; Galanti, E.; Levin, S.; Connerney, J. E.; Bolton, S. J.

    2017-05-01

    The Juno spacecraft has measured Jupiter's low-order, even gravitational moments, J2-J8, to an unprecedented precision, providing important constraints on the density profile and core mass of the planet. Here we report on a selection of interior models based on ab initio computer simulations of hydrogen-helium mixtures. We demonstrate that a dilute core, expanded to a significant fraction of the planet's radius, is helpful in reconciling the calculated Jn with Juno's observations. Although model predictions are strongly affected by the chosen equation of state, the prediction of an enrichment of Z in the deep, metallic envelope over that in the shallow, molecular envelope holds. We estimate Jupiter's core to contain a 7-25 Earth mass of heavy elements. We discuss the current difficulties in reconciling measured Jn with the equations of state and with theory for formation and evolution of the planet.

  14. Microbial communities of the Lemon Creek Glacier show subtle structural variation yet stable phylogenetic composition over space and time

    Directory of Open Access Journals (Sweden)

    Cody Springer Sheik

    2015-05-01

    Full Text Available Glaciers are geologically important yet transient ecosystems that support diverse, biogeochemically significant microbial communities. During the melt season glaciers undergo dramatic physical, geochemical and biological changes that exert great influence on downstream biogeochemical cycles. Thus, we sought to understand the temporal melt-season dynamics of microbial communities and associated geochemistry at the terminus of Lemon Creek Glacier (LCG in coastal southern Alaska. Due to late season snowfall, sampling of LCG occurred in three interconnected areas: proglacial Lake Thomas, the lower glacial outflow stream and the glacier’s terminus. LCG associated microbial communities were phylogenetically diverse and varied by sampling location. However, Betaproteobacteria, Alphaproteobacteria and Bacteroidetes dominated communities at all sampling locations. Strict anaerobic groups such as methanogens, SR1, and OP11 were also recovered from glacier outflows, indicating anoxic conditions in at least some portions of the LCG subglacial environment. Microbial community structure was significantly correlated with sampling location and sodium concentrations. Microbial communities sampled from terminus outflow waters exhibited day-to-day fluctuation in taxonomy and phylogenetic similarity. However, these communities were not significantly different from randomly constructed communities from all three sites. These results indicate that glacial outflows share a large proportion of phylogenetic overlap with downstream environments and that the observed significant shifts in community structure are driven by changes in relative abundance of different taxa, and not complete restructuring of communities. We conclude that LCG glacial discharge hosts a diverse and relatively stable microbiome that shifts at fine taxonomic scales in response to geochemistry and likely water residence time.

  15. A Comparison of Long-Period SKS Datasets And What They Reveal About 1D Outer Core Structure

    Science.gov (United States)

    Houser, C. T.; Ritsema, J. E.; Grand, S.

    2010-12-01

    Seismology is the most direct tool for documenting the presences or absence of outer core stratification. The outermost core is most effectively sampled by SKS, S2KS, S3KS, S4KS, etc.) which have bottoming depths at the top of the outermost core. In order to incorporate modern data sets (e.g., USArray, Europe, China, etc), we need to sift through massive amounts of seismic data to identify the smaller portion of quality signals in a time-efficient manner. We evaluate the application of a cluster analysis technique (Houser et al., 2008) toward identifying and evaluating the SKS phases that traverse the outer core. Cluster analysis is a semi-automated method for interrogating large datasets by processing all the data for an earthquake while allowing the user to graphically interact with the data to remove low quality records. The Houser et al. (2008) cluster analysis method has already been applied to diffracted S waves (Manners et al., 2004), and here we will expand the cluster analysis to the radial component core phases. These newly measured SKS arrival times will be compared with SKS arrival time measurements used in previous mantle tomographic models, namely, S20RTS (Ritsema and van Heist, 2002) using a purely automated method and TXBW (Grand, 2002) using a purely manual method. We find that the arrival times collected by the three methods (automated, clustered, and manual) during overlapping time frames are in agreement within the measurement error bars. Therefore, the SKS data from these studies can be combined to constrain the radial structure of the outermost core. Thus, cluster analysis is an ideal tool for developing a large compilation of SKS arrival times from modern global seismic data, while simultaneously providing a measure of data quality.

  16. Layout of PWR in-core instrumentation system tubing and support structure with Bechtel 3D-CADD

    International Nuclear Information System (INIS)

    Ichikawa, T.; Pfeifer, B.W.; Mulay, J.N.

    1987-01-01

    The optimization study of the PWR In-Core Instrumentation System (ICIS) tubing layout and support structure presented an opportunity to utilize the Bechtel 3D-CADD program to perform this task. This paper provides a brief summary of the Bechtel 3D-CADD program development and capabilities and outlines the process of developing and optimizing the ICIS tube layout. Specific aspects relating to the ICIS tube layout criteria, support, alignment, electronic interference check and erection sequence are provided. (orig.)

  17. Soft-sediment deformation structures in cores from lacustrine slurry deposits of the Late Triassic Yanchang Fm. (central China

    Directory of Open Access Journals (Sweden)

    Yang Renchao

    2016-09-01

    Full Text Available The fine-grained autochthonous sedimentation in the deep part of a Late Triassic lake was frequently interrupted by gravity-induced mass flows. Some of these mass flows were so rich in water that they must have represented slurries. This can be deduced from the soft-sediment deformation structures that abound in cores from these lacustrine deposits which constitute the Yanchang Fm., which is present in the Ordos Basin (central China.

  18. Hepatitis C virus RNA and core protein in kidney glomerular and tubular structures isolated with laser capture microdissection

    Science.gov (United States)

    Sansonno, D; Lauletta, G; Montrone, M; Grandaliano, G; Schena, F P; Dammacco, F

    2005-01-01

    The role of hepatits C virus (HCV) in the production of renal injury has been extensively investigated, though with conflicting results. Laser capture microdissection (LCM) was performed to isolate and collect glomeruli and tubules from 20 consecutive chronically HCV-infected patients, namely 6 with membranoproliferative glomerulonephritis, 4 with membranous glomerulonephritis, 7 with focal segmental glomerulosclerosis and 3 with IgA-nephropathy. RNA for amplification of specific viral sequences was provided by terminal continuation methodology and compared with the expression profile of HCV core protein. For each case two glomeruli and two tubular structures were microdissected and processed. HCV RNA sequences were demonstrated in 26 (65%) of 40 glomeruli, but in only 4 (10%) of the tubules (P < 0·05). HCV core protein was concomitant with viral sequences in the glomeruli and present in 31 of the 40 tubules. HCV RNA and/or HCV core protein was found in all four disease types. The immunohistochemical picture of HCV core protein was compared with the LCM-based immunoassays of the adjacent tissue sections. Immune deposits were detected in 7 (44%) of 16 biopsy samples shown to be positive by extraction methods. The present study indicates that LCM is a reliable method for measuring both HCV RNA genomic sequences and HCV core protein in kidney functional structures from chronically HCV-infected patients with different glomerulopathies and provides a useful baseline estimate to define the role of HCV in the production of renal injury. The different distribution of HCV RNA and HCV-related proteins may reflect a peculiar ‘affinity’ of kidney microenvironments for HCV and point to distinct pathways of HCV-related damage in glomeruli and tubules. PMID:15932511

  19. Structural characterization of Pt-Pd and Pd-Pt core-shell nanoclusters at atomic resolution.

    Science.gov (United States)

    Sanchez, Sergio I; Small, Matthew W; Zuo, Jian-min; Nuzzo, Ralph G

    2009-06-24

    We describe the results of a study at atomic resolution of the structures exhibited by polymer-capped monometallic and bimetallic Pt and Pd nanoclusters--models for nanoscale material electrocatalysts--as carried out using an aberration-corrected scanning transmission electron microscope (STEM). The coupling of sub-nanometer resolution with Z-contrast measurements provides unprecedented insights into the atomic structures and relative elemental speciation of Pt and Pd within these clusters. The work further defines the nature of deeply quenched states that prevent facile conversions of core-shell motifs to equilibrium alloys and the nature of nonidealities such as twinning (icosahedral cores) and atomic segregation that these structures can embed. The nature of the facet structure present in these model systems is revealed by theory directed modeling in which experimental intensity profiles obtained in Z-contrast measurements at atomic resolution are compared to simulated intensity profiles using theoretically predicted cluster geometries. These comparisons show close correspondences between experiment and model and highlight striking structural complexities in these systems that are compositionally sensitive and subject to amplification by subsequent cluster growth processes. The work demonstrates an empowering competency in nanomaterials research for STEM measurements carried out using aberration corrected microscopes, approaches that hold considerable promise for characterizing the structure of these and other important catalytic materials systems at the atomic scale.

  20. Preparation and characterization of core-shell structured α-Fe2O3/SiC spheres

    International Nuclear Information System (INIS)

    Wu Xiangyang; Jin Guoqiang; Guan Lianxiu; Cao Hu; Guo Xiangyun

    2006-01-01

    Fe 2 O 3 /SiC composite microspheres with a core-shell structure were prepared by the carbothermal reduction reaction between poly(styrene sulfonic acid) iron salt and silica. X-ray diffraction, scanning electron microscope and magnetic properties measurement system were employed to characterize the morphology, structure and magnetic properties of the microspheres. From the results, the microspheres with a diameter of 150-400 μm have an α-Fe 2 O 3 core and a SiC shell of tens of microns in thickness. The magnetism of the core-shell structured spheres at 10 4 Oe is much larger than that of pure α-Fe 2 O 3 spheres prepared under the same conditions and the increment in magnetism is attributed to the introduction of iron silicides and SiC. By further chemical treatment, the α-Fe 2 O 3 /SiC microspheres can change into SiC hollow spheres, which have diameters similar to the magnetic spheres and mainly consist of irregular SiC particles. The formation mechanism of the composite and hollow spheres was also discussed

  1. Preparation of core-shell structured CaCO3 microspheres as rapid and recyclable adsorbent for anionic dyes

    Science.gov (United States)

    Zhao, Mengen; Chen, Zhenhua; Lv, Xinyan; Zhou, Kang; Zhang, Jie; Tian, Xiaohan; Ren, Xiuli; Mei, Xifan

    2017-09-01

    Core-shell structured CaCO3 microspheres (MSs) were prepared by a facile, one-pot method at room temperature. The adsorbent dosage and adsorption time of the obtained CaCO3 MSs were investigated. The results suggest that these CaCO3 MSs can rapidly and efficiently remove 99-100% of anionic dyes within the first 2 min. The obtained CaCO3 MSs have a high Brunauer-Emmett-Teller surface area (211.77 m2 g-1). In addition, the maximum adsorption capacity of the obtained CaCO3 MSs towards Congo red was 99.6 mg g-1. We also found that the core-shell structured CaCO3 MSs have a high recycling capability for removing dyes from water. Our results demonstrate that the prepared core-shell structured CaCO3 MSs can be used as an ideal, rapid, efficient and recyclable adsorbent to remove dyes from aqueous solution.

  2. Electrochemical Synthesis of Core-Shell-Structured NbC-Fe Composite Powder for Enforcement in Low-Carbon Steel.

    Science.gov (United States)

    Li, Hongmei; Song, Qiushi; Xu, Qian; Chen, Ying; Xu, Liang; Man, Tiannan

    2017-11-01

    An NbC-Fe composite powder was synthesized from an Nb₂O₅/Fe/C mixture by electrochemical reduction and subsequent carbonization in molten CaCl₂-NaCl. The composite has a core-shell structure, in which NbC acts as the cores distributing in the Fe matrix. A strong bonding between NbC and Fe is benefit from the core-shell structure. The sintering and electrochemical reduction processes were investigated to probe the mechanism for the reactions. The results show that NbC particles about several nanometers were embraced by the Fe shell to form a composite about 100 nm in size. This featured structure can feasibly improve the wettability and sinterability of NbC as well as the uniform distribution of the carbide in the cast steel. By adding the composite into steel in the casting process, the grain size of the casted steel was markedly deceased from 1 mm to 500 μm on average, favoring the hardening of the casted steel.

  3. Core value and theoretical logic of structure-borne noise.Part 1: summary, value and cognitive subversion

    Directory of Open Access Journals (Sweden)

    WU Chongjian

    2018-02-01

    Full Text Available During the quieting process, a submarine faces the new energy differences of radiated noise. The theory of structure-borne noise must be deeply analyzed and applied as it is one of the most indispensably important theories for Chinese submarines to achieve transcendence. However, if hope is still pinned on improved raft vibration isolation, greater structural rigidity, higher damping or refined construction, the probability of success is almost nil. Researchers must adopt new thinking about structure-borne noise in order to decode the inherent acoustic passwords of structures and reconstruct the complementation characteristics, overlay characteristics and functional design of complex and huge submarine systems, thereby controlling energy input, internal wave conduction and acoustic radiation. As a theoretical tool for solving the "last kilometer" of submarine quietness, this is the core value of structure-borne noise with logically subversive significance.

  4. Analysis of bacterial core communities in the central Baltic by comparative RNA-DNA-based fingerprinting provides links to structure-function relationships.

    Science.gov (United States)

    Brettar, Ingrid; Christen, Richard; Höfle, Manfred G

    2012-01-01

    Understanding structure-function links of microbial communities is a central theme of microbial ecology since its beginning. To this end, we studied the spatial variability of the bacterioplankton community structure and composition across the central Baltic Sea at four stations, which were up to 450 km apart and at a depth profile representative for the central part (Gotland Deep, 235 m). Bacterial community structure was followed by 16S ribosomal RNA (rRNA)- and 16S rRNA gene-based fingerprints using single-strand conformation polymorphism (SSCP) electrophoresis. Species composition was determined by sequence analysis of SSCP bands. High similarities of the bacterioplankton communities across several hundred kilometers were observed in the surface water using RNA- and DNA-based fingerprints. In these surface communities, the RNA- and DNA-based fingerprints resulted in very different pattern, presumably indicating large difference between the active members of the community as represented by RNA-based fingerprints and the present members represented by the DNA-based fingerprints. This large discrepancy changed gradually over depth, resulting in highly similar RNA- and DNA-based fingerprints in the anoxic part of the water column below 130 m depth. A conceivable mechanism explaining this high similarity could be the reduced oxidative stress in the anoxic zone. The stable communities on the surface and in the anoxic zone indicate the strong influence of the hydrography on the bacterioplankton community structure. Comparative analysis of RNA- and DNA-based community structure provided criteria for the identification of the core community, its key members and their links to biogeochemical functions.

  5. Genetic structure of the rattan Calamus thwaitesii in core, buffer and ...

    Indian Academy of Sciences (India)

    Thus, the zones from core to periphery offer decreasing levels of protection against disturbance due to human interferences, cattle graz- ing, etc. As a measure of the extent of disturbance in each of the zones, the percentage of rattan stems harvested or cut ...... ern Ghats: population biology, socio-economics and conserva-.

  6. Structural and magnetic properties of CoO-Pt core-shell nanoparticles

    Czech Academy of Sciences Publication Activity Database

    Zeleňáková, A.; Zeleňák, V.; Michalik, Štefan; Kováč, J.; Meisel, M. W.

    2014-01-01

    Roč. 89, č. 10 (2014), "104417-1"-"104417-10" ISSN 1098-0121 Institutional support: RVO:68378271 Keywords : CoO-Pt core shell nanoparticles * superparamagnetism * superspin glass state * x-ray diffraction * x-ray absorption spectroscopy Subject RIV: BG - Nuclear, Atomic and Molecular Physics, Colliders Impact factor: 3.736, year: 2014

  7. Genetic structure of the rattan Calamus thwaitesii in core, buffer and ...

    Indian Academy of Sciences (India)

    from extraneous pressures and human encroachment (Chap- man et al. 2003; Uma Shaanker et al. 2003). ... The PAs in the country comprise about 4.6% of the total ge- ographical area (NWDC 1999). The Western .... differences in the various parameters across the three zones. (core, buffer and periphery) were analysed ...

  8. A simple approach to the construction of the core structure present in ...

    Indian Academy of Sciences (India)

    Abstract. A convenient route for the synthesis of oxacyclobutapentalene, the tricyclic bridged core struc- ture present in bioactive marine diterpene bielschowskysin and the polyketide hippolachnin A, is reported. The key steps involve ring closing metathesis of a triene derived from D-mannitol to produce selectively the.

  9. GTfold: Enabling parallel RNA secondary structure prediction on multi-core desktops

    DEFF Research Database (Denmark)

    Swenson, M Shel; Anderson, Joshua; Ash, Andrew

    2012-01-01

    achieved significant improvements in runtime, but their implementations were not portable from niche high-performance computers or easily accessible to most RNA researchers. With the increasing prevalence of multi-core desktop machines, a new parallel prediction program is needed to take full advantage...

  10. Stable isotopes

    International Nuclear Information System (INIS)

    Evans, D.K.

    1986-01-01

    Seventy-five percent of the world's stable isotope supply comes from one producer, Oak Ridge Nuclear Laboratory (ORNL) in the US. Canadian concern is that foreign needs will be met only after domestic needs, thus creating a shortage of stable isotopes in Canada. This article describes the present situation in Canada (availability and cost) of stable isotopes, the isotope enrichment techniques, and related research programs at Chalk River Nuclear Laboratories (CRNL)

  11. Solvent-surface interactions control the phase structure in laser-generated iron-gold core-shell nanoparticles.

    Science.gov (United States)

    Wagener, Philipp; Jakobi, Jurij; Rehbock, Christoph; Chakravadhanula, Venkata Sai Kiran; Thede, Claas; Wiedwald, Ulf; Bartsch, Mathias; Kienle, Lorenz; Barcikowski, Stephan

    2016-03-23

    This work highlights a strategy for the one-step synthesis of FeAu nanoparticles by the pulsed laser ablation of alloy targets in the presence of different solvents. This method allows particle generation without the use of additional chemicals; hence, solvent-metal interactions could be studied without cross effects from organic surface ligands. A detailed analysis of generated particles via transmission electron microscopy in combination with EDX elemental mapping could conclusively verify that the nature of the used solvent governs the internal phase structure of the formed nanoparticles. In the presence of acetone or methyl methacrylate, a gold shell covering a non-oxidized iron core was formed, whereas in aqueous media, an Au core with an Fe3O4 shell was generated. This core-shell morphology was the predominant species found in >90% of the examined nanoparticles. These findings indicate that fundamental chemical interactions between the nanoparticle surface and the solvent significantly contribute to phase segregation and elemental distribution in FeAu nanoparticles. A consecutive analysis of resulting Fe@Au core-shell nanoparticles revealed outstanding oxidation resistance and fair magnetic and optical properties. In particular, the combination of these features with high stability magnetism and plasmonics may create new opportunities for this hybrid material in imaging applications.

  12. Solvent-surface interactions control the phase structure in laser-generated iron-gold core-shell nanoparticles

    Science.gov (United States)

    Wagener, Philipp; Jakobi, Jurij; Rehbock, Christoph; Chakravadhanula, Venkata Sai Kiran; Thede, Claas; Wiedwald, Ulf; Bartsch, Mathias; Kienle, Lorenz; Barcikowski, Stephan

    2016-03-01

    This work highlights a strategy for the one-step synthesis of FeAu nanoparticles by the pulsed laser ablation of alloy targets in the presence of different solvents. This method allows particle generation without the use of additional chemicals; hence, solvent-metal interactions could be studied without cross effects from organic surface ligands. A detailed analysis of generated particles via transmission electron microscopy in combination with EDX elemental mapping could conclusively verify that the nature of the used solvent governs the internal phase structure of the formed nanoparticles. In the presence of acetone or methyl methacrylate, a gold shell covering a non-oxidized iron core was formed, whereas in aqueous media, an Au core with an Fe3O4 shell was generated. This core-shell morphology was the predominant species found in >90% of the examined nanoparticles. These findings indicate that fundamental chemical interactions between the nanoparticle surface and the solvent significantly contribute to phase segregation and elemental distribution in FeAu nanoparticles. A consecutive analysis of resulting Fe@Au core-shell nanoparticles revealed outstanding oxidation resistance and fair magnetic and optical properties. In particular, the combination of these features with high stability magnetism and plasmonics may create new opportunities for this hybrid material in imaging applications.

  13. Synthesis of bluetongue virus (BTV) corelike particles by a recombinant baculovirus expressing the two major structural core proteins of BTV.

    Science.gov (United States)

    French, T J; Roy, P

    1990-04-01

    The L3 and M7 genes of bluetongue virus (BTV), which encode the two major core proteins of the virus (VP3 and VP7, respectively), were inserted into a baculovirus dual-expression transfer vector and a recombinant baculovirus expressing both foreign genes isolated following in vivo recombination with wild-type Autographa californica nuclear polyhedrosis virus DNA. Spodoptera frugiperda insect cells infected with the recombinant synthesized large amounts of BTV corelike particles. These particles have been shown to be similar to authentic BTV cores in terms of size, appearance, stoichiometric arrangement of VP3 to VP7 (ratio, 2:15), and the predominance of VP7 on the surface of the particles. In infected insect cells, the corelike particles were observed in paracrystalline arrays. The formation of these structures indicates that neither the BTV double-stranded viral RNA species nor the associated minor core proteins are necessary for assembly of cores in insect cells. Furthermore, the three BTV nonstructural proteins NS1, NS2, and NS3, are not required to assist or direct the formation of empty corelike particles from VP3 and VP7.

  14. Genetic Variation and Population Structure of Oryza glaberrima and Development of a Mini-Core Collection Using DArTseq.

    Science.gov (United States)

    Ndjiondjop, Marie-Noelle; Semagn, Kassa; Gouda, Arnaud C; Kpeki, Sèdjro B; Dro Tia, Daniel; Sow, Mounirou; Goungoulou, Alphonse; Sie, Moussa; Perrier, Xavier; Ghesquiere, Alain; Warburton, Marilyn L

    2017-01-01

    The sequence variation present in accessions conserved in genebanks can best be used in plant improvement when it is properly characterized and published. Using low cost and high density single nucleotide polymorphism (SNP) assays, the genetic diversity, population structure, and relatedness between pairs of accessions can be quickly assessed. This information is relevant for different purposes, including creating core and mini-core sets that represent the maximum possible genetic variation contained in the whole collection. Here, we studied the genetic variation and population structure of 2,179 Oryza glaberrima Steud. accessions conserved at the AfricaRice genebank using 27,560 DArTseq-based SNPs. Only 14% (3,834 of 27,560) of the SNPs were polymorphic across the 2,179 accessions, which is much lower than diversity reported in other Oryza species. Genetic distance between pairs of accessions varied from 0.005 to 0.306, with 1.5% of the pairs nearly identical, 8.0% of the pairs similar, 78.1% of the pairs moderately distant, and 12.4% of the pairs very distant. The number of redundant accessions that contribute little or no new genetic variation to the O. glaberrima collection was very low. Using the maximum length sub-tree method, we propose a subset of 1,330 and 350 accessions to represent a core and mini-core collection, respectively. The core and mini-core sets accounted for ~61 and 16%, respectively, of the whole collection, and captured 97-99% of the SNP polymorphism and nearly all allele and genotype frequencies observed in the whole O. glaberrima collection available at the AfricaRice genebank. Cluster, principal component and model-based population structure analyses all divided the 2,179 accessions into five groups, based roughly on country of origin but less so on ecology. The first, third and fourth groups consisted of accessions primarily from Liberia, Nigeria, and Mali, respectively; the second group consisted primarily of accessions from Togo and

  15. Design and synthesis of novel ROR inverse agonists with a dibenzosilole scaffold as a hydrophobic core structure.

    Science.gov (United States)

    Toyama, Hirozumi; Nakamura, Masaharu; Hashimoto, Yuichi; Fujii, Shinya

    2015-07-01

    Molecular structure calculations indicated that the dibenzosilole skeleton could be well superposed on phenanthridinone, which is a structural component of ligands of retinoic acid receptor-related orphan receptors (RORs). Therefore, we designed, synthesized and biologically evaluated a series of novel ROR ligands based on the dibenzosilole scaffold as a hydrophobic core structure. Dibenzosilole derivatives bearing a hexafluoro-2-hydroxypropyl group on the benzene ring exhibited significant ROR-inhibitory activity, comparable to that of the lead phenanthridinone derivative 5. Our results indicate that the dibenzosilole skeleton would be a useful scaffold for developing novel biologically active compounds, and that cis-amide structure can be replaced by an alkylsilyl functionality. Copyright © 2015 Elsevier Ltd. All rights reserved.

  16. Structure and Filling Characteristics of Paleokarst Reservoirs in the Northern Tarim Basin, Revealed by Outcrop, Core and Borehole Images

    Science.gov (United States)

    Tian, Fei; Lu, Xinbian; Zheng, Songqing; Zhang, Hongfang; Rong, Yuanshuai; Yang, Debin; Liu, Naigui

    2017-06-01

    The Ordovician paleokarst reservoirs in the Tahe oilfield, with burial depths of over 5300 m, experienced multiple phases of geologic processes and exhibit strong heterogeneity. Core testing can be used to analyse the characteristics of typical points at the centimetre scale, and seismic datasets can reveal the macroscopic outlines of reservoirs at the >10-m scale. However, neither method can identify caves, cave fills and fractures at the meter scale. Guided by outcrop investigations and calibrations based on core sample observations, this paper describes the interpretation of high longitudinal resolution borehole images, the identification of the characteristics of caves, cave fills (sedimentary, breccia and chemical fills) and fractures in single wells, and the identification of structures and fill characteristics at the meter scale in the strongly heterogeneous paleokarst reservoirs. The paleogeomorphology, a major controlling factor in the distribution of paleokarst reservoirs, was also analysed. The results show that one well can penetrate multiple cave layers of various sizes and that the caves are filled with multiple types of fill. The paleogeomorphology can be divided into highlands, slopes and depressions, which controlled the structure and fill characteristics of the paleokarst reservoirs. The results of this study can provide fundamental meter-scale datasets for interpreting detailed geologic features of deeply buried paleocaves, can be used to connect core- and seismic-scale interpretations, and can provide support for the recognition and development of these strongly heterogeneous reservoirs.

  17. Structure and Filling Characteristics of Paleokarst Reservoirs in the Northern Tarim Basin, Revealed by Outcrop, Core and Borehole Images

    Directory of Open Access Journals (Sweden)

    Tian Fei

    2017-06-01

    Full Text Available The Ordovician paleokarst reservoirs in the Tahe oilfield, with burial depths of over 5300 m, experienced multiple phases of geologic processes and exhibit strong heterogeneity. Core testing can be used to analyse the characteristics of typical points at the centimetre scale, and seismic datasets can reveal the macroscopic outlines of reservoirs at the >10-m scale. However, neither method can identify caves, cave fills and fractures at the meter scale. Guided by outcrop investigations and calibrations based on core sample observations, this paper describes the interpretation of high longitudinal resolution borehole images, the identification of the characteristics of caves, cave fills (sedimentary, breccia and chemical fills and fractures in single wells, and the identification of structures and fill characteristics at the meter scale in the strongly heterogeneous paleokarst reservoirs. The paleogeomorphology, a major controlling factor in the distribution of paleokarst reservoirs, was also analysed. The results show that one well can penetrate multiple cave layers of various sizes and that the caves are filled with multiple types of fill. The paleogeomorphology can be divided into highlands, slopes and depressions, which controlled the structure and fill characteristics of the paleokarst reservoirs. The results of this study can provide fundamental meter-scale datasets for interpreting detailed geologic features of deeply buried paleocaves, can be used to connect core- and seismic-scale interpretations, and can provide support for the recognition and development of these strongly heterogeneous reservoirs.

  18. Synthesis, characterization and nitrite ion sensing performance of reclaimable composite samples through a core-shell structure

    Science.gov (United States)

    Cui, Xiao; Yuqing, Zhao; Cui, Jiantao; Zheng, Qian; Bo, Wang

    2018-02-01

    The following paper reported and discussed a nitrite ion optical sensing platform based on a core-shell structure, using superamagnetic nanoparticles as the core, a silica molecular sieve MCM-41 as the shell and two rhodamine derivatives as probe, respectively. This superamagnetic core made this sensing platform reclaimable after finishing nitrite ion sensing procedure. This sensing platform was carefully characterized by means of electron microscopy images, porous structure analysis, magnetic response, IR spectra and thermal stability analysis. Detailed analysis suggested that the emission of these composite samples was quenchable by nitrite ion, showing emission turn off effect. A static sensing mechanism based on an additive reaction between chemosensors and nitrite ion was proposed. These composite samples followed Demas quenching equation against different nitrite ion concentrations. Limit of detection value was obtained as low as 0.4 μM. It was found that, after being quenched by nitrite ion, these composite samples could be reclaimed and recovered by sulphamic acid, confirming their recyclability.

  19. Synthesis, characterization and nitrite ion sensing performance of reclaimable composite samples through a core-shell structure.

    Science.gov (United States)

    Cui, Xiao; Yuqing, Zhao; Cui, Jiantao; Zheng, Qian; Bo, Wang

    2018-02-15

    The following paper reported and discussed a nitrite ion optical sensing platform based on a core-shell structure, using superamagnetic nanoparticles as the core, a silica molecular sieve MCM-41 as the shell and two rhodamine derivatives as probe, respectively. This superamagnetic core made this sensing platform reclaimable after finishing nitrite ion sensing procedure. This sensing platform was carefully characterized by means of electron microscopy images, porous structure analysis, magnetic response, IR spectra and thermal stability analysis. Detailed analysis suggested that the emission of these composite samples was quenchable by nitrite ion, showing emission turn off effect. A static sensing mechanism based on an additive reaction between chemosensors and nitrite ion was proposed. These composite samples followed Demas quenching equation against different nitrite ion concentrations. Limit of detection value was obtained as low as 0.4μM. It was found that, after being quenched by nitrite ion, these composite samples could be reclaimed and recovered by sulphamic acid, confirming their recyclability. Copyright © 2017 Elsevier B.V. All rights reserved.

  20. Nonlinear seismic analysis of a reactor structure with impact between core components

    International Nuclear Information System (INIS)

    Hill, R.G.

    1975-01-01

    The seismic analysis of the FFTF-PIOTA (Fast Flux Test Facility-Postirradiation Open Test Assembly), subjected to a horizontal DBE (Design Base Earthquake) is presented. The PIOTA is the first in a set of open test assemblies to be designed for the FFTF. Employing the direct method of transient analysis, the governing differential equations describing the motion of the system are set up directly and are implicitly integrated numerically in time. A simple lumped-mass beam model of the FFTF which includes small clearances between core components is used as a ''driver'' for a fine mesh model of the PIOTA. The nonlinear forces due to the impact of the core components and their effect on the PIOTA are computed. 6 references

  1. Au@Pd core-shell nanobricks with concave structures and their catalysis of ethanol oxidation.

    Science.gov (United States)

    Wang, Wenjin; Zhang, Jie; Yang, Shengchun; Ding, Bingjun; Song, Xiaoping

    2013-10-01

    Au@Pd core-shell nanobricks (CNBs) with concave surfaces and Pd shells with a thickness of approximately 5 nm were synthesized by co-reduction of HAuCl4 and H2 PdCl4 in the presence of Au seeds and Ag ions. These as-synthesized concave CNBs exhibit significantly enhanced catalytic activity for the electrooxidation of ethanol in alkaline media compared to the commercially-used Pd black. The improved performance of the Au@Pd CNBs can be attributed to the exposed stepped surfaces, high-index facets, and the synergistic effects of the core and shell metals. Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  2. Core-shell structured high-k polymer nanocomposites for energy storage and dielectric applications.

    Science.gov (United States)

    Huang, Xingyi; Jiang, Pingkai

    2015-01-21

    High-k polymer nanocomposites have considerable potential in energy storage and dielectric applications because of their ease of processing, flexibility, and low cost. Core-shell nanoarchitecture strategies are versatile and powerful tools for the design and synthesis of advanced high-k polymer nanocomposites. Recent and in-progress state-of-the-art advancements in the application of core-shell nanoarchitecture strategies to design and prepare high-k polymer nanocomposites are summarized. Special focus is directed to emphasizing their advantages over conventional melt-mixing and solution-mixing methods: first, homogeneous nanoparticle dispersion can be easily achieved even in highly loaded nanocomposites; second, the dielectric constant of the nanocomposites can be effectively enhanced and meanwhile the high breakdown strength can be well-preserved; third, for nanocomposites filled with electrically conductive nanoparticles, dielectric loss can be effectively surpressed, and meanwhile a high dielectric constant can be achieved. In addition, fundamental insights into the roles of the interfaces on the dielectric properties of the nanocomposites can be probed. The last part of the article is concluded with current problems and future perspectives of utilizing the core-shell nanoarchitecture strategies for the development of high-k polymer nanocomposites. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  3. Monte Carlo simulation of magnetic properties of a ferrimagnetic nanoisland with hexagonal prismatic core-shell structure

    Science.gov (United States)

    Wang, Wei; Peng, Zhou; Lin, Shan-shan; Li, Qi; Lv, Dan; Yang, Sen

    2018-01-01

    Using Monte Carlo simulation, the magnetic and thermodynamic properties of a ferrimagnetic nanoisland with hexagonal prismatic core-shell structure, consisting of the bilayer with a core of spin-5/2 atoms surrounded by shell of spin-2 atoms in the external magnetic field have been studied. We have investigated the effects of the single-ion anisotropies, the exchange coupling and the magnetic field on the magnetization, susceptibility, internal energy and blocking temperature of the nanoisland. A great number of interesting behaviors, such as various types of magnetization curves, have been obtained depending on different values of the physical parameters. The magnetic hysteresis loop behaviors are the main focus of the research. The system exhibits multiple hysteresis loop behaviors, such as double, triple and quadruple hysteresis loops for certain parameters.

  4. Facile synthesis of core-shell Cu2O@ ZnO structure with enhanced photocatalytic H2 production

    Science.gov (United States)

    Zhang, Yong-Hui; Jiu, Bei-Bei; Gong, Fei-Long; Lu, Kuan; Jiang, Nan; Zhang, Hao-Li; Chen, Jun-Li

    2018-05-01

    Core-shell Cu2O@ZnO composites were synthesized successfully based on a one-pot hydrothermal method in the presence of dioctyl sulfosuccinate sodium salt (AOT) surfactant. The Cu2O can be converted to rough core-shell Cu2O@ZnO structure by adjusting the amount of zinc powder added. The as-synthesized Cu2O@ZnO composites exhibited excellent photocatalytic activity and the amount of H2 generated using these composites was 4.5-fold more than that produced with Cu2O cubes. A possible photocatalytic mechanism for the Cu2O@ZnO composites with enhanced photocatalytic activity could be the separation by ZnO of the effective charge carriers.

  5. Research on dual-parameter optical fiber sensor based on thin-core fiber and spherical structure

    Science.gov (United States)

    Tong, Zhengrong; Wang, Xue; Zhang, Weihua; Xue, Lifang

    2018-04-01

    A novel dual-parameter optical fiber sensor is proposed and experimentally demonstrated. The proposed sensor is based on a fiber in-line Mach-Zehnder interferometer, which is fabricated by sandwiching a section of thin-core fiber between two spherical structures made of single-mode fibers. The transmission spectrum exhibits the response of the interference between the core and the different cladding modes. Due to the different wavelength shifts of the two selected dips, the simultaneous measurement of temperature and the surrounding refractive index can be achieved. The measured temperature sensitivities are 0.067 nm/°C and 0.050 nm/°C, and the refractive index sensitivities are  -119.9 nm/RIU and  -69.71 nm/RIU, respectively. In addition, the compact size, simple fabrication and cost-effectiveness of the fiber sensor are also advantages.

  6. WC-Co Composite Coating Deposited by Cold Spraying of a Core-Shell-Structured WC-Co Powder

    Science.gov (United States)

    Luo, Xiao-Tao; Li, Cheng-Xin; Shang, Fu-Lin; Yang, Guan-Jun; Wang, Yu-Yue; Li, Chang-Jiu

    2015-01-01

    In this study, a core-shell-structured WC-Co powder was used to develop a heterogeneously structured WC-Co coating with tens micrometers of WC-10Co as strengthening phase and Co-rich WC-Co as the binder in order to realize simultaneous strengthening and toughening. Spray powder particles contain WC-10Co core coated with a Co-rich WC-Co shell by mechanical milling. WC-Co coating with dual-scale strengthening phases was deposited by cold spraying. Post-spray annealing was carried out to further modify the coating microstructure. Microstructures of the spray powder and the coating were characterized by SEM. Mechanical properties of the coating in terms of microhardness and fracture toughness were examined. Results show that a biomodal WC-Co coating with a porosity of only 0.7% was deposited by cold spray. The Co-rich matrix phase contains submicrometer-sized carbide and primary hard phase is WC-10Co particles. The measurement yielded a Vickers microhardness of 1493 ± 76.7 HV0.1 for WC-10Co core and 693 ± 47.3 HV0.1 for Co-rich binder phase. After annealed at 900 °C for 5 h, a remarkable increase in fracture toughness from 21.2 ± 3.8 to 35.7±5.2 MPa m-0.5 was achieved while no evident change occurred to the hardness of WC-10Co cores.

  7. Structural, magnetic characterization (dependencies of coercivity and loss with the frequency) of magnetic cores based in Finemet

    Science.gov (United States)

    Osinalde, M.; Infante, P.; Domínguez, L.; Blanco, J. M.; del Val, J. J.; Chizhik, A.; González, J.

    2017-12-01

    We report changes of coercivity, induced magnetic anisotropy, magneto-optical domain structure and frequency dependencies of coercivity and energy loss (up to 10 MHz) associated with the structural modifications produced by thermal treatments under applied magnetic field (field annealing) in toroidal wound cores of Fe73.5Cu1Nb3Si15.5B7 amorphous alloy. The thermal treatment (535 °C, 1 h) leads to the typical nanocrystalline structure of α-Fe(Si) nanograins (60-65% relative volume, 10-20 nm average grain size embedded in a residual amorphous matrix, while the magnetic field with the possibility to be applied in two directions to the toroidal core axis, that is in transverse (which is equivalent to the transverse direction of the ribbon) or longitudinal (equivalent to the longitudinal direction of the ribbon), develops a macroscopic uniaxial magnetic anisotropy in the transverse (around 245 J/m3) or longitudinal (around 85 J/m3) direction of the ribbon, respectively. It is remarkable the quasi-unhysteretic character of the cores with these two kinds of field annealing as comparing with that of the as-quenched one. Magneto-optical study by Kerr-effect of the ribbons provides useful information on the domain structure of the surface in agreement with the direction and intensity of the induced magnetic anisotropy. This induced uniaxial magnetic anisotropy plays a very important role on the Hc(f) and EL(f) curves, (f: frequency), being drastic the presence and direction of the induced magnetic anisotropy. In addition, these frequency dependencies show a significant change at the frequency around 100 Hz.

  8. Synthesis and performance of core-shell structured ZnO/In{sub 2}O{sub 3} composites in situ growth

    Energy Technology Data Exchange (ETDEWEB)

    Zhao Yunlong [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Lu Hongxia, E-mail: luhx@zzu.edu.cn [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Yu Xiujun; Fan Bingbing; Chen Deliang [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Zhang Liwei [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Xinxiang University, Xinxiang 453003 (China); Wang Hailong; Yang Daoyuan; Xu Hongliang [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Zhang Rui [School of Materials Science and Engineering, Zhengzhou University, Zhengzhou 450002 (China); Zhengzhou Institute of Aeronautical Industry Management, Zhengzhou 450015 (China)

    2011-10-01

    Core-shell structured ZnO/In{sub 2}O{sub 3} composites were successfully synthesized via situ growth method. Phase structure, morphology, microstructure and property of the products were investigated by X-ray diffraction (XRD), TG-DTA, field emission scanning electron microscopy (FESEM), energy-dispersive spectrometry (EDS), transmission electron microscope (TEM) and photoluminescence (PL). Results show that the core-shell structures consist of spindle-like ZnO with about 800 nm in length and 200 nm in diameter, and In{sub 2}O{sub 3} particles with a diameter of 50 nm coated on the surface of ZnO uniformly. HMTA plays an important role in the formation of core-shell structures and the addition of In{sub 2}O{sub 3} has a great effect on PL spectrum. Possible mechanism for the formation of core-shell structures is also proposed in this paper.

  9. Bicyclo[3.2.0]heptane as a Core Structure for Conformational Locking of 1,3-Bis-Pharmacophores, Exemplified by GABA

    DEFF Research Database (Denmark)

    Vorberg, Raffael; Trapp, Nils; Carreira, Erick M

    2017-01-01

    , with N-Boc-protected γ-aminobutyric acid (GABA) embedded within the bicyclic core. Despite the different conformations of the urethane and distinct crystal packing, the bicyclic core units of the two stereoisomers adopt virtually identical structures. They correspond to in silico models of the parent...

  10. Geochemical and stable isotopic data on barren and mineralized drill core in the Devonian Popovich Formation, Screamer sector of the Betze-Post gold deposit, northern Carlin trend, Nevada

    Science.gov (United States)

    Christiansen, William D.; Hofstra, Albert H.; Zohar, Pamela B.; Tousignant, Gilles

    2011-01-01

    The Devonian Popovich Formation is the major host for Carlin-type gold deposits in the northern Carlin trend of Nevada. The Popovich is composed of gray to black, thin-bedded, calcareous to dolomitic mudstone and limestone deposited near the carbonate platform margin. Carlin-type gold deposits are Eocene, disseminated, auriferous pyrite deposits characterized by acid leaching, sulfidation, and silicification that are typically hosted in Paleozoic calcareous sedimentary rocks exposed in windows through siliceous sedimentary rocks of the Roberts Mountains allochthon. The Carlin trend currently is the largest gold producer in the United States. The Screamer ore zone is a tabular body on the periphery of the huge Betze-Post gold deposit. Screamer is a good place to study both the original lithogeochemistry of the Popovich Formation and the effects of subsequent alteration and mineralization because it is below the level of supergene oxidation, mostly outside the contact metamorphic aureole of the Jurassic Goldstrike stock, has small, high-grade ore zones along fractures and Jurassic dikes, and has intervening areas with lower grade mineralization and barren rock. In 1997, prior to mining at Screamer, drill core intervals from barren and mineralized Popovich Formation were selected for geochemical and stable isotope analysis. The 332, five-foot core samples analyzed are from five holes separated by as much as 2000 feet (600 meters). The samples extend from the base of the Wispy unit up through the Planar and Soft sediment deformation units into the lower part of the upper Mud unit of the Popovich Formation.

  11. Stable and High OSNR Compound Linear-Cavity Single-Longitudinal-Mode Erbium-Doped Silica Fiber Laser Based on an Asymmetric Four-Cavity Structure

    International Nuclear Information System (INIS)

    Feng Ting; Yan Feng-Ping; Li Qi; Peng Wan-Jing; Feng Su-Chun; Wen Xiao-Dong; Tan Si-Yu; Liu Peng

    2012-01-01

    We propose a stable and high optical signal-to-noise ratio (OSNR) compound linear-cavity single-longitudinal-mode (SLM) erbium-doped silica fiber laser. It consists of three uniform fiber Bragg gratings (FBGs) and two fiber couplers to form a simple asymmetric four-cavity structure to select the longitudinal mode. The stable SLM operation at the wavelength of 1544.053 nm with a 3 dB bandwidth of 0.014 nm and an OSNR of ∼60 dB was verified experimentally. Under laboratory conditions, a power fluctuation performance of less than 0.05 dB for 5 h and wavelength variation of less than 0.01 nm for about 150 min is demonstrated. Finally, the characteristic of laser output power as a function of pump power is investigated. The proposed system provides a simple and cost-effective approach to realize a stable SLM fiber laser

  12. Structural evaluation of fast reactor core restraint with irradiation creep-swelling opposition effects

    International Nuclear Information System (INIS)

    Kalinowski, J.E.

    1979-01-01

    Irradiation creep and swelling correlations are derived from primary loading in-reactor experiments in which irradiation creep and swelling act in the same direction. When correlation uncertainty bands are applied in core restraint evaluations, significant variability in sub-assembly behavior is predicted. For example, sub-assemblies in the outer core region where neutron flux and duct temperature gradients are significant exhibit bowing responses ranging from a creep dominated outward bow to a swelling dominated inward bow. Furthermore, solutions based on upper bound and lower bound correlation uncertainty combinations are observed to cross-over indicating that such combinations are physically unrealistic in the assessment of creep-swelling opposition effects. In order to obtain realistic upper and lower bound sub-assembly responses, judgement must be applied in the selection of creep-swelling equation uncertainty combinations. Experimental programs have been defined which will provide the needed basic as well as prototypic creep-swelling opposition data for reference and advanced sub-assembly duct alloys. The first of these is an irradiation of cylindrical capsules subjected to a through-wall temperature gradient. This test which is presently underway in the EBR-II reactor will provide the data needed to refine irradiation creep and swelling correlations and their associated uncertainties when applied to core restraint evaluations. Restrained pin and duct bowing experiments in FFTF have also been defined. These will provide the prototypic data necessary to verify irradiated duct bowing methodology. The results of this experimental program are expected to reduce creep and swelling uncertainties and permit better definition of the design window for load plane gaps. (orig.)

  13. Core/Shell Structured TiO2/CdS Electrode to Enhance the Light Stability of Perovskite Solar Cells.

    Science.gov (United States)

    Hwang, Insung; Baek, Minki; Yong, Kijung

    2015-12-23

    In this work, enhanced light stability of perovskite solar cell (PSC) achieved by the introduction of a core/shell-structured CdS/TiO2 electrode and the related mechanism are reported. By a simple solution-based process (SILAR), a uniform CdS shell was coated onto the surface of a TiO2 layer, suppressing the activation of intrinsic trap sites originating from the oxygen vacancies of the TiO2 layer. As a result, the proposed CdS-PSC exhibited highly improved light stability, maintaining nearly 80% of the initial efficiency after 12 h of full sunlight illumination. From the X-ray diffraction analyses, it is suggested that the degradation of the efficiency of PSC during illumination occurs regardless of the decomposition of the perovskite absorber. Considering the light-soaking profiles of the encapsulated cells and the OCVD characteristics, it is likely that the CdS shell had efficiently suppressed the undesirable electron kinetics, such as trapping at the surface defects of the TiO2 and preventing the resultant charge losses by recombination. This study suggests that further complementary research on various effective methods for passivation of the TiO2 layer would be highly meaningful, leading to insight into the fabrication of PSCs stable to UV-light for a long time.

  14. Case Study of an Unsustainable Community-Academic Partnership: Toward Core Standards for the Structure of Emerging Participatory Research.

    Science.gov (United States)

    Calderón, José L; Norris, Keith C; Hardigan, Patrick C; Calderón, Lorrin A; Hays, Ron D

    2015-08-07

    This report retrospectively examines the structure of an emerging community-academic participatory research (PR) partnership that was not sustainable, despite attempts to adhere to PR principles and demonstrable success in research outcomes. The influence of community and academic parent organizations on the PR process and outcomes is presented in the context of the Donabedian Model. We dissected the structural elements contributed by parent organizations to forming the structure of the PR partnership (memorandum of understanding, policy environment, human resources and effort, community and academic resources, expertise and experience, and funding) and explored the influence of potential and actual conflicts on the PR partnership's sustainability. The effect of potential and actual conflict on the PR process and quality of PR outcomes is discussed. Based on this, we conclude by proposing seven core standards for the establishment and development of emerging community-academic PR partnerships.

  15. Glass transition of poly (methyl methacrylate) filled with nanosilica and core-shell structured silica

    DEFF Research Database (Denmark)

    Song, Yihu; Bu, Jing; Zuo, Min

    2017-01-01

    Core-shell (CS) nanocomposite particles with 53.4 wt% cross-linked poly (methyl methacrylate) (PMMA) shell of 11.6 nm in thickness were fabricated via miniemulsion polymerization of methyl methacrylate in the presence of modified nanosilica. The influence of nanosilica and CS nanoparticles on glass...... transition and segmental dynamics of PMMA in the nanocomposites prepared via solution casting was compared. The remarkable depression (≥10 °C) of glass transition temperature (Tg) induced by the incorporation of SiO2 and CS was both observed at low loadings. Here, different mechanisms were responsible...

  16. Self-Assembly of Crystalline Structures of Magnetic Core-Shell Nanoparticles for Fabrication of Nanostructured Materials.

    Science.gov (United States)

    Xue, Xiaozheng; Wang, Jianchao; Furlani, Edward P

    2015-10-14

    A theoretical study is presented of the template-assisted formation of crystalline superstructures of magnetic-dielectric core-shell particles. The templates produce highly localized gradient fields and a corresponding magnetic force that guides the assembly with nanoscale precision in particle placement. The process is studied using two distinct and complementary computational models that predict the dynamics and energy of the particles, respectively. Both mono- and polydisperse colloids are studied, and the analysis demonstrates for the first time that although the particles self-assemble into ordered crystalline superstructures, the particle formation is not unique. There is a Brownian motion-induced degeneracy in the process wherein various distinct, energetically comparable crystalline structures can form for a given template geometry. The models predict the formation of hexagonal close packed (HCP) and face centered cubic (FCC) structures as well as mixed phase structures due to in-plane stacking disorders, which is consistent with experimental observations. The polydisperse particle structures are less uniform than the monodisperse particle structures because of the irregular packing of different-sized particles. A comparison of self-assembly using soft- and hard-magnetic templates is also presented, the former being magnetized in a uniform field. This analysis shows that soft-magnetic templates enable an order-of-magnitude more rapid assembly and much higher spatial resolution in particle placement than their hard-magnetic counterparts. The self-assembly method discussed is versatile and broadly applies to arbitrary template geometries and multilayered and multifunctional mono- and polydisperse core-shell particles that have at least one magnetic component. As such, the method holds potential for the bottom-up fabrication of functional nanostructured materials for a broad range of applications. This work provides unprecedented insight into the assembly

  17. Nuclear reactor core flow baffling

    International Nuclear Information System (INIS)

    Berringer, R.T.

    1979-01-01

    A flow baffling arrangement is disclosed for the core of a nuclear reactor. A plurality of core formers are aligned with the grids of the core fuel assemblies such that the high pressure drop areas in the core are at the same elevations as the high pressure drop areas about the core periphery. The arrangement minimizes core bypass flow, maintains cooling of the structure surrounding the core, and allows the utilization of alternative beneficial components such as neutron reflectors positioned near the core

  18. Structural and Optical Properties of Core-Shell TiO2/CdS Prepared by Chemical Bath Deposition

    Science.gov (United States)

    Al-Jawad, Selma M. H.

    2017-10-01

    Titanium dioxide (TiO2) nanorod arrays (NRAs) sensitized with cadmium sulfide (CdS) nanoparticles (NPs) were deposited by chemical bath deposition (CBD). TiO2 NRAs were also obtained by using the same method on glass substrates coated with fluorine-doped tin oxide (FTO). The structure of the FTO/TiO2/CdS core-shell was characterized by x-ray diffraction (XRD), atomic force microscopy, scanning electron microscopy, ultraviolet-visible (UV-Vis) absorption spectroscopy, photoluminescence, and photoelectrocatalysis of FTO/TiO2 and FTO/TiO2/CdS. The FTO/TiO2 conformed to anatase and rutile phase structures for different pH values and also with annealing. XRD patterns of the FTO/TiO2/CdS sample exhibited two peaks corresponding to hexagonal (100) and (101) for CdS. Scanning electron micrographs showed nanorod structures for the TiO2 thin films deposited at a pH value equal 0.7. Optical results showed the CdS deposited on nanorod TiO2 exhibited increased absorption ability in the visible light, indicating an increased photocatalytic activity for TiO2/CdS core-shell nanorods in the visible light. When illuminated with a UV-Vis light source, the TiO2/CdS core-shell films displayed high responses. A composite exists between the TiO2 nanostructure and CdS NPs because the film absorbs the incident light located in both the visible and UV-Vis regions. A higher response to UV-Vis light was attained with the use of TiO2 NRAs/CdS NPs films prepared by CBD. This approach offers a technique for fabricating photoelectrodes.

  19. Nickel oxide/polypyrrole/silver nanocomposites with core/shell/shell structure: Synthesis, characterization and their electrochemical behaviour with antimicrobial activities

    Energy Technology Data Exchange (ETDEWEB)

    Das, Dhaneswar; Nath, Bikash C. [Department of Chemical Sciences, Tezpur University, Tezpur 784028, Assam (India); Phukon, Pinkee [Department of Molecular Biology and Biotechnology, Tezpur University, Tezpur 784028, Assam (India); Saikia, Bhaskar J.; Kamrupi, Isha R. [Department of Chemical Sciences, Tezpur University, Tezpur 784028, Assam (India); Dolui, Swapan K., E-mail: dolui@tezu.ernet.in [Department of Chemical Sciences, Tezpur University, Tezpur 784028, Assam (India)

    2013-10-01

    Magnetic and conducting Nickel oxide–polypyrrole (NiO/PPy) nanoparticles with core–shell structure were prepared in the presence of Nickel oxide (NiO) in aqueous solution containing sodium dodecyl benzenesulfonate (SDBS) as a surfactant as well as dopant. A stable dispersion of silver (Ag) nanoparticles was synthesized by chemical (citrate reduction) method. NiO/PPy nanocomposites were added to the Ag colloid under stirring. Ag nanoparticles could be electrostatically attracted on the surface of NiO/PPy nanocomposites, leading to formation of NiO/PPy/Ag nanocomposites with core/shell/shell structure. The morphology, structure, particle size and composition of the products were characterized by transmission electron microscopy (TEM), scanning electron microscopy (SEM), X-ray diffraction (XRD), Fourier transform infrared (FT-IR) spectroscopy, cyclic voltammetry (CV) and current–voltage (I–V) analysis. The resultant nanocomposites have the good conductivity and excellent electrochemical and catalytic properties of PPy and Ag nanoparticles. Furthermore, the nanocomposites showed excellent antibacterial behaviour due to the presence of Ag nanoparticles in the composite. The thermal stability of NiO–PPy as well as NiO/PPy/Ag nanocomposites was higher than that of pristine PPy. Studies of IR spectra suggest that the increased thermal stability may be due to interactions between NiO and Ag nanoparticles with the PPy backbone. - Highlights: • NiO nanoparticles were synthesized by two step soft chemical synthesis route. • Ag nanoparticles were prepared by using citrate reduction method. • NiO/PPy nanocomposites are synthesized by chemical oxidative polymerization process. • NiO/PPy/Ag nanocomposites can be used in the water purification technology.

  20. Nickel oxide/polypyrrole/silver nanocomposites with core/shell/shell structure: Synthesis, characterization and their electrochemical behaviour with antimicrobial activities

    International Nuclear Information System (INIS)

    Das, Dhaneswar; Nath, Bikash C.; Phukon, Pinkee; Saikia, Bhaskar J.; Kamrupi, Isha R.; Dolui, Swapan K.

    2013-01-01

    Magnetic and conducting Nickel oxide–polypyrrole (NiO/PPy) nanoparticles with core–shell structure were prepared in the presence of Nickel oxide (NiO) in aqueous solution containing sodium dodecyl benzenesulfonate (SDBS) as a surfactant as well as dopant. A stable dispersion of silver (Ag) nanoparticles was synthesized by chemical (citrate reduction) method. NiO/PPy nanocomposites were added to the Ag colloid under stirring. Ag nanoparticles could be electrostatically attracted on the surface of NiO/PPy nanocomposites, leading to formation of NiO/PPy/Ag nanocomposites with core/shell/shell structure. The morphology, structure, particle size and composition of the products were characterized by transmission electron microscopy (TEM), scanning electron microscopy (SEM), X-ray diffraction (XRD), Fourier transform infrared (FT-IR) spectroscopy, cyclic voltammetry (CV) and current–voltage (I–V) analysis. The resultant nanocomposites have the good conductivity and excellent electrochemical and catalytic properties of PPy and Ag nanoparticles. Furthermore, the nanocomposites showed excellent antibacterial behaviour due to the presence of Ag nanoparticles in the composite. The thermal stability of NiO–PPy as well as NiO/PPy/Ag nanocomposites was higher than that of pristine PPy. Studies of IR spectra suggest that the increased thermal stability may be due to interactions between NiO and Ag nanoparticles with the PPy backbone. - Highlights: • NiO nanoparticles were synthesized by two step soft chemical synthesis route. • Ag nanoparticles were prepared by using citrate reduction method. • NiO/PPy nanocomposites are synthesized by chemical oxidative polymerization process. • NiO/PPy/Ag nanocomposites can be used in the water purification technology

  1. Preparation, optical properties, magnetic properties and thermal stability of core-shell structure cobalt/zinc oxide nanocomposites

    International Nuclear Information System (INIS)

    Bala, Hari; Fu Wuyou; Yu Yanhui; Yang Haibin; Zhang Yishun

    2009-01-01

    Cobalt nanoparticles coated with zinc oxide can form composite spheres with core-shell structure. This coating process was based on the use of silane coupling with agent 3-mercaptopropyltrimethoxysilane (HS-(CH 2 ) 3 Si(OCH 3 ) 3 , MPTS) as a primer to render the cobalt surface vitreophilic, thus it renders cobalt surface compatible with ZnO. X-ray photoelectron spectroscopy (XPS) was used to gain insight into the way in which the MPTS is bound to the surface of the cobalt nanoparticles. The morphological structure, chemical composition, optical properties and magnetic properties of the product were investigated by using transmission electron microscopy (TEM), X-ray diffraction (XRD), energy dispersive X-ray spectroscopy (EDS), photoluminescence (PL) spectroscope and vibrating sample magnetometer (VSM). It was found that the Co/ZnO core-shell structure nanocomposites exhibited both of favorable magnetism and photoluminescence properties. Results of the thermogravimetric analysis (TGA) and differential thermal analysis (DTA) indicated that the thermal stability of cobalt/zinc oxide was better than that of pure cobalt nanoparticles.

  2. Effects of core models and neutron energy group structures on xenon oscillation in large graphite-moderated reactors

    International Nuclear Information System (INIS)

    Yamasita, Kiyonobu; Harada, Hiroo; Murata, Isao; Shindo, Ryuichi; Tsuruoka, Takuya.

    1993-01-01

    Xenon oscillations of large graphite-moderated reactors have been analyzed by a multi-group diffusion code with two- and three-dimensional core models to study the effects of the geometric core models and the neutron energy group structures on the evaluation of the Xe oscillation behavior. The study clarified the following. It is important for accurate Xe oscillation simulations to use the neutron energy group structure that describes well the large change in the absorption cross section of Xe in the thermal energy range of 0.1∼0.65 eV, because the energy structure in this energy range has significant influences on the amplitude and the period of oscillations in power distributions. Two-dimensional R-Z models can be used instead of three-dimensional R-θ-Z models for evaluation of the threshold power of Xe oscillation, but two-dimensional R-θ models cannot be used for evaluation of the threshold power. Although the threshold power evaluated with the R-θ-Z models coincides with that of the R-Z models, it does not coincide with that of the R-θ models. (author)

  3. Preparation, optical properties, magnetic properties and thermal stability of core-shell structure cobalt/zinc oxide nanocomposites

    Science.gov (United States)

    Bala, Hari; Fu, Wuyou; Yu, Yanhui; Yang, Haibin; Zhang, Yishun

    2009-01-01

    Cobalt nanoparticles coated with zinc oxide can form composite spheres with core-shell structure. This coating process was based on the use of silane coupling with agent 3-mercaptopropyltrimethoxysilane (HS-(CH 2) 3Si(OCH 3) 3, MPTS) as a primer to render the cobalt surface vitreophilic, thus it renders cobalt surface compatible with ZnO. X-ray photoelectron spectroscopy (XPS) was used to gain insight into the way in which the MPTS is bound to the surface of the cobalt nanoparticles. The morphological structure, chemical composition, optical properties and magnetic properties of the product were investigated by using transmission electron microscopy (TEM), X-ray diffraction (XRD), energy dispersive X-ray spectroscopy (EDS), photoluminescence (PL) spectroscope and vibrating sample magnetometer (VSM). It was found that the Co/ZnO core-shell structure nanocomposites exhibited both of favorable magnetism and photoluminescence properties. Results of the thermogravimetric analysis (TGA) and differential thermal analysis (DTA) indicated that the thermal stability of cobalt/zinc oxide was better than that of pure cobalt nanoparticles.

  4. Preparation, optical properties, magnetic properties and thermal stability of core-shell structure cobalt/zinc oxide nanocomposites

    Energy Technology Data Exchange (ETDEWEB)

    Bala, Hari [Institute of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo 454000 (China); State Key Laboratory of Polymer Physics and Chemistry, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China)], E-mail: hari@hpu.edu.cn; Fu Wuyou [National Laboratory for Superhard Materials, JiIin University, Changchun 130023 (China); Yu Yanhui [Institute of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo 454000 (China); Yang Haibin [Institute of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo 454000 (China); National Laboratory for Superhard Materials, JiIin University, Changchun 130023 (China); Zhang Yishun [Institute of Materials Science and Engineering, Henan Polytechnic University, Jiaozuo 454000 (China)

    2009-01-15

    Cobalt nanoparticles coated with zinc oxide can form composite spheres with core-shell structure. This coating process was based on the use of silane coupling with agent 3-mercaptopropyltrimethoxysilane (HS-(CH{sub 2}){sub 3}Si(OCH{sub 3}){sub 3}, MPTS) as a primer to render the cobalt surface vitreophilic, thus it renders cobalt surface compatible with ZnO. X-ray photoelectron spectroscopy (XPS) was used to gain insight into the way in which the MPTS is bound to the surface of the cobalt nanoparticles. The morphological structure, chemical composition, optical properties and magnetic properties of the product were investigated by using transmission electron microscopy (TEM), X-ray diffraction (XRD), energy dispersive X-ray spectroscopy (EDS), photoluminescence (PL) spectroscope and vibrating sample magnetometer (VSM). It was found that the Co/ZnO core-shell structure nanocomposites exhibited both of favorable magnetism and photoluminescence properties. Results of the thermogravimetric analysis (TGA) and differential thermal analysis (DTA) indicated that the thermal stability of cobalt/zinc oxide was better than that of pure cobalt nanoparticles.

  5. Preparation and characterization of core-shell structured TiO 2-BaCO 3 particles

    Science.gov (United States)

    Gablenz, Silvio; Damm, Cornelia; Müller, Franz Werner; Israel, Gunter; Rössel, Michael; Röder, Andreas; Abicht, Hans-Peter

    2001-03-01

    Preparation of core-shell structured TiO 2-BaCO 3 particles as precursor of BaTiO 3 genesis, proceeds using a two step procedure, by first coating the TiO 2 core by Ba(OH) 2 shell followed by conversion of the shell region with CO 2 gas by the formation of BaCO 3. Straightforward experimental results reveal environmental scanning electron microscopy (ESEM) and scanning transmission electron microscopy (STEM) as suitable methods for analytical characterization of the core and shell regions from individual TiO 2-BaCO 3 grains. Evidence of coating the whole ensemble of TiO 2 particles is possible using Photo Electro Motive Force (Photo EMF, PEMF) measurements. This method is able to indicate very sensitively changes of surface properties of TiO 2 after coating with Ba(OH) 2 and BaCO 3, respectively. PEMF measurements were used for the first time with concern to this topic.

  6. Outline of the reactor core and internal structure design of the experimental VHTR

    International Nuclear Information System (INIS)

    Ide, Akira; Saitoh, Yoshihiro; Miki, Toshiya; Takigawa, Noboru; Nakata, Tetsuo.

    1986-01-01

    This paper outlines the reactor design of the experimental VHTR in ''The Design of Main Equipment of the Second Stage Detailed Design''. The design, being carried out between April 1985 and February 1986 under a contract with JAERI, were the summarizing one of the experimental reactor design using the pin-in-block fuel element, which was started in 1969. The basic plant design of the rationalized reactor with the thermal output of 50MW and the core outlet gas temperature of 950 deg C (initially 850 deg C) was carried out and, in this report, the reactor design and its performances are described. It became clear that the mean core power density of 2.5 W/cc and the mean fuel burn-up of 15 GWD/T will be attained using the up-graded fuel element, the sophisticated control rod layout, and so on. These figures are greater by about 70 % compared with those in the previous design. (author)

  7. Facile and green synthesis of core-shell structured magnetic chitosan submicrospheres and their surface functionalization.

    Science.gov (United States)

    Li, Yiya; Yuan, Dongying; Dong, Mingjie; Chai, Zhihua; Fu, Guoqi

    2013-09-17

    Submicrometer-sized magnetite colloid nanocrystal clusters (MCNCs) provide a new avenue for constructing uniformly sized and highly magnetic composite submicrospheres. Herein, a facile and eco-friendly method is described for the synthesis of Fe3O4@poly(acrylic acid) (PAA)/chitosan (CS) core-shell submicrospheres using MCNCs bearing carboxyl groups as the magnetic cores. It is based on the self-assembly of positively charged CS chains on the surface of the oppositely charged MCNCs dispersed in the aqueous solution containing acrylic acid (AA) and a cross-linker N,N'-methylenebis(acrylamide) (MBA), followed by radical induced cross-linking copolymerization of AA and MBA along the CS chains. The resulting polymer shell comprises a medium shell of cross-linked PAA/CS polyelectrolyte complexes and an outer shell of protonated CS chains. It was found that the shell thickness could be tuned by varying either the concentration of radical initiator or the molar ratio of AA to aminoglucoside units of CS. To the surface of thus obtained Fe3O4@PAA/CS particles, Au nanoparticles, a variety of functional groups such as fluorescein, carboxyl, quaternary ammonium, and aliphatic bromide, and even functional polymer chains were successfully introduced. Therefore, such Fe3O4@PAA/CS submicrospheres may be used as versatile magnetic functional scaffolds in biorelated areas like bioseparation and medical assay, considering the unique features of CS like nontoxicity and biocompatibility.

  8. Liquid Core ARROW Waveguides: A Promising Photonic Structure for Integrated Optofluidic Microsensors

    Directory of Open Access Journals (Sweden)

    Genni Testa

    2016-03-01

    Full Text Available In this paper, we introduce a liquid core antiresonant reflecting optical waveguide (ARROW as a novel optofluidic device that can be used to create innovative and highly functional microsensors. Liquid core ARROWs, with their dual ability to guide the light and the fluids in the same microchannel, have shown great potential as an optofluidic tool for quantitative spectroscopic analysis. ARROWs feature a planar architecture and, hence, are particularly attractive for chip scale integrated system. Step by step, several improvements have been made in recent years towards the implementation of these waveguides in a complete on-chip system for highly-sensitive detection down to the single molecule level. We review applications of liquid ARROWs for fluids sensing and discuss recent results and trends in the developments and applications of liquid ARROW in biomedical and biochemical research. The results outlined show that the strong light matter interaction occurring in the optofluidic channel of an ARROW and the versatility offered by the fabrication methods makes these waveguides a very promising building block for optofluidic sensor development.

  9. Preparation of the Core Structure of Aspidosperma and Strychnos Alkaloids from Aryl Azides by a Cascade Radical Cyclization.

    Science.gov (United States)

    Wyler, Benjamin; Brucelle, François; Renaud, Philippe

    2016-03-18

    A novel approach to prepare the core structure of Aspidosperma and Strychnos alkaloids is described. The strategy is based on a cyclization cascade involving the formation of quaternary carbon center followed by trapping of the radical intermediate by an aryl azide to build the 5-membered ring of the pyrrolocarbazole system. This reaction is run with triethylborane without the need for any hydrogen atom donor such as a tin hydride or tris(trimethylsilyl)silane, and it furnishes the tetracyclic framework as a single diastereomer. The influence of different N-protecting groups on the starting iodoacetamide has been examined.

  10. Core stability and bicycling.

    Science.gov (United States)

    Asplund, Chad; Ross, Michael

    2010-01-01

    Bicycling is a popular fitness activity in the United States and around the world. Because of the nature of the bicycling position, the neck and back are at risk for injury. One method to prevent these injuries is to ensure that the body's "core" is strong and stable. A strong and stable core also provides a platform to maximize power transfer, improving performance. Core exercises also may enhance recovery from intense bicycling efforts. Simple stability exercises can improve performance and may prevent injuries in bicyclists.

  11. Monodisperse and core-shell-structured SiO2@YBO3:Eu3+ spherical particles: synthesis and characterization.

    Science.gov (United States)

    Lin, Cuikun; Kong, Deyan; Liu, Xiaoming; Wang, Huan; Yu, Min; Lin, Jun

    2007-04-02

    Y0.9Eu0.1BO3 phosphor layers were deposited on monodisperse SiO2 particles of different sizes (300, 570, 900, and 1200 nm) via a sol-gel process, resulting in the formation of core-shell-structured SiO2@Y0.9Eu0.1BO3 particles. X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM), transmission electron microscopy (TEM), photoluminescence (PL), and cathodoluminescence (CL) spectra as well as lifetimes were employed to characterize the resulting composite particles. The results of XRD, FE-SEM, and TEM indicate that the 800 degrees C annealed sample consists of crystalline YBO3 shells and amorphous SiO2 cores, in spherical shape with a narrow size distribution. Under UV (240 nm) and VUV (172 nm) light or electron beam (1-6 kV) excitation, these particles show the characteristic 5D0-7F1-4 orange-red emission lines of Eu3+ with a quantum yield ranging from 36% (one-layer Y0.9Eu0.1BO3 on SiO2) to 54% (four-layer Y0.9Eu0.1BO3 on SiO2). The luminescence properties (emission intensity and color coordinates) of Eu3+ ions in the core-shell particles can be tuned by the coating number of Y0.9Eu0.1BO3 layers and SiO2 core particle size to some extent, pointing out the great potential for these particles applied in displaying and lightening fields.

  12. Stable isotope composition of CO2 outgassed from cores of argillites: a simple method to constrain δ 18O of porewater and δ 13C of dissolved carbon in mudrocks

    International Nuclear Information System (INIS)

    Girard, Jean-Pierre; Flehoc, Christine; Gaucher, Eric

    2005-01-01

    Stable isotope characterization of porewater, and dissolved species, in mudrocks and argillaceous rocks is notoriously difficult. Techniques based on physical or chemical extraction of porewater can generate significant analytical artefacts. The authors report a novel, simple approach to determine the δ 18 O of porewater and δ 13 C of dissolved C in argillites. The method uses core samples placed in specifically-designed outgassing cells, sealed shortly after drilling and stored in well-controlled conditions. After 1-2 months, CO 2 naturally outgassed by argillite porewater is collected, purified and analyzed for C and O isotopes. Porewater δ 18 O and dissolved C δ 13 C are calculated from CO 2 isotope data using appropriate fractionation factors. This methodology was successfully applied to the Callovo-Oxfordian argillites from Bure (eastern Paris Basin, France) and the Opalinus Clay formation from Mont Terri (Switzerland). In both clay formati