WorldWideScience

Sample records for loop reaction studies

  1. Mineral carbonation: energy costs of pretreatment options and insights gained from flow loop reaction studies

    Energy Technology Data Exchange (ETDEWEB)

    Penner, Larry R.; O' Connor, William K.; Dahlin, David C.; Gerdemann, Stephen J.; Rush, Gilbert E.

    2004-01-01

    Sequestration of carbon as a stable mineral carbonate has been proposed to mitigate environmental concerns that carbon dioxide may with time escape from its sequestered matrix using alternative sequestration technologies. A method has been developed to prepare stable carbonate products by reacting CO2 with magnesium silicate minerals in aqueous bicarbonate/chloride media at high temperature and pressure. Because this approach is inherently expensive due to slow reaction rates and high capital costs, studies were conducted to improve the reaction rates through mineral pretreatment steps and to cut expenses through improved reactor technology. An overview is given for the estimated cost of the process including sensitivity to grinding and heating as pretreatment options for several mineral feedstocks. The energy costs are evaluated for each pretreatment in terms of net carbon avoided. New studies with a high-temperature, high-pressure flow-loop reactor have yielded information on overcoming kinetic barriers experienced with processing in stirred autoclave reactors. Repeated tests with the flow-loop reactor have yielded insights on wear and failure of system components, on challenges to maintain and measure flow, and for better understanding of the reaction mechanism.

  2. Chemical Looping Combustion Reactions and Systems

    Energy Technology Data Exchange (ETDEWEB)

    Sarofim, Adel; Lighty, JoAnn; Smith, Philip; Whitty, Kevin; Eyring, Edward; Sahir, Asad; Alvarez, Milo; Hradisky, Michael; Clayton, Chris; Konya, Gabor; Baracki, Richard; Kelly, Kerry

    2014-03-01

    , they performed a sensitivity analysis for velocity, height and polydispersity and compared results against literature data for experimental studies of CLC beds with no reaction. Finally, they present an optimization space using simple non-reactive configurations. In Subtask 5.3, through a series of experimental studies, behavior of a variety of oxygen carriers with different loadings and manufacturing techniques was evaluated under both oxidizing and reducing conditions. The influences of temperature, degree of carrier conversion and thermodynamic driving force resulting from the difference between equilibrium and system O{sub 2} partial pressures were evaluated through several experimental campaigns, and generalized models accounting for these influences were developed to describe oxidation and oxygen release. Conversion of three solid fuels with widely ranging reactivities was studied in a small fluidized bed system, and all but the least reactive fuel (petcoke) were rapidly converted by oxygen liberated from the CLOU carrier. Attrition propensity of a variety of carriers was also studied, and the carriers produced by freeze granulation or impregnation of preformed substrates displayed the lowest rates of attrition. Subtask 5.4 focused on gathering kinetic data for a copper-based oxygen carrier to assist with modeling of a functioning chemical looping reactor. The kinetics team was also responsible for the development and analysis of supported copper oxygen carrier material.

  3. Gravitational back reaction on piecewise linear cosmic string loops

    CERN Document Server

    Wachter, Jeremy M

    2016-01-01

    We calculate the metric and affine connection due to a piecewise linear cosmic string loop, and the effect of gravitational back reaction for the Garfinkle-Vachaspati loop with four straight segments. As expected, back reaction reduces the size of the loop, in accord with the energy going into gravitational waves. The "square" loop whose generators lie at right angles evaporates without changing shape, but in all other cases, the kinks become less sharp and segments between kinks become curved. If the loop is close to the square case, the loop will evaporate before its kinks are significantly changed; if it is far from square, the opening out of the kinks is much faster than evaporation of the loop. In more realistic loops, the curvature of the straight segments due to gravitational back reaction may lead to cusps which did not exist in the original shape with the bending of the string concentrated at kinks.

  4. Chemical Looping Combustion Reactions and Systems

    Energy Technology Data Exchange (ETDEWEB)

    Sarofim, Adel; Lighty, JoAnn; Smith, Philip; Whitty, Kevin; Eyring, Edward; Sahir, Asad; Alvarez, Milo; Hradisky, Michael; Clayton, Chris; Konya, Gabor; Baracki, Richard; Kelly, Kerry

    2011-07-01

    Chemical Looping Combustion (CLC) is one promising fuel-combustion technology, which can facilitate economic CO2 capture in coal-fired power plants. It employs the oxidation/reduction characteristics of a metal, or oxygen carrier, and its oxide, the oxidizing gas (typically air) and the fuel source may be kept separate. This work focused on two classes of oxygen carrier, one that merely undergoes a change in oxidation state, such as Fe3O4/Fe2O3 and one that is converted from its higher to its lower oxidation state by the release of oxygen on heating, i.e., CuO/Cu2O. This topical report discusses the results of four complementary efforts: (1) the development of process and economic models to optimize important design considerations, such as oxygen carrier circulation rate, temperature, residence time; (2) the development of high-performance simulation capabilities for fluidized beds and the collection, parameter identification, and preliminary verification/uncertainty quantification (3) the exploration of operating characteristics in the laboratory-scale bubbling bed reactor, with a focus on the oxygen carrier performance, including reactivity, oxygen carrying capacity, attrition resistance, resistance to deactivation, cost and availability (4) the identification of mechanisms and rates for the copper, cuprous oxide, and cupric oxide system using thermogravimetric analysis.

  5. Theoretical study of stability and reaction mechanism of CuO supported on ZrO{sub 2} during chemical looping combustion

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Minjun; Liu, Jing, E-mail: liujing27@mail.hust.edu.cn; Shen, Fenghua; Cheng, Hao; Dai, Jinxin; Long, Yan

    2016-03-30

    Graphical abstract: - Highlights: • The stability and reaction mechanism of CuO supported on ZrO{sub 2} were studied by DFT. • ZrO{sub 2} provides a high resistance to CuO sintering. • ZrO{sub 2} promotes the activity of CuO for CO oxidation in fuel reactor. • The energy barriers are low enough for CuO/ZrO{sub 2} oxidation reaction in air reactor. - Abstract: The addition of inert support is important for the Cu-based oxygen carrier used in chemical looping combustion (CLC). The effects of the ZrO{sub 2} support on the stability and reactivity of Cu-based oxygen carrier were investigated using the density functional theory (DFT). First, the sintering inhibition mechanism of ZrO{sub 2} that support active CuO was investigated. The optimized Cu{sub 4}O{sub 4}/ZrO{sub 2} structure showed a strong interaction occurred between the Cu{sub 4}O{sub 4} cluster and ZrO{sub 2}(1 0 1) surface. The interaction prevented the migration and agglomeration of CuO. Next, the adsorption of CO on Cu{sub 4}O{sub 4}/ZrO{sub 2} and the mechanism of the CuO/ZrO{sub 2} reduction by CO were studied. CO mainly chemisorbed on the Cu site and ZrO{sub 2} acted as an electron donor in the adsorption system. The energy barrier of CuO/ZrO{sub 2} reduction by CO (0.79 eV) was much lower than that of the pure CuO cluster (1.44 eV), indicating that ZrO{sub 2} had a positive effect on CuO/ZrO{sub 2} reduction by CO. After CO was oxidized in the fuel reactor, the CuO was reduced into Cu. The adsorption of O{sub 2} on Cu{sub 2}/ZrO{sub 2} and the most likely pathway of Cu{sub 2}/ZrO{sub 2} oxidation by O{sub 2} were investigated. The adsorption of O{sub 2} was found a strong chemisorption behavior. The energy barriers were low enough for the Cu-based oxygen carrier oxidation reaction.

  6. Study of the Open Loop and Closed Loop Oscillator Techniques

    Energy Technology Data Exchange (ETDEWEB)

    Imel, George R. [Idaho State Univ., Pocatello, ID (United States); Baker, Benjamin [Idaho National Lab. (INL), Idaho Falls, ID (United States); Riley, Tony [Knolls Atomic Power Lab. (KAPL), Schenectady, NY (United States); Langbehn, Adam [Puget Sound Naval Base, Bremerton, WA (United States); Aryal, Harishchandra [Idaho State Univ., Pocatello, ID (United States); Benzerga, M. Lamine [Idaho State Univ., Pocatello, ID (United States)

    2015-04-11

    This report presents the progress and completion of a five-year study undertaken at Idaho State University of the measurement of very small worth reactivity samples comparing open and closed loop oscillator techniques.The study conclusively demonstrated the equivalency of the two techniques with regard to uncertainties in reactivity values, i.e., limited by reactor noise. As those results are thoroughly documented in recent publications, in this report we will concentrate on the support work that was necessary. For example, we describe in some detail the construction and calibration of a pilot rod for the closed loop system. We discuss the campaign to measure the required reactor parameters necessary for inverse-kinetics. Finally, we briefly discuss the transfer of the open loop technique to other reactor systems.

  7. Development of Capillary Loop Convective Polymerase Chain Reaction Platform with Real-Time Fluorescence Detection

    Directory of Open Access Journals (Sweden)

    Wen-Pin Chou

    2017-02-01

    Full Text Available Polymerase chain reaction (PCR has been one of the principal techniques of molecular biology and diagnosis for decades. Conventional PCR platforms, which work by rapidly heating and cooling the whole vessel, need complicated hardware designs, and cause energy waste and high cost. On the other hand, partial heating on the various locations of vessels to induce convective solution flows by buoyancy have been used for DNA amplification in recent years. In this research, we develop a new convective PCR platform, capillary loop convective polymerase chain reaction (clcPCR, which can generate one direction flow and make the PCR reaction more stable. The U-shaped loop capillaries with 1.6 mm inner diameter are designed as PCR reagent containers. The clcPCR platform utilizes one isothermal heater for heating the bottom of the loop capillary and a CCD device for detecting real-time amplifying fluorescence signals. The stable flow was generated in the U-shaped container and the amplification process could be finished in 25 min. Our experiments with different initial concentrations of DNA templates demonstrate that clcPCR can be applied for precise quantification. Multiple sample testing and real-time quantification will be achieved in future studies.

  8. Space Station evolution study oxygen loop closure

    Science.gov (United States)

    Wood, M. G.; Delong, D.

    1993-01-01

    In the current Space Station Freedom (SSF) Permanently Manned Configuration (PMC), physical scars for closing the oxygen loop by the addition of oxygen generation and carbon dioxide reduction hardware are not included. During station restructuring, the capability for oxygen loop closure was deferred to the B-modules. As such, the ability to close the oxygen loop in the U.S. Laboratory module (LAB A) and the Habitation A module (HAB A) is contingent on the presence of the B modules. To base oxygen loop closure of SSF on the funding of the B-modules may not be desirable. Therefore, this study was requested to evaluate the necessary hooks and scars in the A-modules to facilitate closure of the oxygen loop at or subsequent to PMC. The study defines the scars for oxygen loop closure with impacts to cost, weight and volume and assesses the effects of byproduct venting. In addition, the recommended scenarios for closure with regard to topology and packaging are presented.

  9. Reactions between a <111> screw dislocation and <100> interstitial dislocation loops in alpha-iron modelled at atomic-scale

    Energy Technology Data Exchange (ETDEWEB)

    Terentyev, Dmitry [Belgian Nuclear Research Centre, SCK-CEN; Bacon, David J [University of Liverpool; Osetskiy, Yury N [ORNL

    2010-03-01

    Interstitial dislocation loops with Burgers vector of <100> type are observed in {alpha}-iron irradiated by neutrons or heavy ions, and their population increases with increasing temperature. Their effect on motion of a 1/2<111> edge dislocation was reported earlier 1. Results are presented of a molecular dynamics study of interactions between a 1/2<111> screw dislocation and <100> loops in iron at temperature in the range 100 to 600 K. A variety of reaction mechanisms and outcomes are observed and classified in terms of the resulting dislocation configuration and the maximum stress required for the dislocation to break away. The highest obstacle resistance arises when the loop is absorbed to form a helical turn on the screw dislocation line, for the dislocation cannot glide away until the turn closes and a loop is released with the same Burgers vector as the line. Other than one situation found, in which no dislocation-loop reaction occurs, the weakest obstacle strength is found when the original <100> loop is restored at the end of the reaction. The important role of the cross-slip and the influence of model boundary conditions are emphasised and demonstrated by examples.

  10. Loop-loop interaction in an adenine-sensing riboswitch: a molecular dynamics study.

    Science.gov (United States)

    Allnér, Olof; Nilsson, Lennart; Villa, Alessandra

    2013-07-01

    Riboswitches are mRNA-based molecules capable of controlling the expression of genes. They undergo conformational changes upon ligand binding, and as a result, they inhibit or promote the expression of the associated gene. The close connection between structural rearrangement and function makes a detailed knowledge of the molecular interactions an important step to understand the riboswitch mechanism and efficiency. We have performed all-atom molecular dynamics simulations of the adenine-sensing add A-riboswitch to study the breaking of the kissing loop, one key tertiary element in the aptamer structure. We investigated the aptamer domain of the add A-riboswitch in complex with its cognate ligand and in the absence of the ligand. The opening of the hairpins was simulated using umbrella sampling using the distance between two loops as the reaction coordinate. A two-step process was observed in all the simulated systems. First, a general loss of stacking and hydrogen bond interactions is seen. The last interactions that break are the two base pairs G37-C61 and G38-C60, but the break does not affect the energy profile, indicating their pivotal role in the tertiary structure formation but not in the structure stabilization. The junction area is partially organized before the kissing loop formation and residue A24 anchors together the loop helices. Moreover, when the distance between the loops is increased, one of the hairpins showed more flexibility by changing its orientation in the structure, while the other conserved its coaxial arrangement with the rest of the structure.

  11. Structural studies on an internal loop from a hairpin ribozyme

    Energy Technology Data Exchange (ETDEWEB)

    Cai, Z.; SantaLucia, J. Jr.; Tinoco, I. Jr. [Univ. of California, Berkeley, CA (United States)

    1994-12-01

    Ribozymes, RNA enzymes, catalyze site-specific RNA cleavage and ligation reactions. We are studying the three-dimensional structure of a hairpin ribozyme derived from the minus strand of tobacco ring spot virus satellite RNA ((-)sTRSV), which has been engineering to specifically cleave the HIV-1 RNA. The minimum structure for the catalytic reaction involves a 50-nucleotide ribozyme and a 14-nucleotide substrate. The proposed secondary structure of the ribozyme-substrate complex consists of four short helices separated by two internal loops. The relatively large size (64-nucleotide) of the ribozyme-substrate complex presents formidable problems in solving the structure using NMR. Therefore we are studying smaller structural subunits of the complex. We are determining the high resolution structure of the symmetric internal loop involving the cleavage site and the flanking helices. One strand of the internal loop was selectively {sup 13}C-labeled at C8 of each purine and C6 of each pyrimidine. By using {sup 13}C-edited two-dimensional NMR, the proton NOESY spectrum was greatly simplified. This allowed unambiguous sequential proton resonance assignments along each strand. Three-dimensional {sup 1}-{sup 13}C HMQC-NOESY was used to further facilitate resonance assignments. We are also enzymatically synthesizing the entire 50-nucleotide ribozyme and will combine it with the {sup 13}C-labeled substrate. Through comparison of the NOE connectivities of the labeled nucleotides from the internal loop alone with those from the entire complex, the differences between the two structures can be elucidated.

  12. An Holomorphic Study Of Smarandache Automorphic and Cross Inverse Property Loops

    CERN Document Server

    Jaiyeola, Temitope Gbolahan

    2008-01-01

    By studying the holomorphic structure of automorphic inverse property quasigroups and loops[AIPQ and (AIPL)] and cross inverse property quasigroups and loops[CIPQ and (CIPL)], it is established that the holomorph of a loop is a Smarandache; AIPL, CIPL, K-loop, Bruck-loop or Kikkawa-loop if and only if its Smarandache automorphism group is trivial and the loop is itself is a Smarandache; AIPL, CIPL, K-loop, Bruck-loop or Kikkawa-loop.

  13. Study of loop-loop and loop-edge dislocation interactions in bcc iron

    DEFF Research Database (Denmark)

    Osetsky, Y.N.; Bacon, D.J.; Gao, F.

    2000-01-01

    Recent theoretical calculations and atomistic computer simulations have shown that one-dimensional glissile clusters of self-interstitial atoms (SIAs) play an important role in the evolution of microstructure in metals and alloys under cascade damage conditions. Recently, it has been proposed...... that the evolution of heterogeneities such as dislocation decoration and rafts has serious impacts on the mechanical properties on neutron-irradiated metals. In the present work, atomic-scale computer modelling (ASCM) has been applied to study the mechanisms for the formation of such microstructure in bcc iron...

  14. Heat Integration of the Water-Gas Shift Reaction System for Carbon Sequestration Ready IGCC Process with Chemical Looping

    Energy Technology Data Exchange (ETDEWEB)

    Juan M. Salazara; Stephen E. Zitney; Urmila M. Diwekara

    2010-01-01

    Integrated gasification combined cycle (IGCC) technology has been considered as an important alternative for efficient power systems that can reduce fuel consumption and CO2 emissions. One of the technological schemes combines water-gas shift reaction and chemical-looping combustion as post gasification techniques in order to produce sequestration-ready CO2 and potentially reduce the size of the gas turbine. However, these schemes have not been energetically integrated and process synthesis techniques can be applied to obtain an optimal flowsheet. This work studies the heat exchange network synthesis (HENS) for the water-gas shift reaction train employing a set of alternative designs provided by Aspen energy analyzer (AEA) and combined in a process superstructure that was simulated in Aspen Plus (AP). This approach allows a rigorous evaluation of the alternative designs and their combinations avoiding all the AEA simplifications (linearized models of heat exchangers). A CAPE-OPEN compliant capability which makes use of a MINLP algorithm for sequential modular simulators was employed to obtain a heat exchange network that provided a cost of energy that was 27% lower than the base case. Highly influential parameters for the pos gasification technologies (i.e. CO/steam ratio, gasifier temperature and pressure) were calculated to obtain the minimum cost of energy while chemical looping parameters (oxidation and reduction temperature) were ensured to be satisfied.

  15. Theoretical Studies of Reaction Surfaces

    Science.gov (United States)

    2007-11-02

    Similar levels of agreement are being found in studies of water clusters12 , the Menshutkin reaction 13 (ion separation reaction ), a prototypical SN2 ...of both reactants and products. These analyses reveal that Bery pseudorotation occurs repeatedly during the side attack, whereas the SN2 reaction H...31 Aug 97 4. TITLE AND SUBTITLE 5. FUNDING NUMBERS AASERT93 THEORETICAL STUDIES OF REACTION SURFACES F49620-93-1-0556 3484/XS 6. AUTHOR(S) 61103D DR

  16. Closed Loop Adaptive Refinement of Dynamical Models for Complex Chemical Reactions

    Science.gov (United States)

    2008-06-26

    CH3Br, Ar + H2O are given below. 3.1 Cl− + CH3Br Reaction A global RS-HDMR input/output map for the SN2 reaction Cl− +CH3Br→ ClCH3 +Br − (9) 3 was...2257-2266. [16] Wang H. B., Hase W. L. (1996). Reaction path Hamiltonian analysis of the dynamics for Cl− + CH3Br→ ClCH3 + Br − SN2 nucleophilic... reaction Cl − + CH3Br → ClCH3 + Br −, J. Chem. Phys., 111(24), 10887- 10894. [18] Sun, L., Hase, W. L., Song, K. (2001). Trajectory studies of SN2

  17. Chemical looping coal gasification with calcium ferrite and barium ferrite via solid--solid reactions

    Energy Technology Data Exchange (ETDEWEB)

    Siriwardane, Ranjani [U.S. Department of Energy/NETL; Riley, Jarrett [Oak Ridge Inst. for Science and Education (ORISE), Oak Ridge, TN (United States); Tian, Hanjing [West Virginia Univ., Morgantown, WV (United States); Richards, George [U.S. Department of Energy/NETL

    2016-01-01

    Coal gasification to produce synthesis gas by chemical looping was investigated with two oxygen carriers, barium ferrite (BaFe2O4) and calcium ferrite (CaFe2O4). Thermo-gravimetric analysis (TGA) and fixed-bed flow reactor data indicated that a solid–solid interaction occurred between oxygen carriers and coal to produce synthesis gas. Both thermodynamic analysis and experimental data indicated that BaFe2O4 and CaFe2O4 have high reactivity with coal but have a low reactivity with synthesis gas, which makes them very attractive for the coal gasification process. Adding steam increased the production of hydrogen (H2) and carbon monoxide (CO), but carbon dioxide (CO2) remained low because these oxygen carriers have minimal reactivity with H2 and CO. Therefore, the combined steam–oxygen carrier produced the highest quantity of synthesis gas. It appeared that neither the water–gas shift reaction nor the water splitting reaction promoted additional H2 formation with the oxygen carriers when steam was present. Wyodak coal, which is a sub-bituminous coal, had the best gasification yield with oxygen carrier–steam while Illinois #6 coal had the lowest. The rate of gasification and selectivity for synthesis gas production was significantly higher when these oxygen carriers were present during steam gasification of coal. The rates and synthesis gas yields during the temperature ramps of coal–steam with oxygen carriers were better than with gaseous oxygen.

  18. Loop-induced Neutrino Masses: A Case Study

    CERN Document Server

    Geng, Chao-Qiang; Tsai, Lu-Hsing

    2014-01-01

    We study the cocktail model in which the Majorana neutrino masses are generated by the so-called "cocktail" three-loop diagrams with the dark matter particle running in the loops. In particular, we give the correct analytic expressions of the neutrino masses in the model by the detailed calculation of the cocktail diagrams. Based on the reliable numerical calculation of the loop integrals, we explore the parameter space which can give the correct orders of neutrino masses while satisfying other experimental constraints, such as those from the neutrinoless double beta decay, low-energy lepton flavor violation processes, electroweak precision tests, and collider searches. As a result, the large couplings and the large mass difference between the two singly-charged (neutral) scalars are required.

  19. Study of Scaling Development on Tube Surfaces of Water Steam Loop in Steam Generator of CEFR

    Institute of Scientific and Technical Information of China (English)

    ZHANG; Lu; LIU; Fu-chen; LUO; De-kang; WU; Qiang; ZHANG; Huan-qi

    2012-01-01

    <正>The steam generator worked as pressure boundary of Na-H2O loop in China Experimental FastReactor (CEFR), which was quite important for nuclear reactor safety. Once the tubes separating the water from steam leak because of corrosion by scaling, Na-H2O reaction would lead to severe accident. So it’s critically important to study how the scaling develops on the water-steam sides.

  20. A Study on the Role of Reaction Modeling in Multi-phase CFD-based Simulations of Chemical Looping Combustion Impact du modèle de réaction sur les simulations CFD de la combustion en boucle chimique

    Directory of Open Access Journals (Sweden)

    Kruggel-Emden H.

    2011-03-01

    Full Text Available Chemical Looping Combustion is an energy efficient combustion technology for the inherent separation of carbon dioxide for both gaseous and solid fuels. For scale up and further development of this process multi-phase CFD-based simulations have a strong potential which rely on kinetic models for the solid/gaseous reactions. Reaction models are usually simple in structure in order to keep the computational cost low. They are commonly derived from thermogravimetric experiments. With only few CFD-based simulations performed on chemical looping combustion, there is a lack in understanding of the role and of the sensitivity of the applied chemical reaction model on the outcome of a simulation. The aim of this investigation is therefore the study of three different carrier materials CaSO4, Mn3O4 and NiO with the gaseous fuels H2 and CH4 in a batch type reaction vessel. Four reaction models namely the linear shrinking core, the spherical shrinking core, the Avrami-Erofeev and a recently proposed multi parameter model are applied and compared on a case by case basis. La combustion en boucle chimique (Chemical Looping Combustion est une technologie de combustion efficace permettant le captage in situ du CO2 pour des charges gazeuses ou solides. Dans l’optique du développement et de l’extrapolation du procédé, la CFD est un outil de simulation à fort potentiel qui s’appuie notamment sur des modèles cinétiques pour décrire les réactions gaz-solide. Ces modèles décrivant les réactions sont généralement assez simples pour limiter les temps de simulation et sont obtenus à partir d’expérimentations en thermobalance. Il y a encore peu de travaux de modélisation CFD du procédé CLC et il est difficile d’estimer l’importance du modèle décrivant les réactions chimiques sur les résultats des simulations. Le but de ce travail est donc d’étudier la combustion de charges gazeuses H2 et CH4 dans des réacteurs en batch en consid

  1. An holomorphic study of the Smarandache concept in loops

    CERN Document Server

    Jaiyeola, Temitope Gbolahan

    2006-01-01

    If two loops are isomorphic, then it is shown that their holomorphs are also isomorphic. Conversely, it is shown that if their holomorphs are isomorphic, then the loops are isotopic. It is shown that a loop is a Smarandache loop if and only if its holomorph is a Smarandache loop. This statement is also shown to be true for some weak Smarandache loops(inverse property, weak inverse property) but false for others(conjugacy closed, Bol, central, extra, Burn, A-, homogeneous) except if their holomorphs are nuclear or central. A necessary and sufficient condition for the Nuclear-holomorph of a Smarandache Bol loop to be a Smarandache Bruck loop is shown. Whence, it is found also to be a Smarandache Kikkawa loop if in addition the loop is a Smarandache A-loop with a centrum holomorph. Under this same necessary and sufficient condition, the Central-holomorph of a Smarandache A-loop is shown to be a Smarandache K-loop.

  2. Collider study on the loop-induced dark matter mediation

    Energy Technology Data Exchange (ETDEWEB)

    Tsai, Yuhsin, E-mail: yhtsai@umd.edu [Maryland Center for Fundamental Physics, University of Maryland, College Park, MD 20742 (United States)

    2016-06-21

    Collider experiments are one of the most promising ways to constrain Dark Matter (DM) interactions. For DM couplings involving light mediators, especially for the loop-mediated interactions, a meaningful interpretation of the results requires to go beyond effective field theory. In this note we discuss the study of the magnetic dipole interacting DM, focusing on a model with anarchic dark flavor structure. By including the momentum-dependent form factors that mediate the coupling – given by the Dark Penguin – in collider processes, we study bounds from monophoton, diphoton, and non-pointing photon searches at the LHC. We also compare our results to constraints from the direct detection experiments.

  3. Theoretical study on a solar collector loop during stagnation

    DEFF Research Database (Denmark)

    Chen, Ziqian; Dragsted, Janne; Furbo, Simon;

    2010-01-01

    A mathematical model simulating the stagnation behavior of a pressurized solar collector loop with solar collectors with a good emptying behavior is developed. Based on the pre-pressure of the expansion vessel, the system filling pressure of the solar collector loop and the design of the solar...... collector loop, the mass of the fluid flowing into the pressurized expansion vessel and the pressures at the top part and at the bottom part of the solar collector loop during stagnation for the solar collector loop are calculated. The theoretically calculated results are compared with experimental results....... There is a good agreement between calculations and measurements. The developed simulation model is therefore suitable to determine the behavior of solar collector loops during stagnation....

  4. Theoretical study on a solar collector loop during stagnation

    DEFF Research Database (Denmark)

    Chen, Ziqian; Dragsted, Janne; Furbo, Simon;

    A mathematical model simulating the stagnation behavior of a pressurized solar collector loop with solar collectors with a good emptying behavior is developed. Based on the pre-pressure of the expansion vessel, the system filling pressure of the solar collector loop and the design of the solar...... collector loop, the mass of the fluid flowing into the pressurized expansion vessel and the pressures at the top part and at the bottom part of the solar collector loop during stagnation for the solar collector loop are calculated. The theoretically calculated results are compared with experimental results....... There is a good agreement between calculations and measurements. The developed simulation model is therefore suitable to determine the behavior of solar collector loops during stagnation....

  5. S0 Tight Loop Studies on ICHIRO 9-Cell Cavities

    Energy Technology Data Exchange (ETDEWEB)

    Furuta, Fumio [KEK; Konomi, T. [KEK; Saito, Kenji [KEK; Bice, Damon [Fermilab; Crawford, Anthony C. [JLAB; Geng, Rongli [JLAB

    2009-11-01

    We have continued high gradient R&D of ICHIRO 9-cell cavities at KEK. ICHIRO 9-cell cavity #5 (I9#5) that has no end groups on beam tube to focus on high gradient sent to Jlab as S0 tight loop study. Surface treatments and vertical test were repeated 3 times at Jlab, and then I9#5 sent back to KEK. We also repeated surface treatments and test at KEK. Maximum gradients were 36.5MV/m at Jlab, and 33.7MV/m at KEK so far. Now we are struggling with the puzzle why the results of singles do not work well on 9-cell cavities.

  6. Kinetic studies of elementary chemical reactions

    Energy Technology Data Exchange (ETDEWEB)

    Durant, J.L. Jr. [Sandia National Laboratories, Livermore, CA (United States)

    1993-12-01

    This program concerning kinetic studies of elementary chemical reactions is presently focussed on understanding reactions of NH{sub x} species. To reach this goal, the author is pursuing experimental studies of reaction rate coefficients and product branching fractions as well as using electronic structure calculations to calculate transition state properties and reaction rate calculations to relate these properties to predicted kinetic behavior. The synergy existing between the experimental and theoretical studies allow one to gain a deeper insight into more complex elementary reactions.

  7. Test Reactions to Study Efficiency of

    OpenAIRE

    Jasińska Magdalena

    2015-01-01

    Effects of mixing on the course of fast chemical reactions are relatively well understood, especially in homogeneous systems. This enables to design and operate chemical reactors with the goal to achieve a high yield of a desired product and use systems of complex reactions as a chemical probe (chemical test reactions) to identify progress of mixing and quality of mixture. Recently, a number of studies have focused on the application of chemical test reactions to identify energy efficiency of...

  8. Evaluation and Comparison of Biomechanical Properties of Snail Loop with that of Opus Loop and Teardrop Loop for en masse Retraction of Anterior Teeth: FEM Study

    Directory of Open Access Journals (Sweden)

    Parikshit Rajkumar Rao

    2013-01-01

    Results: Inherently the M/F ratio produced was higher and F/D rate produced was least for opus loop compared to snail loop and teardrop loop. Conclusion: With incorporation of 20°gable bends snail loop prepared in 0.017 × 0.025 inch and 0.019 × 0.025 inch TMA wire is very efficient to deliver M/F ratio required for translatory tooth movement with acceptable F/D rate. Snail loop is easy to fabricate and finer shape morphology prevents tissue impingement.

  9. Study of Two-Loop Neutrino Mass Generation Models

    CERN Document Server

    Geng, Chao-Qiang

    2015-01-01

    We study the models with the Majorana neutrino masses generated radiatively by two-loop diagrams due to the Yukawa $\\rho \\bar \\ell_R^c \\ell_R$ and effective $\\rho^{\\pm\\pm} W^\\mp W^\\mp$ couplings along with a scalar triplet $\\Delta$, where $\\rho$ is a doubly charged singlet scalar, $\\ell_R$ the charged lepton and $W$ the charged gauge boson. A generic feature in these types of models is that the neutrino mass spectrum has to be a normal hierarchy. Furthermore, by using the neutrino oscillation data and comparing with the global fitting result in the literature, we find a unique neutrino mass matrix and predict the Dirac and two Majorana CP phases to be $1.40\\pi$, $1.11\\pi$ and $1.47\\pi$, respectively. We also discuss the model parameters constrained by the lepton flavor violating processes and electroweak oblique parameters. In addition, we show that the rate of the neutrinoless double beta decay $(0\

  10. Loop mediated isothermal amplification assay using hydroxy naphthol blue, conventional polymerase chain reaction and real-time PCR in the diagnosis of intraocular tuberculosis.

    Science.gov (United States)

    Balne, P K; Basu, S; Rath, S; Barik, M R; Sharma, S

    2015-01-01

    This study is a comparative evaluation (Chi-square test) of a closed tube loop mediated isothermal amplification assay using hydroxy naphthol blue dye (HNB-LAMP), real-time polymerase chain reaction (PCR) and conventional PCR in the diagnosis of intraocular tuberculosis. Considering clinical presentation as the gold standard in 33 patients, the sensitivity of HNB-LAMP assay (75.8%) was higher (not significant, P value 0.2) than conventional PCR (57.6%) and lower than real-time PCR (90.9%). Specificity was 100% by all three methods. No amplification was observed in negative controls (n = 20) by all three methods. The cost of the HNB-LAMP assay was Rs. 500.00 and it does not require thermocycler, therefore, it can be used as an alternative to conventional PCR in resource-poor settings.

  11. Loop mediated isothermal amplification assay using hydroxy naphthol blue, conventional polymerase chain reaction and real-time PCR in the diagnosis of intraocular tuberculosis

    Directory of Open Access Journals (Sweden)

    P K Balne

    2015-01-01

    Full Text Available This study is a comparative evaluation (Chi-square test of a closed tube loop mediated isothermal amplification assay using hydroxy naphthol blue dye (HNB-LAMP, real-time polymerase chain reaction (PCR and conventional PCR in the diagnosis of intraocular tuberculosis. Considering clinical presentation as the gold standard in 33 patients, the sensitivity of HNB-LAMP assay (75.8% was higher (not significant, P value 0.2 than conventional PCR (57.6% and lower than real-time PCR (90.9%. Specificity was 100% by all three methods. No amplification was observed in negative controls (n = 20 by all three methods. The cost of the HNB-LAMP assay was Rs. 500.00 and it does not require thermocycler, therefore, it can be used as an alternative to conventional PCR in resource-poor settings.

  12. Nuclear reaction studies: Progress report

    Energy Technology Data Exchange (ETDEWEB)

    Thaler, R.M.

    1986-11-19

    A principal focus of recent research has been the three-body problem. A great deal of effort has been devoted to the creation of a computer program to calculate physical observables in the three body problem below 1 GeV. Successful results have been obtained for the triton. Additional work concerns scattering of K/sup +/ mesons from nuclei, antinucleon physics, relativistic nuclear physics and inclusive reactions. (DWL)

  13. Systematic study of the d=5 Weinberg operator at one-loop order

    CERN Document Server

    Bonnet, Florian; Ota, Toshihiko; Winter, Walter

    2012-01-01

    We perform a systematic study of the $d=5$ Weinberg operator at the one-loop level. We identify three different categories of neutrino mass generation: (1) finite irreducible diagrams; (2) finite extensions of the usual seesaw mechanisms at one-loop and (3) divergent loop realizations of the seesaws. All radiative one-loop neutrino mass models must fall into one of these classes. Case (1) gives the leading contribution to neutrino mass naturally and a classic example of this class is the Zee model. We demonstrate that in order to prevent that a tree level contribution dominates in case (2), Majorana fermions running in the loop and an additional $\\mathbb{Z}_2$ symmetry are needed for a genuinely leading one-loop contribution. In the type-II loop extensions, the lepton number violating coupling will be generated at one loop, whereas the type-I/III extensions can be interpreted as loop-induced inverse or linear seesaw mechanisms. For the divergent diagrams in category (3), the tree level contribution cannot be ...

  14. Test Reactions to Study Efficiency of

    Directory of Open Access Journals (Sweden)

    Jasińska Magdalena

    2015-06-01

    Full Text Available Effects of mixing on the course of fast chemical reactions are relatively well understood, especially in homogeneous systems. This enables to design and operate chemical reactors with the goal to achieve a high yield of a desired product and use systems of complex reactions as a chemical probe (chemical test reactions to identify progress of mixing and quality of mixture. Recently, a number of studies have focused on the application of chemical test reactions to identify energy efficiency of mixing, being a convenient way of comparing mixers and reactors in terms of their mixing efficiency. This review offers a presentation of chemical test reactions available in the literature and methods of applications of test reactions to identify the energy efficiency of mixing. Also methods to assess the extent of micromixing by measuring product distribution or segregation index, and to determine the time constant for mixing are presented for single phase homogeneous systems and two-phase liquid-liquid systems.

  15. A Detailed Observational Study of Molecular Loops 1 and 2 in the Galactic Center

    CERN Document Server

    Torii, Kazufumi; Fujishita, Motosuji; Kawase, Tokuichi; Yamamoto, Hiroaki; Kawamura, Akiko; Mizuno, Norikazu; Onishi, Toshikazu; Mizuno, Akira; Machida, Mami; Takahashi, Kunio; Nozawa, Satoshi; Matsumoto, Ryoji; Fukui, Yasuo

    2009-01-01

    Fukui et al. (2006) discovered two molecular loops in the Galactic center that are likely created by the magnetic flotation due to the Parker instability. Following the discovery, we present here a detailed study of the two loops based on NANTEN 12CO(J=1-0) and 13CO(J=1-0) datasets. The two loops are located in (l, b) ~ (357, 1) deg. at a velocity range of -20 - -180 km/s with a projected total length of ~ 600 pc and heights of ~250 - 300 pc from the Galactic disk at a distance of 8.5 kpc. They show bright foot points in the 12CO emission in the edges of the loops at b ~ 0.8 - 1.0 deg.. These foot points are characterized by velocity dispersions of 50 - 100 km/s. The loops also show large-scale velocity gradients of ~30 - 50 km/s per ~100 pc. The loops also have counterparts of the HI gas and IRAS emissions. The HI gas with weaker intensity fills the inner part of the loops where there is no significant 12CO and 13CO emission. We estimate total mass and kinetic energy of the loops are ~1.5 - 2.5 x 10^6 Msun a...

  16. Interaction of 〈1 0 0〉 dislocation loops with dislocations studied by dislocation dynamics in α-iron

    Energy Technology Data Exchange (ETDEWEB)

    Shi, X.J.; Dupuy, L. [CEA, DEN, SRMA, F-91191 Gif-sur-Yvette (France); Devincre, B. [Laboratoire d’Etude des Microstructures, CNRS-ONERA, 29 av. de la Division Leclerc, 92322 Châtillon Cedex (France); Terentyev, D. [SCK–CEN, Nuclear Materials Science Institute, Boeretang 200, B-2400 Mol (Belgium); Vincent, L. [CEA, DEN, SRMA, F-91191 Gif-sur-Yvette (France)

    2015-05-15

    Highlights: • Interactions between edge dislocations and radiation-induced loops were studied by dislocation dynamics. • Dislocation dynamics results are directly compared to molecular dynamics results. • The complex elementary reactions are successfully reproduced. • The critical shear stress to overcome individual loops if reproduced quantitatively. - Abstract: Interstitial dislocation loops with Burgers vector of 〈1 0 0〉 type are formed in α-iron under neutron or heavy ion irradiation. As the density and size of these loops increase with radiation dose and temperature, these defects are thought to play a key role in hardening and subsequent embrittlement of iron-based steels. The aim of the present work is to study the pinning strength of the loops on mobile dislocations. Prior to run massive Dislocation Dynamics (DD) simulations involving experimentally representative array of radiation defects and dislocations, the DD code and its parameterization are validated by comparing the individual loop–dislocation reactions with those obtained from direct atomistic Molecular Dynamics (MD) simulations. Several loop–dislocation reaction mechanisms are successfully reproduced as well as the values of the unpinning stress to detach mobile dislocations from the defects.

  17. Analytical Study of Thermonuclear Reaction Probability Integrals

    CERN Document Server

    Chaudhry, M A; Mathai, A M

    2000-01-01

    An analytic study of the reaction probability integrals corresponding to the various forms of the slowly varying cross-section factor $S(E)$ is attempted. Exact expressions for reaction probability integrals are expressed in terms of the extended gamma functions.

  18. Experimental and analytical studies of merging plasma loops on the Caltech solar loop experiment

    Science.gov (United States)

    Pitigoi-Aron, Gabriela

    Attracting and retaining strong faculty members in dental schools have long been challenges in the United States. Faced with an emerging crisis in the availability and quality of dental educators, many researchers have focused on analyzing data and trends related to this subject. Even though there are substantial studies that provide a picture of why domestic dentists choose to become dental educators, there are no dedicated studies investigating why foreign-educated dentists want to become dental educators. This distinct area is of particular importance as we witness increasing diversity of patients and an increased need for a more diverse health care workforce. The purpose of this study was to analyze the reasons why foreign-educated dentists became dental educators in United States and furthermore, at University of the Pacific Arthur A. Dugoni School of Dentistry in San Francisco, California. The research data was collected by means of surveys and in-depth interviews of foreign-trained faculty and IDS graduates on staff at Pacific. The data analysis was performed using descriptive statistics for the survey and a process of thematic analysis for interviews. The surveys' analysis yielded the following six factors that most positively influenced foreign-educated dentists in deciding to embrace a career as an academic educator: (1) Intellectual challenges and stimulation; (2) Opportunity to always be on the cutting edge; (3) Interest in science, new discovery, exploration; (4) Opportunity for regular interaction with other faculty dentists; (5) Desire to be a teacher. (6) Collegial environment of the university. There were two most negative factors identified, as follows: (1) Income differential compared to private practice; (2) Pressure to generate income for the university. Corroborated by analysis of the interviews, the following themes emerged: (1) Drive for research; (2) Desire to be on cutting edge. (3) Desire to share knowledge through teaching; (4) Social

  19. Quasiparticles in Leptogenesis - A hard-thermal-loop study

    CERN Document Server

    Kie\\ssig, Clemens Paul

    2011-01-01

    We analyse the effects of thermal quasiparticles in leptogenesis using hard-thermal-loop-resummed propagators in the imaginary time formalism of thermal field theory. We perform our analysis in a leptogenesis toy model with three right-handed heavy neutrinos $N_1$, $N_2$ and $N_3$. We consider decays and inverse decays and work in the hierarchical limit where $M_2 \\gg M_1$. We neglect flavour effects and assume that the temperatures are much smaller than $M_2$ and $M_3$. We pay special attention to the influence of fermionic quasiparticles. We allow for the leptons to be either decoupled from each other, except for the interactions with neutrinos, or to be in chemical equilibrium by some strong interaction, for example via gauge bosons. In two additional cases, we approximate the full hard-thermal-loop lepton propagators with zero-temperature propagators, where we replace the zero-temperature mass by the thermal mass of the leptons $m_\\ell(T)$ in one case and the asymptotic mass of the positive-helicity mode ...

  20. A numerical study of the thermal stability of low-lying coronal loops

    Science.gov (United States)

    Klimchuk, J. A.; Antiochos, S. K.; Mariska, J. T.

    1986-01-01

    The nonlinear evolution of loops that are subjected to a variety of small but finite perturbations was studied. Only the low-lying loops are considered. The analysis was performed numerically using a one-dimensional hydrodynamical model developed at the Naval Research Laboratory. The computer codes solve the time-dependent equations for mass, momentum, and energy transport. The primary interest is the active region filaments, hence a geometry appropriate to those structures was considered. The static solutions were subjected to a moderate sized perturbation and allowed to evolve. The results suggest that both hot and cool loops of the geometry considered are thermally stable against amplitude perturbations of all kinds.

  1. Study of Transients in an Enrichment Closed Loop

    CERN Document Server

    Fernandino, M

    2002-01-01

    In the present thesis a mathematic model is presented in order to describe the dynamic behavior inside a closed enrichment loop, the latter representing a single stage of an uranium gaseous diffusion enrichment cascade.The analytical model is turned into a numerical model, and implemented through a computational code.For the verification of the model, measurements were taken in an experimental circuit using air as the process fluid.This circuit was instrumented so as to register its characteristic thermohydraulic variables.The measured transients were simulated, comparing the numerical results with the experimental measurements.A good agreement between the characteristic setting times and the thermohydraulic parameters evolution was observed.Besides, other transients of two species separation were numerically analyzed, including setting times of each magnitude, behavior of each one of them during different transients, and redistribution of concentrations.

  2. Study of the fast photoswitching of spin crossover nanoparticles outside and inside their thermal hysteresis loop

    Energy Technology Data Exchange (ETDEWEB)

    Galle, G.; Degert, J.; Freysz, E. [Universite de Bordeaux, LOMA, UMR-CNRS 5798, 351 cours de la Liberation, 33405 Talence Cedex (France); Etrillard, C.; Letard, J.-F. [CNRS, Universite de Bordeaux, ICMCB, UPR CNRS 9048, 87 Avenue du Docteur Albert Schweitzer, 33608 Pessac Cedex (France); Guillaume, F. [Universite de Bordeaux, ISM, UMR CNRS 5255, 351 cours de la Liberation, 33405 Talence Cedex (France)

    2013-02-11

    We have studied the low spin to high spin phase transition induced by nanosecond laser pulses outside and within the thermal hysteresis loop of the [Fe(Htrz){sub 2} trz](BF{sub 4}){sub 2}-H{sub 2}O spin crossover nanoparticles. We demonstrate that, whatever the temperature of the compound, the photo-switching is achieved in less than 12.5 ns. Outside the hysteresis loop, the photo-induced high spin state remains up to 100 {mu}s and then relaxes. Within the thermal hysteresis loop, the photo-induced high spin state remains as long as the temperature of the sample is kept within the thermal loop. A Raman study indicates that the photo-switching can be completed using single laser pulse excitation.

  3. Alternative loop rings

    CERN Document Server

    Goodaire, EG; Polcino Milies, C

    1996-01-01

    For the past ten years, alternative loop rings have intrigued mathematicians from a wide cross-section of modern algebra. As a consequence, the theory of alternative loop rings has grown tremendously. One of the main developments is the complete characterization of loops which have an alternative but not associative, loop ring. Furthermore, there is a very close relationship between the algebraic structures of loop rings and of group rings over 2-groups. Another major topic of research is the study of the unit loop of the integral loop ring. Here the interaction between loop rings and group ri

  4. Alpha resonant scattering for astrophysical reaction studies

    Energy Technology Data Exchange (ETDEWEB)

    Yamaguchi, H.; Kahl, D.; Nakao, T. [Center for Nuclear Study (CNS), University of Tokyo, RIKEN campus, 2-1 Hirosawa, Wako, Saitama 351-0198 (Japan); Wakabayashi, Y.; Kubano, S. [The Institute of Physical and Chemical Research (RIKEN), 2-1 Hirosawa, Wako, Saitama 351-0198 (Japan); Hashimoto, T. [Research Center for Nuclear Physics (RCNP), Osaka University, 10-1 Mihogaoka, Ibaraki, Osaka 567-0047 (Japan); Hayakawa, S. [Istituto Nazionale Fisica Nucleare - Laboratori Nazionali del Sud (INFN-LNS), Via S. Sofia 62, 95125 Catania (Italy); Kawabata, T. [Department of Physics, Kyoto University, Kita-Shirakawa, Kyoto 606-8502 (Japan); Iwasa, N. [Department of Physics, Tohoku University, Aoba, Sendai, Miyagi 980-8578 (Japan); Teranishi, T. [Department of Physics, Kyushu University, 6-10-1 Hakozaki, Fukuoka 812-8581 (Japan); Kwon, Y. K. [Institute for Basic Science, 70, Yuseong-daero 1689-gil, Yuseong-gu, Daejeon 305-811 (Korea, Republic of); Binh, D. N. [30 MeV Cyclotron Center, Tran Hung Dao Hospital, Hoan Kiem District, Hanoi (Viet Nam); Khiem, L. H.; Duy, N. G. [Institute of Physics, Vietnam Academy of Science and Technology, 18 Hong Quoc Viet, Nghia do, Hanoi (Viet Nam)

    2014-05-02

    Several alpha-induced astrophysical reactions have been studied at CRIB (CNS Radioactive Ion Beam separator), which is a low-energy RI beam separator at Center for Nuclear Study (CNS) of the University of Tokyo. One of the methods to study them is the α resonant scattering using the thick-target method in inverse kinematics. Among the recent studies at CRIB, the measurement of {sup 7}Be+α resonant scattering is discussed. Based on the result of the experiment, we evaluated the contributions of high-lying resonances for the {sup 7}Be(α,γ) reaction, and proposed a new cluster band in {sup 11}C.

  5. Quasiparticles in leptogenesis. A hard-thermal-loop study

    Energy Technology Data Exchange (ETDEWEB)

    Kiessig, Clemens Paul

    2011-06-29

    We analyse the effects of thermal quasiparticles in leptogenesis using hard-thermal-loop-resummed propagators in the imaginary time formalism of thermal field theory. We perform our analysis in a leptogenesis toy model with three right-handed heavy neutrinos N{sub 1}, N{sub 2} and N{sub 3}. We consider decays and inverse decays and work in the hierarchical limit where the mass of N{sub 2} is assumed to be much larger than the mass of N{sub 1}, that is M{sub 2} >> M{sub 1}. We neglect flavour effects and assume that the temperatures are much smaller than M{sub 2} and M{sub 3}. We pay special attention to the influence of fermionic quasiparticles. We allow for the leptons to be either decoupled from each other, except for the interactions with neutrinos, or to be in chemical equilibrium by some strong interaction, for example via gauge bosons. In two additional cases, we approximate the full hard-thermal-loop lepton propagators with zero-temperature propagators, where we replace the zero-temperature mass by the thermal mass of the leptons m{sub l}(T) in one case and the asymptotic mass of the positive-helicity mode {radical}(2)m{sub l}(T) in the other case. We calculate all relevant decay rates and CP-asymmetries and solve the corresponding Boltzmann equations we derived. We compare the final lepton asymmetry of the four thermal cases and the vacuum case for three different initial neutrino abundances; zero, thermal and dominant abundance. The final asymmetries of the thermal cases differ considerably from the vacuum case and from each other in the weak washout regime for zero abundance and in the intermediate regime for dominant abundance. In the strong washout regime, where no influences from thermal corrections are commonly expected, the final lepton asymmetry can be enhanced by a factor of two by hiding part of the lepton asymmetry in the quasi-sterile minus-mode in the case of strongly interacting lepton modes. (orig.)

  6. Theoretical studies of chemical reaction dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Schatz, G.C. [Argonne National Laboratory, IL (United States)

    1993-12-01

    This collaborative program with the Theoretical Chemistry Group at Argonne involves theoretical studies of gas phase chemical reactions and related energy transfer and photodissociation processes. Many of the reactions studied are of direct relevance to combustion; others are selected they provide important examples of special dynamical processes, or are of relevance to experimental measurements. Both classical trajectory and quantum reactive scattering methods are used for these studies, and the types of information determined range from thermal rate constants to state to state differential cross sections.

  7. 化学链燃烧反应中LaFe1-xCoxO3载氧体的性能研究%PERFORMANCE STUDY OF LaFe1-xCoxO3 AS OXYGEN CARRIERS IN CHEMICAL-LOOPING COMBUSTION REACTION

    Institute of Scientific and Technical Information of China (English)

    梁皓; 尹泽群; 张喜文; 方向晨

    2013-01-01

    A series of LaFe1-xCoxO3 oxygen carriers with different Co content were prepared by citric acid complex method,and their properties were characterized by thermal analysis,X-ray diffraction,temperature program reduction and scanning electron microscopy.The catalytic performance of the prepared samples was investigated in chemical-looping combustion of CO.XRD results showed that LaFe1-xCoxO3 oxides possessed perovskite-type structure.TPR results indicated that oxidizing ability of LaCoO3 was stronger than that of LaFeO3.Especially,the sequential redox reaction revealed that LaCoO3 oxide exhibits high oxygen delivery capacity after 10 redox cycles,in each cycle the CO conversion is 100%.Also the structure of LaCoO3 oxide didn't change much after 10 cycles besides new network structure which was formed under high temperature.All the results showed that LaCoO3 was suit to be oxygen carrier in chemical-looping combustion owing to its high activity and stability.%采用柠檬酸络合法制备不同Co含量的LaFe1-xCoxO3系列复合氧化物载氧体.采用热分析、X射线衍射(XRD)、程序升温还原(TPR)和扫描电镜等手段对载氧体进行表征,并在化学链燃烧反应中进行性能评价.XRD表征结果表明,不同Co含量的LaFe1xCoxO3均能形成钙钛矿结构.TPR表征结果可以说明LaCoO3中的氧物种氧化能力强于LaFeO3.在连续10次化学链燃烧反应中,燃料CO全部被氧化,这归于LaCoO3持续供氧能力强的特点.LaCoO3循环10次后仍然保持钙钛矿结构不变,而且颗粒没有长大,只是颗粒之间形成了网状结构.通过该实验发现LaCoO3具有高活性和较强的稳定性,适合作化学链燃烧技术的载氧体.

  8. Deconfinement transition in SU(2) Yang-Mills theory: a two-loop study

    CERN Document Server

    Reinosa, U; Tissier, M; Wschebor, N

    2014-01-01

    In a recent work we have proposed a perturbative approach for the study of the phase transition of pure Yang-Mills theories at finite temperature. This is based on a simple massive extension of background field methods in the Landau-DeWitt gauge, where the gluon mass term is related to the existence of Gribov ambiguities. We have shown that a one-loop calculation of the background field effective potential describes well the phase structure of the SU(2) and SU(3) theories. Here, we present the calculation of the next-to-leading order contribution in perturbation theory for the SU(2) case. In particular, we compute the background field effective potential at two-loop order and the corresponding Polyakov loop, a gauge invariant order parameter of the transition, at one-loop order. We show that the two-loop correction brings the critical temperature closer to its actual value as compared to the previous one-loop result. We also compute the thermodynamic pressure as a function of the temperature and show that two...

  9. Molecular beam studies of reaction dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Y.T. [Lawrence Berkeley Laboratory, CA (United States)

    1993-12-01

    The major thrust of this research project is to elucidate detailed dynamics of simple elementary reactions that are theoretically important and to unravel the mechanism of complex chemical reactions or photochemical processes that play important roles in many macroscopic processes. Molecular beams of reactants are used to study individual reactive encounters between molecules or to monitor photodissociation events in a collision-free environment. Most of the information is derived from measurement of the product fragment energy, angular, and state distributions. Recent activities are centered on the mechanisms of elementary chemical reactions involving oxygen atoms with unsaturated hydrocarbons, the dynamics of endothermic substitution reactions, the dependence of the chemical reactivity of electronically excited atoms on the alignment of excited orbitals, the primary photochemical processes of polyatomic molecules, intramolecular energy transfer of chemically activated and locally excited molecules, the energetics of free radicals that are important to combustion processes, the infrared-absorption spectra of carbonium ions and hydrated hydronium ions, and bond-selective photodissociation through electric excitation.

  10. Steam drum level control studies of a natural circulation multi loop reactor

    Energy Technology Data Exchange (ETDEWEB)

    Kumar, Rajesh; Contractor, A.D.; Srivastava, Abhishek; Lele, H.G. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Reactor Safety Div.; Vaze, K.K. [Bhabha Atomic Research Centre, Trombay, Mumbai (India). Reactor Design and Development Group

    2013-12-15

    The proposed heavy water moderated and light water cooled pressure tube type boiling water reactor works on natural circulation at all power levels. It has parallel inter-connected loops with 452 boiling channels in the main heat transport system configuration. These multiple (four) interconnected loops influence the steam drum level control adversely through the common reactor inlet header. Alternate design studies made earlier for efficient control of SD levels have shown favorable results. This has lead to explore further the present scheme with the compartmentalization of CRIH into four compartments catering to four loops separately. The conventional 3-element level control has been found to be working satisfactorily. The interconnections between ECCS header and inlet header compartments have also increased the safety margin for various LOCA and design basis events. The paper deals with the SD level control aspects for this novel MHT configuration which has been analyzed for various PIEs (Postulated Initiating Events) and found to be satisfactory. (orig.)

  11. Spallation reactions studied with 4-detector arrays

    Indian Academy of Sciences (India)

    J Galin

    2001-07-01

    Recently there has been a renewed interest in the study of spallation reactions in basic nuclear physics as well as in potential applications. Spallation reactions induced by light projectiles (protons, antiprotons, pions, etc.) in the GeV range allow the formation of hot nuclei which do not suffer the collective excitations (compression, rotation, deformation) unavoidable when using massive projectiles. Such nuclei provide an ideal testbench for probing their decay as a function of excitation energy. In these investigations, 4-detector arrays for charged particles and neutrons play a major role in the event-by-event sorting according to the excitation energy of the nucleus. Spallation reactions induced on heavy nuclei allow the conversion of the incident GeV proton into several tens of evaporated neutrons. The neutron production in thick targets has been investigated in great detail thanks to the use of high efficiency neutron detector arrays. When scattered on samples of inert or biological materials, these neutrons can be used to study details of the material structure. They could also be utilized for the transmutation of long-lived nuclear wastes or for the feeding of sub-critical nuclear reactors. The role of different types of multi-detector arrays is highlighted in this paper. Several references are also given for different uses of high efficiency neutron detectors in other contexts.

  12. Studying barrier-discharge-stimulated plasmachemical reactions

    Science.gov (United States)

    Malanichev, V. E.; Malashin, M. V.; Moshkunov, S. I.; Nebogatkin, S. V.; Khomich, V. Yu.; Shmelev, V. M.

    2017-05-01

    Barrier-discharge stimulation of chemical reactions has been studied in the case of methane oxidation by atmospheric oxygen with the formation of carbon monoxide and hydrogen. Experiments in a plasmachemical reactor demonstrated the possibility of increasing the yield of synthesis gas (syngas) by means of plasma pretreatment of the initial mixture of air and methane in a 7: 1 ratio at atmospheric pressure. The output-gas composition was determined by gas chromatography. It is established that the plasma-discharge treatment of the initial gas mixture leads to a 15% increase in the amount of syngas at the reactor output and increases the reaction selectivity with respect to hydrogen and carbon monoxide by 3.2 and 6.5%, respectively.

  13. Recycler Reaction for the Government Behavior in Closed-Loop Supply Chain Distribution Network: Based on the System Dynamics

    Directory of Open Access Journals (Sweden)

    Xi gang Yuan

    2015-01-01

    Full Text Available With system dynamics, we establish three-closed-loop supply chain distribution network system model which consists of supplier, manufacturer, two retailers, and products (parts recycler. We proposed that recycler make reflect for the government policy by adjusting the recycling ratio and recycling delay. We use vensim software to simulate this model and investigate how the products (parts recyclers behavior influences the loop supply chain distribution system. The result shows that (1 when recyclers respond positively to government policies, recycling will increase the proportion of recyclers. When recyclers respond negatively to government policy making, recycling will reduce the proportion of recyclers. (2 When the recovery percentage of recyclers improves, manufacturers, Retailer 1, and Retailer 2 quantity fluctuations will reduce and the bullwhip effect will diminish. (3 When the proportion of recycled parts recyclers is lowered, manufacturers, Retailer 1, and Retailer 2 inventory fluctuation will increase and the bullwhip effect will be enhanced. (4 When recyclers recycling product delays increased, volatility manufacturers order quantity will rise, but there is little change in the amount of fluctuation of orders of the two retailers. (5 When recycling parts recyclers delay increases, fluctuations in the supplier order quantity will rise, but there is little change in the amount of fluctuation of orders of the two retailers.

  14. Two-dimensional wetting with binary disorder: a numerical study of the loop statistics

    Science.gov (United States)

    Garel, T.; Monthus, C.

    2005-07-01

    We numerically study the wetting (adsorption) transition of a polymer chain on a disordered substrate in 1+1 dimension. Following the Poland-Scheraga model of DNA denaturation, we use a Fixman-Freire scheme for the entropy of loops. This allows us to consider chain lengths of order N ˜105 to 106, with 104 disorder realizations. Our study is based on the statistics of loops between two contacts with the substrate, from which we define Binder-like parameters: their crossings for various sizes N allow a precise determination of the critical temperature, and their finite size properties yields a crossover exponent φ=1/(2-α) ≃0.5. We then analyse at criticality the distribution of loop length l in both regimes l ˜O(N) and 1 ≪l ≪N, as well as the finite-size properties of the contact density and energy. Our conclusion is that the critical exponents for the thermodynamics are the same as those of the pure case, except for strong logarithmic corrections to scaling. The presence of these logarithmic corrections in the thermodynamics is related to a disorder-dependent logarithmic singularity that appears in the critical loop distribution in the rescaled variable λ=l/N as λ↦1.

  15. Hysteresis loop behaviors of ferroelectric thin films:A Monte Carlo simulation study

    Institute of Scientific and Technical Information of China (English)

    C. M. Bedoya-Hincapi´e; H. H. Ortiz-´Alvarez; E. Restrepo-Parra; J. J. Olaya-Fl´orez; J. E. Alfonso

    2015-01-01

    The ferroelectric response of bismuth titanate Bi4Ti3O12 (BIT) thin film is studied through a Monte Carlo simulation of hysteresis loops. The ferroelectric system is described by using a Diffour Hamiltonian with three terms: the electric field applied in the z direction, the nearest dipole–dipole interaction in the transversal (x–y) direction, and the nearest dipole–dipole interaction in the direction perpendicular to the thin film (the z axis). In the sample construction, we take into consideration the dipole orientations of the monoclinic and orthorhombic structures that can appear in BIT at low temperature in the ferroelectric state. The effects of temperature, stress, and the concentration of pinned dipole defects are assessed by using the hysteresis loops. The results indicate the changes in the hysteresis area with temperature and stress, and the asymmetric hysteresis loops exhibit evidence of the imprint failure mechanism with the emergence of pinned dipolar defects. The simulated shift in the hysteresis loops conforms to the experimental ferroelectric response.

  16. Hysteresis loop behaviors of ferroelectric thin films: A Monte Carlo simulation study

    Science.gov (United States)

    M. Bedoya-Hincapié, C.; H. Ortiz-Álvarez, H.; Restrepo-Parra, E.; J. Olaya-Flórez, J.; E. Alfonso, J.

    2015-11-01

    The ferroelectric response of bismuth titanate Bi4Ti3O12 (BIT) thin film is studied through a Monte Carlo simulation of hysteresis loops. The ferroelectric system is described by using a Diffour Hamiltonian with three terms: the electric field applied in the z direction, the nearest dipole-dipole interaction in the transversal (x-y) direction, and the nearest dipole-dipole interaction in the direction perpendicular to the thin film (the z axis). In the sample construction, we take into consideration the dipole orientations of the monoclinic and orthorhombic structures that can appear in BIT at low temperature in the ferroelectric state. The effects of temperature, stress, and the concentration of pinned dipole defects are assessed by using the hysteresis loops. The results indicate the changes in the hysteresis area with temperature and stress, and the asymmetric hysteresis loops exhibit evidence of the imprint failure mechanism with the emergence of pinned dipolar defects. The simulated shift in the hysteresis loops conforms to the experimental ferroelectric response. Project sponsored by the research departments of the Universidad Nacional de Colombia DIMA and DIB under Project 201010018227-“Crecimiento y caracterización eléctrica y estructural de películas delgadas de BixTiyOz producidas mediante Magnetrón Sputtering” and Project 12920-“Desarrollo teóricoexperimental de nanoestructuras basadas en Bismuto y materiales similares” and “Bisnano Project.”

  17. Catalytic Hydrogenation Reaction of Naringin-Chalcone. Study of the Electrochemical Reaction

    Directory of Open Access Journals (Sweden)

    B. A. López de Mishima

    2000-03-01

    Full Text Available The electrocatalytic hydrogenation reaction of naringin derivated chalcone is studied. The reaction is carried out with different catalysts in order to compare with the classic catalytic hydrogenation.

  18. Loop L1 governs the DNA-binding specificity and order for RecA-catalyzed reactions in homologous recombination and DNA repair

    Science.gov (United States)

    Shinohara, Takeshi; Ikawa, Shukuko; Iwasaki, Wakana; Hiraki, Toshiki; Hikima, Takaaki; Mikawa, Tsutomu; Arai, Naoto; Kamiya, Nobuo; Shibata, Takehiko

    2015-01-01

    In all organisms, RecA-family recombinases catalyze homologous joint formation in homologous genetic recombination, which is essential for genome stability and diversification. In homologous joint formation, ATP-bound RecA/Rad51-recombinases first bind single-stranded DNA at its primary site and then interact with double-stranded DNA at another site. The underlying reason and the regulatory mechanism for this conserved binding order remain unknown. A comparison of the loop L1 structures in a DNA-free RecA crystal that we originally determined and in the reported DNA-bound active RecA crystals suggested that the aspartate at position 161 in loop L1 in DNA-free RecA prevented double-stranded, but not single-stranded, DNA-binding to the primary site. This was confirmed by the effects of the Ala-replacement of Asp-161 (D161A), analyzed directly by gel-mobility shift assays and indirectly by DNA-dependent ATPase activity and SOS repressor cleavage. When RecA/Rad51-recombinases interact with double-stranded DNA before single-stranded DNA, homologous joint-formation is suppressed, likely by forming a dead-end product. We found that the D161A-replacement reduced this suppression, probably by allowing double-stranded DNA to bind preferentially and reversibly to the primary site. Thus, Asp-161 in the flexible loop L1 of wild-type RecA determines the preference for single-stranded DNA-binding to the primary site and regulates the DNA-binding order in RecA-catalyzed recombinase reactions. PMID:25561575

  19. Cosmic string loop shapes

    CERN Document Server

    Blanco-Pillado, Jose J; Shlaer, Benjamin

    2015-01-01

    We analyze the shapes of cosmic string loops found in large-scale simulations of an expanding-universe string network. The simulation does not include gravitational back reaction, but we model that process by smoothing the loop using Lorentzian convolution. We find that loops at formation consist of generally straight segments separated by kinks. We do not see cusps or any cusp-like structure at the scale of the entire loop, although we do see very small regions of string that move with large Lorentz boosts. However, smoothing of the string almost always introduces two cusps on each loop. The smoothing process does not lead to any significant fragmentation of loops that were in non-self-intersecting trajectories before smoothing.

  20. Why Isn't Looping a More Common Practice? A Leadership Case Study

    Science.gov (United States)

    Ovalle, Robert A.

    2004-01-01

    One alternative to a traditional class is a looping class. What is "looping"? As described in the educational literature, looping is a practice that allows teachers to remain with their class for a period of two or more years. Looping has proved to be an effective process that increases student achievement, supports instructional time, and…

  1. Giardia and Cryptosporidium spp. dissemination during wastewater treatment and comparative detection via immunofluorescence assay (IFA), nested polymerase chain reaction (nested PCR) and loop mediated isothermal amplification (LAMP).

    Science.gov (United States)

    Gallas-Lindemann, Carmen; Sotiriadou, Isaia; Plutzer, Judit; Noack, Michael J; Mahmoudi, Mohammad Reza; Karanis, Panagiotis

    2016-06-01

    Environmental water samples from the Lower Rhine area in Germany were investigated via immunofluorescence assays (IFAs), nested polymerase chain reaction (nested PCR) and loop-mediated isothermal amplification (LAMP) to detect the presence of Giardia spp. (n=185) and Cryptosporidium spp. (n=227). The samples were concentrated through filtration or flocculation, and oocysts were purified via centrifugation through a sucrose density gradient. For all samples, IFA was performed first, followed by DNA extraction for the nested PCR and LAMP assays. Giardia cysts were detected in 105 samples (56.8%) by IFA, 62 samples (33.5%) by nested PCR and 79 samples (42.7%) by LAMP. Cryptosporidium spp. were detected in 69 samples (30.4%) by IFA, 95 samples (41.9%) by nested PCR and 99 samples (43.6%) by LAMP. According to these results, the three detection methods are complementary for monitoring Giardia and Cryptosporidium in environmental waters.

  2. Closed-loop controller for chest compressions based on coronary perfusion pressure: a computer simulation study.

    Science.gov (United States)

    Wang, Chunfei; Zhang, Guang; Wu, Taihu; Zhan, Ningbo; Wang, Yaling

    2016-03-01

    High-quality cardiopulmonary resuscitation contributes to cardiac arrest survival. The traditional chest compression (CC) standard, which neglects individual differences, uses unified standards for compression depth and compression rate in practice. In this study, an effective and personalized CC method for automatic mechanical compression devices is provided. We rebuild Charles F. Babbs' human circulation model with a coronary perfusion pressure (CPP) simulation module and propose a closed-loop controller based on a fuzzy control algorithm for CCs, which adjusts the CC depth according to the CPP. Compared with a traditional proportion-integration-differentiation (PID) controller, the performance of the fuzzy controller is evaluated in computer simulation studies. The simulation results demonstrate that the fuzzy closed-loop controller results in shorter regulation time, fewer oscillations and smaller overshoot than traditional PID controllers and outperforms the traditional PID controller for CPP regulation and maintenance.

  3. An Analytical and Experimental Study of a Natural Circulation Loop with Horizontal Heating Section

    Institute of Scientific and Technical Information of China (English)

    YinxueSu; QingjinWu

    1994-01-01

    The thermal performance of a rectangular loop with a horizontal heating segment and a partly cooling vertical leg is studied.By one-dimensional approach,traditional friction factor and empirical correlation,a modified Grashof number Gr* which turns out to be very important in the description of circulation flow is introduced .A new correlation for Nusselt number of the horizontal heater is obtained and the comparison with experimental values shows good agreement.

  4. A study on sodium-concrete reaction

    Energy Technology Data Exchange (ETDEWEB)

    Bae, Jae Heum; Min, Byong Hun [Suwon University, Suwon (Korea, Republic of)

    1997-07-01

    A small sodium-concrete reaction facility was designed, manufactured and installed. this facility has been operated under inert gas(N{sub 2}) with different experimental variables such as sodium injection temperature, injection amount of sodium, aging period of concrete, sodium reservoir temperature. As a result, it was found that sodium injection temperature and injected amount of sodium has little effect on sodium-concrete reaction. However, sodium reservoir temperature and aging period of concrete has relatively high impact on sodium-concrete reaction. Sodium-concrete reaction model has also been developed and compared with experimental results. (Author) 51 refs., 16 tabs., 64 figs.

  5. The importance of hinge sequence for loop function and catalytic activity in the reaction catalyzed by triosephosphate isomerase.

    Science.gov (United States)

    Xiang, J; Sun, J; Sampson, N S

    2001-04-01

    We have determined the sequence requirements for the N-terminal protein hinge of the active-site lid of triosephosphate isomerase. The codons for the hinge (PVW) were replaced with a genetic library of all possible 8000 amino acid combinations. The most active of these 8000 mutants were selected using in vivo complementation of a triosephosphate isomerase-deficient strain of Escherichia coli, DF502. Approximately 0.3 % of the mutants complement DF502 with an activity that is between 10 and 70 % of wild-type activity. They all contain Pro at the first position. Furthermore, the sequences of these hinge mutants reveal that hydrophobic packing is very important for efficient formation of the enediol intermediate. However, the reduced catalytic activities observed are not due to increased rates of loop opening. To explore the relationship between the N-terminal and C-terminal hinges, three semi-active mutants from the N-terminal hinge selection experiment (PLH, PHS and PTF), and six active C-terminal hinge mutants from previous work (NSS, LWA, YSL, KTK, NPN, KVA) were combined to form 18 "double-hinge" mutants. The activities of these mutants suggest that the N-terminal and C-terminal hinge structures affect one another. It appears that specific side-chain interactions are important for forming a catalytically active enzyme, but not for preventing release of the unstable enediol intermediate from the active site of the enzyme. The independence of intermediate release on amino acid sequence is consistent with the absence of a "universal" hinge sequence in structurally related enzymes.

  6. Study on Disproportionation Reaction of FCC Gasoline on Acid Catalyst

    Institute of Scientific and Technical Information of China (English)

    Xu Youhao; Wang Xieqing

    2004-01-01

    Based on the experimental data relating to the reaction of FCC gasoline on acid catalyst the analysis of product distribution, and composition of gasoline and diesel fractions have been analyzed. The occurrence of disproportionation reaction of FCC gasoline on acid catalyst and the network of disproportionation reaction have been identified. Study has also shown that different reaction temperatures can result in different pathways of disproportionation reactions on acid catalyst.

  7. Small intestinal mucosal injury in the experimental blind loop syndrome. Light- and electron-microscopic and histochemical studies.

    Science.gov (United States)

    Toskes, P P; Giannella, R A; Jervis, H R; Rout, W R; Takeuchi, A

    1975-05-01

    Microscopic (light and electron) and histochemical abnormalities have been demonstrated in the jejunum of rats with the blind loop syndrome. Three groups of animals were studied: normal control animals, and animals with either self-filling (SF) or self-emptying (SE) blind loops. Vitamin B12 malabsorption and bacterial overgrowth occurred only in those animals with SF blind loops. Three jejunal segments were studied: the blind loop segment and the jejunal segments proximal and distal to the blind loop. In the animals with the blind loop syndrome, those with SF blind loops, the most striking findings occurred in the blind loop itself, with similar but less marked changes in the jejunum distal but not proximal to the blind loop segment. Hypertrophy of both crypts and villi was evident with focal abnormalities of villus architecture. Approximately 10 to 20% of the columnar cells in the upper half of the villi were swollen and vesiculated. By electron microscopy microvilli demonstrated a variety of degeneration changes and the glycocalyx and terminal web were disrupted. Mitochondria and endoplasmic reticulum (ER), both smooth and rough, were swollen. Concentric whorls of parallel membranes and long, curvilinear rough ER were present in the cytoplasm. Histochemically, there was loss of enzymatic activity in the epithelial brush border, mitochondria and ER. Inasmuch as bacterial invasion of the jejunal mucosa was not seen, the etiology of these changes is not known but may involve bacterial "toxins" or products of bacterial metabolism. These morphological observations demonstrate that both brush border and intracellular injury occur in the jejunal epithelial cell of rats with the experimental blind loop syndrome.

  8. Worm Monte Carlo study of the honeycomb-lattice loop model

    Energy Technology Data Exchange (ETDEWEB)

    Liu Qingquan, E-mail: liuqq@mail.ustc.edu.c [Hefei National Laboratory for Physical Sciences at Microscale, Department of Modern Physics, University of Science and Technology of China, Hefei, 230027 (China); Deng Youjin, E-mail: yjdeng@ustc.edu.c [Hefei National Laboratory for Physical Sciences at Microscale, Department of Modern Physics, University of Science and Technology of China, Hefei, 230027 (China); Garoni, Timothy M., E-mail: t.garoni@ms.unimelb.edu.a [ARC Centre of Excellence for Mathematics and Statistics of Complex Systems, Department of Mathematics and Statistics, University of Melbourne, Victoria 3010 (Australia)

    2011-05-11

    We present a Markov-chain Monte Carlo algorithm of worm type that correctly simulates the O(n) loop model on any (finite and connected) bipartite cubic graph, for any real n>0, and any edge weight, including the fully-packed limit of infinite edge weight. Furthermore, we prove rigorously that the algorithm is ergodic and has the correct stationary distribution. We emphasize that by using known exact mappings when n=2, this algorithm can be used to simulate a number of zero-temperature Potts antiferromagnets for which the Wang-Swendsen-Kotecky cluster algorithm is non-ergodic, including the 3-state model on the kagome lattice and the 4-state model on the triangular lattice. We then use this worm algorithm to perform a systematic study of the honeycomb-lattice loop model as a function of n{<=}2, on the critical line and in the densely-packed and fully-packed phases. By comparing our numerical results with Coulomb gas theory, we identify a set of exact expressions for scaling exponents governing some fundamental geometric and dynamic observables. In particular, we show that for all n{<=}2, the scaling of a certain return time in the worm dynamics is governed by the magnetic dimension of the loop model, thus providing a concrete dynamical interpretation of this exponent. The case n>2 is also considered, and we confirm the existence of a phase transition in the 3-state Potts universality class that was recently observed via numerical transfer matrix calculations.

  9. Numerical Study of Eddy Shedding By The Loop Current With Ogcm

    Science.gov (United States)

    Tanahara, S.; Crèpon, M.

    The high resolution CLIPPER model for the Atlantic Ocean running at 1/6o was used to study the dynamic of the Gulf of Mexico. The model was daily forced with the ECMWF re-analysis air-sea fluxes during 20 years. A spin-up phase of 10 years is done in the experience. The results show the formation of the Loop Current in the interior of the Gulf of Mexico. This loop detach an anticyclonic eddy northward to Yucatan shelf Peninsula. The size of the eddy is close to 290 Km and 1000 m depth. The eddy shedding periodicity is between 7 to 9 months for the 5 first years of numer- ical forcing simulation. After that, the eddy shedding is blocked and an intensification and deepening of the loop happens. It is found that barotropic transport through Yu- catan channel and vertical structure of cross velocity's Yucatan current are important for eddy shedding process. A hypothesis for the generation and blocking of westward propagation of eddies in the Gulf of Mexico is proposed according to the numerical results.

  10. Coulomb dissociation studies for astrophysical thermonuclear reactions

    Energy Technology Data Exchange (ETDEWEB)

    Motobayashi, T. [Dept. of Physics, Rikkyo Univ., Toshima, Tokyo (Japan)

    1998-06-01

    The Coulomb dissociation method was applied to several radiative capture processes of astrophysical interest. The method has an advantage of high experimental efficiency, which allow measurements with radioactive nuclear beams. The reactions {sup 13}N(p,{gamma}){sup 14}O and {sup 7}Be(p,{gamma}){sup 8}B are mainly discussed. They are the key reaction in the hot CNO cycle in massive stars and the one closely related to the solar neutrino problem, respectively. (orig.)

  11. Feasibility study of sulfates as oxygen carriers for chemical looping processes

    Directory of Open Access Journals (Sweden)

    Ganesh Kale

    2012-12-01

    Full Text Available The operational feasibility temperature range of chemical looping combustion (CLC and chemical looping reforming (CLR of the fuels methane, propane, iso-octane and ethanol was explored using the common sulphates

  12. The anterior loop of the inferior alveolar nerve. A radiographic study of panoramic radiographs and review of the literature.

    Directory of Open Access Journals (Sweden)

    Konstantinos VLASTOS

    2014-04-01

    Full Text Available The inferior alveolar nerve sometimes extends anteriorly beyond the mental foramen and runs outward, upward and backward before it reaches the mental foramen, creating what is known as the anterior loop. Placement of dental implants in this area, has a high risk of injury to the inferior alveolar nerve. Aim: This study seeks to investigate the visualization of the anterior loop on panoramic radiographs. Material and methods: 100 panoramic radiographs were analysed in terms of loop visualization. Results: Anterior loop was observed in 34% of the radiographs. Its prevalence was higher in males (70.5% and in patients between 40-60 years old (47%. In most cases the loop was located bilaterally (64.7%, while the interforaminal area was mostly edentulous (64.7%. The loop length ranged between 0.5-8 mm, with an average length of 4.37mm. Conclusions: An analysis of the findings shows that implants should be placed at least 5-8mm anteriorly to the mental foramen. According to a review of the literature, computed tomography is more accurate than panoramic radiography in identifying the anterior loop.

  13. Matlab Based Human & Hardware-in-Loop Simulation for the Study on Vehicle Stability Control

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    This paper described an effective method to implement human & hardware in the loop simulation (HHILS), which is based on MATLAB system and can be used to study human driving actions in the abrupt situation and vehicle stability control(VSC). A hybrid control algorithm, which makes full use of the advantages of robust control and fuzzy logic, was adopted in VSC system. The results of HHILS show that HHILS' application on the vehicle handling and VSC resarch is feasible. These results also confirm that the handling performance of the vehicle with VSC is improved obviously compared to the vehicle without VSC.

  14. Study of Tachyon Warm Intermediate and Logamediate Inflationary Universe from Loop Quantum Cosmological Perspective

    Science.gov (United States)

    Das Mandal, Jyotirmay; Debnath, Ujjal

    2016-08-01

    We have studied the tachyon intermediate and logamediate warm inflation in loop quantum cosmological background by taking the dissipative co-efficient Γ = Γ0 (where Γ0 is a constant) in “intermediate” inflation and Γ = V(ϕ), (where V(ϕ) is the potential of tachyonic field) in “logamediate” inflation. We have assumed slow-roll condition to construct scalar field ϕ, potential V, N-folds, etc. Various slow-roll parameters have also been obtained. We have analyzed the stability of this model through graphical representations.

  15. Fuzzy control for closed-loop, patient-specific hypnosis in intraoperative patients: a simulation study.

    Science.gov (United States)

    Moore, Brett L; Pyeatt, Larry D; Doufas, Anthony G

    2009-01-01

    Research has demonstrated the efficacy of closed-loop control of anesthesia using bispectral index (BIS) as the controlled variable, and the recent development of model-based, patient-adaptive systems has considerably improved anesthetic control. To further explore the use of model-based control in anesthesia, we investigated the application of fuzzy control in the delivery of patient-specific propofol-induced hypnosis. In simulated intraoperative patients, the fuzzy controller demonstrated clinically acceptable performance, suggesting that further study is warranted.

  16. Kinetic Study of the Heck Reaction: An Interdisciplinary Experiment

    Science.gov (United States)

    Gozzi, Christel; Bouzidi, Naoual

    2008-01-01

    The aim of this experiment is to study and calculate the kinetic constant of a Heck reaction: the arylation of but-3-en-2-ol by iodobenzene catalyzed by palladium acetate in presence of triethylamine in DMF. The reaction leads to a mixture of two ketones. Students use GC analysis to quantify reagents and products of reaction. They control the…

  17. Study of Reaction Mechanism in Tracer Munitions

    Science.gov (United States)

    1974-12-01

    Regression Rates (Furnished by Frankford Arsenal) 35 13 Calculated Heat Fluxes and Energy Partitions 43 4 I NOMENCLATURE B = preexponential factor... anhydride disproportionates in a fast step: N2 0 3 - 2 + NO (4) so that the resulting dioxide can react with more nitrite in another fast reaction: Sr

  18. Atrial fibrillation detected by continuous electrocardiographic monitoring using implantable loop recorder to prevent stroke in individuals at risk (The LOOP study)

    DEFF Research Database (Denmark)

    Diederichsen, Søren Zöga; Haugan, Ketil Jørgen; Køber, Lars

    2017-01-01

    Atrial fibrillation (AF) increases the rate of stroke 5-fold, and AF-related strokes have a poorer prognosis compared with non-AF-related strokes. Atrial fibrillation and stroke constitute an intensifying challenge, and health care organizations are calling for awareness on the topic. Previous...... anticoagulation will be initiated according to guidelines. Expected follow-up is 4years. The primary end point is time to stroke or systemic embolism, whereas secondary end points include time to AF diagnosis and death. CONCLUSION: The LOOP study will evaluate health benefits and cost-effectiveness of ILR...

  19. Adverse reactions to intravenous iodinated contrast media: a prospective study

    Directory of Open Access Journals (Sweden)

    Dhruv J. Modi

    2012-06-01

    Full Text Available Background: Adverse reactions to intravenous iodinated contrast media may be classified as general and organ-specific, such as contrast-induced nephrotoxicity. General adverse reactions may be sub classified into acute and delayed types. Acute general adverse reactions can range from transient minor reactions to life-threatening severe reactions. This study was done to determine clinical adverse effects of the iodinated contrast media. Methods: Data of 899 consecutive patients at C.U. Shah Medical College and Hospital, Surendranagar, who received sodium meglumine diatrizoate intravenous iodinated contrast media during the period of May 2011 to April 2012, were collected for any adverse drug reactions. Results: Out of 899, 189 patients developed adverse contrast reactions. The incidences of mild, moderate and severe adverse reactions were 19.47%, 1.33% and 0.28%, respectively. There were no differences in the incidence of adverse reactions according to gender (males 21.1%; females 20.7%; p= >0.05 or age (p= >0.05. The incidence of adverse reactions was significantly higher in patients with a history of previous reactions (50% than in those with no history (21.25%; p= <0.05. Conclusions: The skin was the most commonly affected site of reactions. In reactions, mild forms were more common compared to moderate and severe. [Int J Basic Clin Pharmacol 2012; 1(3.000: 211-215

  20. Stopped-in-loop flow analysis system for successive determination of trace vanadium and iron in drinking water using their catalytic reactions.

    Science.gov (United States)

    Ayala Quezada, Alejandro; Ohara, Keisuke; Ratanawimarnwong, Nuanlaor; Nacapricha, Duangjai; Murakami, Hiroya; Teshima, Norio; Sakai, Tadao

    2015-11-01

    An automated stopped-in-loop flow analysis (SILFA) system is proposed for the successive catalytic determination of vanadium and iron. The determination of vanadium was based on the p-anisidine oxidation by potassium bromate in the presence of Tiron as an activator to form a reddish dye, which has an absorption maximum at 510 nm. The selectivity of the vanadium determination was greatly improved by adding diphosphate as a masking agent of iron. For the iron determination, an iron-catalyzed oxidative reaction of p-anisidine by hydrogen peroxide with 1,10-phenanthroline as an activator to produce a reddish dye (510 nm) was employed. The SILFA system consisted of two peristaltic pumps, two six-port injection valves, a four-port selection valve, a heater device, a spectrophotometric detector and a data acquisition device. One six-port injection valve was used for the isolation of a mixed solution of standard/sample and reagent to promote each catalytic reaction, and another six-port injection valve was used for switching the reagent for vanadium or iron to achieve selective determination of each analyte. The above mentioned four-port selection valve was used to select standard solutions or sample. These three valves and the two peristaltic pumps were controlled by a built-in programmable logic controller in a touchscreen controller. The obtained results showed that the proposed SILFA monitoring system constituted an effective approach for the selective determination of vanadium and iron. The limits of detection, 0.052 and 0.55 µg L(-1), were obtained for vanadium and iron, respectively. The proposed system was successfully applied to drinking water samples without any preconcentration procedures.

  1. Numerical study of large-N phase transition of smeared Wilson loops in 4D pure YM theory

    CERN Document Server

    Lohmayer, Robert

    2011-01-01

    In Euclidean four-dimensional SU(N) pure gauge theory, eigenvalue distributions of Wilson loop parallel transport matrices around closed spacetime curves show non-analytic behavior (a 'large-N phase transition') at a critical size of the curve. We focus mainly on an observable composed of traces of the Wilson loop operator in all totally antisymmetric representations, which is regularized with the help of smearing. By studying sequences of square Wilson loops on a hypercubic lattice with standard Wilson action, it is shown that this observable has a nontrivial continuum limit as a function of the physical size of the loop. We furthermore present (preliminary) numerical results confirming that, for large N, the N dependence in the critical regime is governed by the universal exponents 1/2 and 3/4 as expected (Burgers universality).

  2. Laboratory Scale Study of Activated Sludge Process in Jet Loop Reactor for Waste WaterTreatment

    Directory of Open Access Journals (Sweden)

    M. S. Patil

    2014-03-01

    Full Text Available The present study was undertaken to evaluate the feasibility of Activated Sludge Process (ASP for the treatment of synthetic wastewater and to develop a simple design criteria under local conditions.A laboratory scale Compact jet loop reactor model comprising of an aeration tank and final clarifier was used for this purpose.Settled synthetic wastewater was used as influent to the aeration tank. The Chemical Oxygen Demand (COD of the influent and effluent was measured to find process efficiency at various mixed liquorvolatile suspended solids (MLVSS and hydraulic retention time (θ. The results of the studydemonstrated that an efficiency of above 95% could be obtained for COD if the ASP is operated atan MLVSS concentration of 3000 mg/L keeping an aeration time of 1 hour.In the present investigation the preliminary studies were carried out in a lab scale Jet loop reactor made of glass. Synthetic waste water having a composition of 1000 mg/L mixed with other nutrients such as Urea, Primary and secondary Potassium phosphates, Magnesium sulfate, Iron chloriderequired for the bacteria was prepared in the laboratory and reduction in COD and the increase inSuspended Solids (SSand the Sludge Volume Index (SVI were determined.

  3. Study on a Closed-Loop Air-Fuel Control System of Gasoline Engines by Simulation

    Institute of Scientific and Technical Information of China (English)

    张付军; 赵长禄; 黄英; 郝利军

    2003-01-01

    In order to study the factors that influence the air-fuel ratio(A/F), the amplitude and frequency of A/F fluctuation, to reform the control strategy, and to improve the efficiency of three-way catalyst(TWC), a model of closed-loop control system including the engine, air-fuel mixing and transportation, oxygen sensor and controller, etc., is developed. Various factors that influence the A/F control are studied by simulation. The simulation results show that the reference voltage of oxygen sensor will influence the mean value of A/F ratio, the controller parameters will influence the amplitude of A/F fluctuation, and the operating conditions of the engine determine the frequency of A/F fluctuations, the amplitude of A/F fluctuation can be reduced to within demanded values by logical selection of the signal acquisition method and controller parameters. Higher A/F fluctuation frequency under high speed and load can be reduced through software delay in the controller. The A/F closed-loop control system based on the simulation results, accompanied with a rare-earth element TWC, gives a better efficiency of conversion against harmful emissions.

  4. Structural and Functional Studies on the Marburg Virus GP2 Fusion Loop.

    Science.gov (United States)

    Liu, Nina; Tao, Yisong; Brenowitz, Michael D; Girvin, Mark E; Lai, Jonathan R

    2015-10-01

    Marburg virus (MARV) and the ebolaviruses belong to the family Filoviridae (the members of which are filoviruses) that cause severe hemorrhagic fever. Infection requires fusion of the host and viral membranes, a process that occurs in the host cell endosomal compartment and is facilitated by the envelope glycoprotein fusion subunit, GP2. The N-terminal fusion loop (FL) of GP2 is a hydrophobic disulfide-bonded loop that is postulated to insert and disrupt the host endosomal membrane during fusion. Here, we describe the first structural and functional studies of a protein corresponding to the MARV GP2 FL. We found that this protein undergoes a pH-dependent conformational change, as monitored by circular dichroism and nuclear magnetic resonance. Furthermore, we report that, under low pH conditions, the MARV GP2 FL can induce content leakage from liposomes. The general aspects of this pH-dependent structure and lipid-perturbing behavior are consistent with previous reports on Ebola virus GP2 FL. However, nuclear magnetic resonance studies in lipid bicelles and mutational analysis indicate differences in structure exist between MARV and Ebola virus GP2 FL. These results provide new insight into the mechanism of MARV GP2-mediated cell entry.

  5. Structural Dynamics of Human Telomeric G-Quadruplex Loops Studied by Molecular Dynamics Simulations

    Science.gov (United States)

    Zhu, Hong; Xiao, Shiyan; Liang, Haojun

    2013-01-01

    Loops which are linkers connecting G-strands and supporting the G-tetrad core in G-quadruplex are important for biological roles of G-quadruplexes. TTA loop is a common sequence which mainly resides in human telomeric DNA (hTel) G-quadruplex. A series of molecular dynamics (MD) simulations were carried out to investigate the structural dynamics of TTA loops. We found that (1) the TA base pair formed in TTA loops are very stable, the occupied of all hydrogen bonds are more than 0.95. (2) The TA base pair makes the adjacent G-quartet more stable than others. (3) For the edgewise loop and the diagonal loop, most loop bases are stacking with others, only few bases have considerable freedom. (4) The stabilities of these stacking structures are distinct. Part of the loops, especially TA base pairs, and bases stacking with the G-quartet, maintain certain stable conformations in the simulation, but other parts, like TT and TA stacking structures, are not stable enough. For the first time, spontaneous conformational switches of TTA edgewise loops were observed in our long time MD simulations. (5) For double chain reversal loop, it is really hard to maintain a stable conformation in the long time simulation under present force fields (parm99 and parmbsc0), as it has multiple conformations with similar free energies. PMID:23951152

  6. Structural dynamics of human telomeric G-quadruplex loops studied by molecular dynamics simulations.

    Directory of Open Access Journals (Sweden)

    Hong Zhu

    Full Text Available Loops which are linkers connecting G-strands and supporting the G-tetrad core in G-quadruplex are important for biological roles of G-quadruplexes. TTA loop is a common sequence which mainly resides in human telomeric DNA (hTel G-quadruplex. A series of molecular dynamics (MD simulations were carried out to investigate the structural dynamics of TTA loops. We found that (1 the TA base pair formed in TTA loops are very stable, the occupied of all hydrogen bonds are more than 0.95. (2 The TA base pair makes the adjacent G-quartet more stable than others. (3 For the edgewise loop and the diagonal loop, most loop bases are stacking with others, only few bases have considerable freedom. (4 The stabilities of these stacking structures are distinct. Part of the loops, especially TA base pairs, and bases stacking with the G-quartet, maintain certain stable conformations in the simulation, but other parts, like TT and TA stacking structures, are not stable enough. For the first time, spontaneous conformational switches of TTA edgewise loops were observed in our long time MD simulations. (5 For double chain reversal loop, it is really hard to maintain a stable conformation in the long time simulation under present force fields (parm99 and parmbsc0, as it has multiple conformations with similar free energies.

  7. Transient analysis of subcritical/supercritical carbon dioxide based natural circulation loop with end heat exchangers: experimental study

    Science.gov (United States)

    Yadav, Ajay Kumar; Ramgopal, Maddali; Bhattacharyya, Souvik

    2017-09-01

    Carbon dioxide (CO2) based natural circulation loops (NCLs) has gained attention due to its compactness with higher heat transfer rate. In the present study, experimental investigations have been carried out to capture the transient behaviour of a CO2 based NCL operating under subcritical as well as supercritical conditions. Water is used as the external fluid in cold and hot heat exchangers. Results are obtained for various inlet temperatures (323-353 K) of water in the hot heat exchanger and a fixed inlet temperature (305 K) of cooling water in the cold heat exchanger. Effect of loop operating pressure (50-90 bar) on system performance is also investigated. Effect of loop tilt in two different planes (XY and YZ) is also studied in terms of transient as well as steady state behaviour of the loop. Results show that the time required to attain steady state decreases as operating pressure of the loop increases. It is also observed that the change in temperature of loop fluid (CO2) across hot or cold heat exchanger decreases as operating pressure increases.

  8. Design Study of Supercritical CO{sub 2} Integral Experiment Loop (SCIEL)

    Energy Technology Data Exchange (ETDEWEB)

    Ahn, Yoonhan; Lee, Jaekyoung; Lee, Jeong Ik [Korea Adavanced Institute of Science and Technology, Daejeon (Korea, Republic of); Cha, Jae Eun [Korean Atomic Energy Research Institute, Daejeon (Korea, Republic of)

    2014-05-15

    As the global warming becomes more substantial, the development of highly efficient power conversion system gains a lot of interests to reduce CO{sub 2} emission. Supercritical CO{sub 2} (S-CO{sub 2}) cycle is considered as one of the promising candidates due to the competitive efficiency in the mild turbine inlet temperature range, and the compact footprint with compact turbomachinery and heat exchangers. With these advantages, S-CO{sub 2} cycle can be utilized as the power conversion system of fossil power, advanced nuclear reactor, renewable energy system and a bottoming cycle for gas turbine or high temperature fuel cell, as well. In addition, the S-CO{sub 2} cycle is considered as the alternative power conversion system of a Sodium-cooled Fast Reactor (SFR) as the violent Sodium-Water Reaction (SWR) can be replaced with the mild Sodium-CO{sub 2} Reaction (SCR). To demonstrate the S-CO{sub 2} cycle performance, the integral test facilities were constructed and the operational results were reported by several countries. The development of S-CO{sub 2} cycle can be utilized as the power conversion system including the fossil power, next generation nuclear reactor, and concentrated solar power systems as the cycle efficiency is high in the mild turbine inlet temperature range (450-650 .deg. C) and the layout is simple with the physically compact system size. To demonstrate the S-CO{sub 2} cycle performance, Supercritical CO{sub 2} Integral Experiment Loop (SCIEL) has been under development by the joint research team of KAERI, KAIST and POSTECH. The final layout of SCIEL is recuperated cycle with a double stage of compression and expansion to achieve 2.57 pressure ratio. Considering the temperature difference limit of PCHE, a series of recuperation process is utilized.

  9. Solar Corona Loop Studies with AIA: I. Cross-Sectional Temperature Structure

    CERN Document Server

    Aschwanden, Markus J

    2011-01-01

    We present a first systematic study on the cross-sectional temperature structure of coronal loops using the six coronal temperature filters of the Atmospheric Imaging Assembly (AIA) instrument on the Solar Dynamics Observatory (SDO). We analyze a sample of 100 loop snapshots measured at 10 different locations and 10 different times in active region NOAA 11089 on 2010 July 24, 21:00-22:00 UT. The cross-sectional flux profiles are measured and a cospatial background is subtracted in 6 filters in a temperature range of $T \\approx 0.5-16$ MK, and 4 different parameterizations of differential emission measure (DEM) distributions are fitted. We find that the reconstructed DEMs consist predominantly of narrowband peak temperature components with a thermal width of $\\sigma_{log(T)} \\le 0.11\\pm0.02$, close to the temperature resolution limit of the instrument, consistent with earlier triple-filter analysis from TRACE by Aschwanden and Nightingale (2005) and from EIS/Hinode by Warren et al. (2008) or Tripathi et al. (2...

  10. Studies on different iron source absorption by in situ ligated intestinal loops of broilers.

    Science.gov (United States)

    Jia, Y F; Jiang, M M; Sun, J; Shi, R B; Liu, D S

    2015-02-01

    The objective of this study was to investigate the iron source absorption in the small intestine of broiler. In situ ligated intestinal loops of 70 birds were poured into one of seven solutions, including inorganic iron (FeSO4, Fe2(SO4)3), organic Fe glycine chelate (Fe-Gly(II), Fe-Gly(III)), the mixtures (FeSO4 with glycine (Fe+Gly(II)), Fe2(SO4)3 with glycine (Fe+Gly(III)), and no Fe source (control). The total volume of 3-mL solution (containing 1 mg of elemental Fe) was injected into intestinal loops, and then 120-min incubation was performed. Compared with inorganic iron groups, in which higher FeSO4 absorption than Fe2(SO4)3 was observed, supplementation with organic Fe glycine chelate significantly increased the Fe concentration in the duodenum and jejunum (P small intestine. Those results indicated that the absorption of organic Fe glycine chelate was more effective than that of inorganic Fe, and the orders of iron absorption in the small intestine were: Fe-Gly(II), Fe-Gly(III) > FeSO4, Fe+Gly(II) > Fe2(SO4)3, Fe+Gly(III). Additionally, the simple mixture of inorganic iron and glycine could not increase Fe absorption, and the duodenum was the main site of Fe absorption in the intestines of broilers and the ileum absorbed iron rarely.

  11. An experimental study of the dual-loop control of electro-hydraulic load simulator (EHLS)

    Institute of Scientific and Technical Information of China (English)

    Wang Chengwen; Jiao Zongxia; Wu Shuai; Shang Yaoxing

    2013-01-01

    This paper investigates motion coupling disturbance (the so called surplus torque) in the hardware-in-the-loop (HIL) experiments. The‘‘velocity synchronization scheme’’ was proposed by Jiao for an electro-hydraulic load simulator (EHLS) in 2004. In some situations, however, the scheme is limited in the implementation for certain reasons, as is the case when the actuator’s valve signal is not available or it is seriously polluted by noise. To solve these problems, a ‘‘dual-loop scheme’’ is developed for EHLS. The dual-loop scheme is a combination of a torque loop and a position synchronization loop. The role of the position synchronization loop is to decouple the motion disturbance caused by the actuator system. To verify the feasibility and effectiveness of the proposed scheme, extensive simulations are performed using AMESim. Then, the performance of the developed method is validated by experiments.

  12. Linearized broadband optical detector: study and implementation of optical phase-locked loop

    Science.gov (United States)

    Murakowski, Janusz; Schneider, Garrett J.; Schuetz, Christopher A.; Shi, Shouyuan; Prather, Dennis W.

    2013-12-01

    Optical phase-locked loop (OPLL) is used to improve the linearity of an optical link for transmission of analog signals. The finite loop delay and the presence of a low-pass filter, required for stable loop operation, lead to a nontrivial frequency response. Here, the linearity improvement in OPLL is investigated, and simple relation among the loop delay, the open-loop gain, and the loop-filter bandwidth that must be satisfied for stable operation of the OPLL is found. This relation is used to determine the fundamental limit on spur-free dynamic range (SFDR) improvement that OPLL can offer over a conventional Mach-Zehnder (MZ)-type detector.

  13. Neutron-induced reaction studies using stored ions

    Science.gov (United States)

    Glorius, Jan; Litvinov, Yuri A.; Reifarth, René

    2015-11-01

    Storage rings provide unique possibilities for investigations of nuclear reactions. Radioactive ions can be stored if the ring is connected to an appropriate facility and reaction studies are feasible at low beam intensities because of the recycling of beam particles. Using gas jet or droplet targets, charged particle-induced reactions on short-lived isotopes can be studied in inverse kinematics. In such a system a high-flux reactor could serve as a neutron target extending the experimental spectrum to neutron-induced reactions. Those could be studied over a wide energy range covering the research fields of nuclear astrophysics and reactor safety, transmutation of nuclear waste and fusion.

  14. Comparative Study Between Ethylbenzene Disproportionation Reaction and its Ethylation Reaction with Ethanol over ZSM-5

    KAUST Repository

    Tukur, N. M.

    2009-06-23

    Ethylation of ethylbenzene with ethanol has been studied over ZSM-5 catalyst in a riser simulator that mimics the operation of a fluidized-bed reactor. The feed molar ratio of ethylbenzene:ethanol is 1:1. The study was carried out at 350, 400, 450, and 500°C for reaction times of 3, 5, 7, 10, 13, and 15 s. Comparisons are made between the results of the ethylbenzene ethylation reaction with that of ethylbenzene disproportionation reaction earlier reported. The effect of reaction conditions on ethylbenzene reactivity, p-diethylbenzene selectivity, total diethylbenzene (DEB) isomers selectivity, p-DEB-to-m-DEB ratio, benzene-to-DEB molar ratio, and benzene selectivity, are reported. Benzene selectivity is about 10 times more in the EB disproportion reaction as compared to its ethylation reaction with ethanol at 350°C. In addition, the results showed a p-DEB/m-DEB ratio for the EB ethylation reaction varying between 1.2-1.7, which is greater than the equilibrium values. Increase in temperature shifts the alkylation/dealkylation equilibrium towards dealkylation, thereby decreasing conversion and selectivity to DEB. © Springer Science+Business Media, LLC 2009.

  15. Coxeter-Chein Loops

    CERN Document Server

    Blok, Rieuwert J

    2011-01-01

    In 1974 Orin Chein discovered a new family of Moufang loops which are now called Chein loops. Such a loop can be created from any group $W$ together with $\\mathbb{Z}_2$ by a variation on a semi-direct product. We study these loops in the case where $W$ is a Coxeter group and show that it has what we call a Chein-Coxeter system, a small set of generators of order 2, together with a set of relations closely related to the Coxeter relations and Chein relations. As a result we are able to give amalgam presentations for Coxeter-Chein loops. This is to our knowledge the first such presentation for a Moufang loop.

  16. Density functional theory studies of MTSL nitroxide side chain conformations attached to an activation loop

    CERN Document Server

    Concilio, Maria Grazia; Bayliss, Richard; Burgess, Selena G

    2016-01-01

    A quantum-mechanical (QM) method rooted on density functional theory (DFT) has been employed to determine conformations of the methane-thiosulfonate spin label (MTSL) attached to a fragment extracted from the activation loop of Aurora-A kinase. The features of the calculated energy surface revealed low energy barriers between isoenergetic minima and the system could be described in a population of 76 rotamers that can be also considered for other systems since it was found that the X3, X4 and X5 do not depend on the previous two dihedral angles. Conformational states obtained were seen to comparable to those obtained in the {\\alpha}-helix systems studied previously, indicating that the protein backbone does not affect the torsional profiles significantly and suggesting the possibility to use determined conformations for other protein systems for further modelling studies.

  17. Coxeter-Chein Loops

    OpenAIRE

    Blok, Rieuwert J.; Gagola III, Stephen

    2011-01-01

    In 1974 Orin Chein discovered a new family of Moufang loops which are now called Chein loops. Such a loop can be created from any group $W$ together with $\\mathbb{Z}_2$ by a variation on a semi-direct product. We study these loops in the case where $W$ is a Coxeter group and show that it has what we call a Chein-Coxeter system, a small set of generators of order 2, together with a set of relations closely related to the Coxeter relations and Chein relations. As a result we are able to give am...

  18. NASTRAN buckling study of a linear induction motor reaction rail

    Science.gov (United States)

    Williams, J. G.

    1973-01-01

    NASTRAN was used to study problems associated with the installation of a linear induction motor reaction rail test track. Specific problems studied include determination of the critical axial compressive buckling stress and establishment of the lateral stiffness of the reaction rail under combined loads. NASTRAN results were compared with experimentally obtained values and satisfactory agreement was obtained. The reaction rail was found to buckle at an axial compressive stress of 11,400 pounds per square inch. The results of this investigation were used to select procedures for installation of the reaction rail.

  19. A reaction cell with sample laser heating for in situ soft X-ray absorption spectroscopy studies under environmental conditions.

    Science.gov (United States)

    Escudero, Carlos; Jiang, Peng; Pach, Elzbieta; Borondics, Ferenc; West, Mark W; Tuxen, Anders; Chintapalli, Mahati; Carenco, Sophie; Guo, Jinghua; Salmeron, Miquel

    2013-05-01

    A miniature (1 ml volume) reaction cell with transparent X-ray windows and laser heating of the sample has been designed to conduct X-ray absorption spectroscopy studies of materials in the presence of gases at atmospheric pressures. Heating by laser solves the problems associated with the presence of reactive gases interacting with hot filaments used in resistive heating methods. It also facilitates collection of a small total electron yield signal by eliminating interference with heating current leakage and ground loops. The excellent operation of the cell is demonstrated with examples of CO and H2 Fischer-Tropsch reactions on Co nanoparticles.

  20. Force-Depending Radiation Reaction study in an undulator devise

    CERN Document Server

    López, Gustavo V

    2016-01-01

    The effect of force-depending radiation reaction on charge motion traveling inside an undulator is studied using the new force approach for radiation reaction. The effect on the dynamics of a charged particle is determined with the hope that this one can be measured experimentally and can be determined whether or not this approach points on the right direction to understand the nature of radiation reaction.

  1. Assessment of the anterior loop of the mandibular canal: A study using cone-beam computed tomography

    Energy Technology Data Exchange (ETDEWEB)

    Do Nascimento, Eduarda Helena Leandro [Dept. of Oral Diagnosis, Division of Oral Radiology, Piracicaba Dental School, University of Campinas (UNICAMP), Sao Paulo (Brazil); Ddos Anjos Pontual, Maria Luiza; Dos Anjos Pontual, Andra; Da Cruz Perez, Danyel Elias; De Moraes Ramos-Perez, Flavia Maria [Dept. of Clinical and Preventive Dentistry, School of Dentistry, Federal University of Pernambuco (UFPE), Pernambuco (Brazil); Figueiroa, Jose Natal [Instituto de Medicina Integral Professor Fernando Figueira - IMIP, Pernambuco (Brazil); Frazao, Marco Antonio Gomes [Dept. of Oral Radiology, Recife Dental School (FOR), Pernambuco (Brazil)

    2016-06-15

    Sufficient area in the interforaminal region is required for dental implant placement, and the anterior loop of the mandibular canal is located within the limits of this area. The aim of this study was to evaluate the prevalence and extent of the anterior loop in a Brazilian sample population using cone-beam computed tomography (CBCT). CBCT images from 250 patients (500 hemimandibles) obtained for various clinical indications were randomly selected and evaluated to determine the presence and length of the anterior loop. The length of the anterior loop was then compared based on gender, age, and the side of the mandible. The data were analyzed using the Pearson chi-square test and linear regression analysis. An anterior loop was identified in 41.6% of the cases, and its length ranged from 0.25 mm to 4.00 mm (mean, 1.1±0.8 mm). The loop had a greater mean length and was significantly more prevalent in males (p=0.014). No significant differences were found between the right and left sides regarding length (p=0.696) or prevalence (p=0.650). In this study, a high prevalence of the anterior loop of the mandibular canal was found, and although its length varied greatly, in most cases it was less than 1 mm long. Although this is a prevalent anatomical variation, safety limits for the placement of implants in this region cannot be established before an accurate evaluation using imaging techniques in order to identify and preserve the neurovascular bundles.

  2. FDR, an easier way to NNLO calculations: a two-loop case study

    CERN Document Server

    Donati, Alice Maria

    2013-01-01

    In this paper we advertise the important simplifications produced by FDR in NNLO computations. We show that - due to its four-dimensionality - FDR does not require an order-by-order renormalization and that, unlike the one-loop case, FDR and dimensional regularization (DR) generate intermediate two-loop results which are no longer linked by a simple subtraction of the ultraviolet (UV) poles in epsilon. As an illustrative example, we re-derive the known two-loop result for H -> gamma gamma mediated by an infinitely heavy top loop in the presence of gluonic corrections. The calculation establishes FDR as a simpler and fully consistent approach to the UV problem at the two-loop level, that, in turn, is an essential ingredient toward purely numerical NNLO calculations.

  3. Matrix isolation as a tool for studying interstellar chemical reactions

    Science.gov (United States)

    Ball, David W.; Ortman, Bryan J.; Hauge, Robert H.; Margrave, John L.

    1989-01-01

    Since the identification of the OH radical as an interstellar species, over 50 molecular species were identified as interstellar denizens. While identification of new species appears straightforward, an explanation for their mechanisms of formation is not. Most astronomers concede that large bodies like interstellar dust grains are necessary for adsorption of molecules and their energies of reactions, but many of the mechanistic steps are unknown and speculative. It is proposed that data from matrix isolation experiments involving the reactions of refractory materials (especially C, Si, and Fe atoms and clusters) with small molecules (mainly H2, H2O, CO, CO2) are particularly applicable to explaining mechanistic details of likely interstellar chemical reactions. In many cases, matrix isolation techniques are the sole method of studying such reactions; also in many cases, complexations and bond rearrangements yield molecules never before observed. The study of these reactions thus provides a logical basis for the mechanisms of interstellar reactions. A list of reactions is presented that would simulate interstellar chemical reactions. These reactions were studied using FTIR-matrix isolation techniques.

  4. Design of Test Loops for Forced Convection Heat Transfer Studies at Supercritical State

    Science.gov (United States)

    Balouch, Masih N.

    Worldwide research is being conducted to improve the efficiency of nuclear power plants by using supercritical water (SCW) as the working fluid. One such SCW reactor considered for future development is the CANDU-Supercritical Water Reactor (CANDU-SCWR). For safe and accurate design of the CANDU-SCWR, a detailed knowledge of forced-convection heat transfer in SCW is required. For this purpose, two supercritical fluid loops, i.e. a SCW loop and an R-134a loop are developed at Carleton University. The SCW loop is designed to operate at pressures as high as 28 MPa, temperatures up to 600 °C and mass fluxes of up to 3000 kg/m2s. The R-134a loop is designed to operate at pressures as high as 6 MPa, temperatures up to 140 °C and mass fluxes in the range of 500-6000 kg/m2s. The test loops designs allow for up to 300 kW of heating power to be imparted to the fluid. Both test loops are of the closed-loop design, where flow circulation is achieved by a centrifugal pump in the SCW loop and three parallel-connected gear pumps in the R-134a loop, respectively. The test loops are pressurized using a high-pressure nitrogen cylinder and accumulator assembly, which allows independent control of the pressure, while simultaneously dampening pump induced pressure fluctuations. Heat exchangers located upstream of the pumps control the fluid temperature in the test loops. Strategically located measuring instrumentation provides information on the flow rate, pressure and temperature in the test loops. The test loops have been designed to accommodate a variety of test-section geometries, ranging from a straight circular tube to a seven-rod bundle, achieving heat fluxes up to 2.5 MW/m2 depending on the test-section geometry. The design of both test loops allows for easy reconfiguration of the test-section orientation relative to the gravitational direction. All the test sections are of the directly-heated design, where electric current passing through the pressure retaining walls of the

  5. Transverse flow reactor studies of the dynamics of radical reactions

    Energy Technology Data Exchange (ETDEWEB)

    Macdonald, R.G. [Argonne National Laboratory, IL (United States)

    1993-12-01

    Radical reactions are in important in combustion chemistry; however, little state-specific information is available for these reactions. A new apparatus has been constructed to measure the dynamics of radical reactions. The unique feature of this apparatus is a transverse flow reactor in which an atom or radical of known concentration will be produced by pulsed laser photolysis of an appropriate precursor molecule. The time dependence of individual quantum states or products and/or reactants will be followed by rapid infrared laser absorption spectroscopy. The reaction H + O{sub 2} {yields} OH + O will be studied.

  6. STUDY ON SIDE REACTION IN THE SYNTHESIS OF HYPERCROSSLINKED POLYMERS

    Institute of Scientific and Technical Information of China (English)

    ZHANG Bo; LI Aimin; TAO Weihua; YANG Weiben

    2008-01-01

    The systematical study about side reactions have revealed the formation mechanism of oxygen-containing groups of hypercrosslinked polymers.Surface chemistry and functionality of the polymers are characterized by Fourier-transform infrared spectroscopy (FT-IR), solid state nuclear magnetic resonance (NMR) and contact angle.The results showed that the ether groups were from chioromethylated reaction, and the alcohol groups arose from partial hydrolysis of chloromethyl groups during the post-crosslinking reaction, and the carbonyl functionality was formed by further oxidation of the alcohol groups.Catalyst and solvent used in the postcrosslinking reaction would greatly influence the surface chemistry of the polymer.

  7. Variational Flooding Study of a SN2 Reaction.

    Science.gov (United States)

    Piccini, GiovanniMaria; McCarty, James J; Valsson, Omar; Parrinello, Michele

    2017-02-02

    We have studied the reaction dynamics of a prototypical organic reaction using a variationally optimized truncated bias to accelerate transitions between educt and product reactant states. The asymmetric SN2 nucleophilic substitution reaction of fluoromethane and chloromethane CH3F + Cl(-) ⇌ CH3Cl + F(-) is considered, and many independent biased molecular dynamics simulations have been performed at 600, 900, and 1200 K, collecting several hundred transitions at each temperature. The transition times and relative rate constants have been obtained for both reaction directions. The activation energies extracted from an Arrhenius plot compare well with standard static calculations.

  8. Real-time Doppler-based arterial vascular impedance and peripheral pressure-flow loops: a pilot study.

    Science.gov (United States)

    Thiele, Robert H; Bartels, Karsten; Esper, Stephen; Ikeda, Keita; Gan, Tong-Joo

    2014-02-01

    Arterial pressure-flow loops and vascular impedance provide additional data that could be used to assess the hemodynamic effects of therapeutic interventions in anesthetized patients. To evaluate the utility of such an approach, the authors sought to design a device that combines flow waveforms from an esophageal Doppler probe and pressure waveforms from a peripheral artery to produce real-time pressure-flow loops and estimates of arterial vascular impedance. Prospective, cohort study. Single center, university-based teaching hospital. Patients undergoing surgery in whom the attending anesthesiologist had opted to place an esophageal Doppler probe and a peripheral arterial catheter for hemodynamic monitoring. This was a non-interventional study designed to record pressure-flow loops and arterial vascular impedance intraoperatively using a novel, noninvasive device. Pressure-flow loops and arterial vascular impedance were measured noninvasively using radial artery pressure and descending thoracic aorta flow waveforms in real time. Real-time arterial vascular impedance and peripheral pressure-volume loops can be determined using available monitoring devices. Technical feasibility of this technology in patients is a crucial first step to permit meaningful evaluation of the clinical value of this approach for accurate determination of complex hemodynamic indices and, eventually, improvement of outcomes. Copyright © 2014 Elsevier Inc. All rights reserved.

  9. Theoretical Studies on N2H+O Reaction

    Institute of Scientific and Technical Information of China (English)

    L(U) Ying-wen; L(U) Wen-cai; SU Zhong-min

    2008-01-01

    The N2H+O potential energy profile was studied at the CCSD(T)/6-311G++(dfp)//MP2/6-311G(d,p) level.Reactions associated with four intermediates(cis-HNNO, trans-HNNO, NNHO, and NNOH) were investigated. The results indicate that N2H+O reaction toward H+N2O is more favored than that toward N2+OH, consistent with previous experimental studies. The pathways for the two reactions are found to go through cis-HNNO, transition state, and finally to the products. The N2H+O→NH+NO reaction was studied in detail. Product NO in such a reaction is likely to occur via cis-HNNO, followed by trans-HNNO, and finally dissociates into NH+NO. These results suggest that N2H+O→NH+NO is an important channel in NO production.

  10. Study of the reaction gamma p -> p pi(0)eta

    NARCIS (Netherlands)

    Horn, I.; Anisovich, A. V.; Anton, G.; Bantes, R.; Bartholomy, O.; Beck, R.; Beloglazov, Y.; Bogendoerfer, R.; Castelijns, R.; Crede, V.; Ehmanns, A.; Ernst, J.; Fabry, I.; Flemming, H.; Foesel, A.; Fuchs, M.; Funke, Ch.; Gothe, R.; Gridnev, A.; Gutz, E.; Hoeffgen, S.; Hoessi, J.; Junkersfeld, J.; Kalinowsky, H.; Klein, F.; Klempt, E.; Koch, H.; Konrad, M.; Kopf, B.; Krusche, B.; Langheinrich, J.; Loehner, H.; Lopatin, I.; Lotz, J.; Matthaey, H.; Menze, D.; Messchendorp, J.; Metag, V.; Nikonov, V. A.; Novinski, D.; Ostrick, M.; van Pee, H.; Sarantsev, A. V.; Schmidt, C.; Schmieden, H.; Schoch, B.; Suft, G.; Sumachev, V.; Szczepanek, T.; Thoma, U.; Walther, D.; Weinheimer, Ch.

    2008-01-01

    The reaction gamma p -> p pi(0)eta has been studied with the CBELSA detector at the tagged photon beam of the Bonn electron stretcher facility. The reaction shows contributions from Delta(+)(1232)eta, N(1535)(+) pi(0) and pa(0)(980) as intermediate states. A partial-wave analysis suggests that the r

  11. Electromagnetic studies of nuclear structure and reactions

    Science.gov (United States)

    Hersman, F. W.; Dawson, J. F.; Heisenberg, J. H.; Calarco, J. R.

    1990-06-01

    This report contains papers on the following topics: giant resonance studies; deep inelastic scattering studies; high resolution nuclear structure work; and relativistic RPA; and field theory in the Schroedinger Representation.

  12. A study about detection of defects in the nuclear piping loop system using cooling lock-in infrared thermography

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Sang Chae; Kang, Sung Hoon; Yun, Na Yeon; Jung, Hyun Chul; Kim, Kyeong Suk [Dept. of Mechanical System Engineering, Chosun University, Gwangju (Korea, Republic of)

    2015-10-15

    A study on the application of cooling defect detection was performed on the basis of a preceding study on the heated defect detection in nuclear piping loop system, using lock-in infrared thermography. A loop system with piping defects was made by varying the wall-thinning length, the circumference orientation angle, and the wall-thinning depth. The test was performed using an IR camera and a cooling device. Distance between the cooling device and the target loop system was fixed at 2 m. For analyzing experimental results, the temperature distribution data for cooling, and phase data were obtained. Through the analysis of this data, the defect length was measured. The reliability of the measurements for cooling defect conditions was shown to be higher in the lock-in infrared thermography data than the infrared thermography data.

  13. Supersymmetric Wilson loops at two loops

    CERN Document Server

    Bassetto, Antonio; Pucci, Fabrizio; Seminara, Domenico

    2008-01-01

    We study the quantum properties of certain BPS Wilson loops in ${\\cal N}=4$ supersymmetric Yang-Mills theory. They belong to a general family, introduced recently, in which the addition of particular scalar couplings endows generic loops on $S^3$ with a fraction of supersymmetry. When restricted to $S^2$, their quantum average has been further conjectured to be exactly computed by the matrix model governing the zero-instanton sector of YM$_2$ on the sphere. We perform a complete two-loop analysis on a class of cusped Wilson loops lying on a two-dimensional sphere, finding perfect agreement with the conjecture. The perturbative computation reproduces the matrix-model expectation through a highly non-trivial interplay between ladder diagrams and self-energies/vertex contributions, suggesting the existence of a localization procedure.

  14. An experimental and theoretical study of reaction steps relevant to the methanol-to-hydrocarbons reaction

    Energy Technology Data Exchange (ETDEWEB)

    Svelle, Stian

    2004-07-01

    The primary objective of the present work is to obtain new insight into the reaction mechanism of the zeolite catalyzed methanol-to-hydrocarbons (MTH) reaction. It was decided to use both experimental and computational techniques to reach this goal. An investigation of the n-butene + methanol system was therefore initiated. Over time, it became apparent that it was possible to determine the rate for the methylation of n-butene by methanol. The ethene and propene systems were therefore reexamined in order to collect kinetic information also for those cases. With the development of user-friendly quantum chemistry programs such as the Gaussian suite of programs, the possibility of applying quantum chemical methods to many types of problems has become readily available even for non-experts. When performing mechanistic studies, there is quite often a considerable synergy effect when combining experimental and computational approaches. The methylation reactions mentioned above turned out to be an issue well suited for quantum chemical investigations. The incentive for examining the halomethane reactivity was the clear analogy to the MTH reaction system. Alkene dimerization was also a reaction readily examined with quantum chemistry. As discussed in the introduction of this thesis, polymethylbenzenes, or their cationic counterparts, are suspected to be key intermediates in the MTH reaction. It was therefore decided to investigate the intrinsic reactivity of these species in the gas-phase by employing sophisticated mass spectrometric (MS) techniques in collaboration with the MS group at the Department of Chemistry, University of Oslo The data thus obtained will also be compared with results from an ongoing computational study on gas phase polymethylbenzenium reactivity. 6 papers presenting various studies are included. The titles are: 1) A Theoretical Investigation of the Methylation of Alkenes with Methanol over Acidic Zeolites. 2) A Theoretical Investigation of the

  15. A two-loop study of the deconfinement transition in Yang-Mills theories: SU(3) and beyond

    CERN Document Server

    Reinosa, U; Tissier, M; Wschebor, N

    2015-01-01

    We study the confinement-deconfinement phase transition of pure Yang-Mills theories at finite temperature within a simple massive extension of standard background field methods. We generalize our recent next-to-leading-order perturbative calculation of the Polyakov loop and the related background field effective potential for the SU(2) theory to any compact and connex Lie group with a simple Lie algebra. We discuss in detail the SU(3) theory, where the two-loop corrections yield improved values for the first order transition temperature as compared to the one-loop result. We show that certain one-loop artifacts of thermodynamical observables disappear at two-loop order, as was already the case for the SU(2) theory. In particular, the entropy and the pressure are positive for all temperatures. We also discuss the groups SU(4) and Sp(2) which shed interesting light, respectively, on the relation between the (de)confinement of static matter sources in the various representations of the gauge group and on the use...

  16. Study of alpha one antitrypsin activity in lepra reaction.

    Science.gov (United States)

    Sengupta, S R; Dhole, T N; Jahagirdar, V L; Yemul, V L; Chawhan, R N

    1983-04-01

    In our earlier study (Yemul et, al, 1983) we have reported elevation of serum alpha one antitrypsin levels in patients of lepromatous leprosy and lepra reaction. In this study estimation of serum alpha one antitrypsin levels in fifty lepra reaction patients (8 of type 1 and 42 of type II) and fifty age and sex matched healthy controls is described. Alpha one antitrypsin levels were elevated in lepra reaction patients (type I--mean value of 332 mg% and S.D. +/- 118.8 and type II--mean value of 450 mg% and S.D. +/- 73.7) when compared with the healthy controls (mean value of 285 mg% and S.D. +/- 66.05). The increase in levels in type II lepra reaction patients was statistically significant. The results are discussed to correlate the increased levels of alpha one antitrypsin and the high bacterial load leading to the release of various proteases in type II lepra reaction.

  17. Fundamental studies of retrograde reactions in direct liquefaction

    Energy Technology Data Exchange (ETDEWEB)

    Serio, M.A.; Solomon, P.R.; Kroo, E.; Charpenay, S.; Bassilakis, R.

    1991-12-17

    The overall objective of the program was to improve the understanding of retrograde reactions and their dependencies on coal rank and structure, and/or coal modifications and reaction conditions. Because retrograde reactions are competitive with bond breaking reactions, an understanding of both is required to shift the competition in favor of the latter. Related objectives were to clarify the conflicting observations reported in literature on such major topics as the role of oxygen groups in retrograde reactions and to provide a bridge from very fundamental studies on pure compounds to phenomenological studies on actual coal. This information was integrated into the FG-DVC model, which was improved and extended to the liquefaction context.

  18. A complex reaction time study (Sternberg) in space flight

    Science.gov (United States)

    Thornton, W.; Uri, John; Moore, Tom

    1993-01-01

    Simple and complex (Sternberg) reaction time studies were flown on three and seven day Shuttle flights in 1985. Three subjects did selftesting with an onboard handheld calculator without difficulty. There was little change in simple reaction time. One subject demonstrated a decrease in the processing rate during space motion sickness while a second exhibited an increase in complex reaction time without a change in processing rate during a period of high work load. The population was too small to demonstrate significant changes. This study demonstrates the ease and practicality of such measurements and indicates the potential value of such studies in space.

  19. A complex reaction time study (Sternberg) in space flight

    Science.gov (United States)

    Thornton, W.; Uri, John; Moore, Tom

    1993-01-01

    Simple and complex (Sternberg) reaction time studies were flown on three and seven day Shuttle flights in 1985. Three subjects did selftesting with an onboard handheld calculator without difficulty. There was little change in simple reaction time. One subject demonstrated a decrease in the processing rate during space motion sickness while a second exhibited an increase in complex reaction time without a change in processing rate during a period of high work load. The population was too small to demonstrate significant changes. This study demonstrates the ease and practicality of such measurements and indicates the potential value of such studies in space.

  20. Utility of loop-mediated isothermal amplification assay, polymerase chain reaction, and elisa for diagnosis of leptospirosis in South Indian patients

    Directory of Open Access Journals (Sweden)

    Mallika Sengupta

    2017-01-01

    Full Text Available Background: Leptospirosis is a zoonotic disease which requires laboratory diagnosis for confirmation. Materials and Methods: In this study serum samples from adults with acute undifferentiated fever (duration ≤15 days were tested for IgM antibodies to Leptospira by ELISA, PCR for rrs gene and loop-mediated isothermal amplification (LAMP assay for LipL32 and LipL41. Results: Among the 150 sera tested, three were positive by PCR, LAMP and IgM ELISA/modified Faines' criteria, two by only PCR; seven only by LAMP assay and forty fulfilled modified Faine's criteria (illness clinically compatible and IgM ELISA positive for leptospirosis. Clinical correlation revealed renal compromise, low platelet count and severe jaundice were significantly related to leptospirosis (P < 0.05. Conclusion: This study suggests that LAMP assay could be useful for diagnosis of leptospirosis during the 1st week of illness whereas IgM ELISA forms the mainstay of diagnosis from the 2nd week onward. Further studies especially community based, comparing ELISA, PCR, LAMP, culture and microscopic agglutination test are required to evaluate the veracity of these findings.

  1. Utility of Loop-mediated Isothermal Amplification Assay, Polymerase Chain Reaction, and ELISA for Diagnosis of Leptospirosis in South Indian Patients

    Science.gov (United States)

    Sengupta, Mallika; Prabhakar, Abhilash Kundavaram Paul; Satyendra, Sowmya; Thambu, David; Abraham, Ooriapadickal Cherian; Balaji, Veeraraghavan; Chen, Hua-Wei; Chao, Chien-Chung; Ching, Wei-Mei; Prakash, John Antony Jude

    2017-01-01

    Background: Leptospirosis is a zoonotic disease which requires laboratory diagnosis for confirmation. Materials and Methods: In this study serum samples from adults with acute undifferentiated fever (duration ≤15 days) were tested for IgM antibodies to Leptospira by ELISA, PCR for rrs gene and loop-mediated isothermal amplification (LAMP) assay for LipL32 and LipL41. Results: Among the 150 sera tested, three were positive by PCR, LAMP and IgM ELISA/modified Faines’ criteria, two by only PCR; seven only by LAMP assay and forty fulfilled modified Faine's criteria (illness clinically compatible and IgM ELISA positive for leptospirosis). Clinical correlation revealed renal compromise, low platelet count and severe jaundice were significantly related to leptospirosis (P < 0.05). Conclusion: This study suggests that LAMP assay could be useful for diagnosis of leptospirosis during the 1st week of illness whereas IgM ELISA forms the mainstay of diagnosis from the 2nd week onward. Further studies especially community based, comparing ELISA, PCR, LAMP, culture and microscopic agglutination test are required to evaluate the veracity of these findings.

  2. Using the Hysteresis Loop to Study a Single-Phase Transformer Working in AC-Switching Regime

    Directory of Open Access Journals (Sweden)

    STRIMBU, C.

    2007-04-01

    Full Text Available A model to generate the hysteresis loop starting from the fundamental magnetization curve is proposed in this paper. This was imposed by the necessity to improve the results returned by authors' previous studies about the periodical acswitching mode of single-phase transformers. The hysteresis loop generation and tracing procedures are presented in the paper, the last one dealing with a transformer working in acswitching mode, RL and RC loaded (with current or voltage rectifiers in secondary winding. Comparisons between experimentally and theoretically determined primary current waveforms are included in the paper, to prove the correctness of the proposed hysteresis loop model. MathCAD 6.0 was used as mathematical support.

  3. Detection of cyclonic eddy generated by looping tropical cyclone in the northern South China Sea:a case study

    Institute of Scientific and Technical Information of China (English)

    HU Jianyu; KAWAMURA Hiroshi

    2004-01-01

    A case study on the cyclonic eddy generated by the tropical cyclone looping over the northern South China Sea (NSCS) is presented, using TOPEX/POSEIDON altimeter data and AVHRR sea surface temperature (SST) data.Three cases relating to the tropical cyclone events (Typhoon Kai-Tak in July 2000, Tropical Storm Russ in June 1994 and Tropical Storm Maria in August-September 2000) over the NSCS have been analyzed. For each looping tropical cyclone case, the cyclonic eddy with an obvious sea level depression appears in the sea area where the tropical cyclone takes a loop form, and lasts for about 2 weeks with a slight variation in location. The cold core with the SST difference greater than 2 ℃ against its surrounding areas is also observed by the satellite-derived SST data.

  4. Detection of cyclonic eddy generated by looping tropical cyclone in the northern South China Sea:a case study

    Institute of Scientific and Technical Information of China (English)

    HU Jianyu; KAWAMURA Hiroshi

    2004-01-01

    A case study on the cyclonic eddy generated by the tropical cyclone looping over the northern South China Sea (NSCS) is presented, using TOPEX/POSEIDON altimeter data and AVHRR sea surface temperature (SST) data.Three cases relating to the tropical cyclone events (Typhoon Kai-Tak in July 2000, Tropical Storm Russ in June 1994and Tropical Storm Maria in August-September 2000) over the NSCS have been analyzed. For each looping tropical cyclone case, the cyclonic eddy with an obvious sea level depression appears in the sea area where the tropical cyclone takes a loop form, and lasts for about 2 weeks with a slight variation in location. The cold core with the SST difference greater than 2 ℃ against its surrounding areas is also observed by the satellite-derived SST data.

  5. Local loop near-rings

    OpenAIRE

    Franetič, Damir

    2015-01-01

    We study loop near-rings, a generalization of near-rings, where the additive structure is not necessarily associative. We introduce local loop near-rings and prove a useful detection principle for localness.

  6. NSPT study of the three-loop lattice gluon propagator in Landau gauge

    CERN Document Server

    Torrero, C; Ilgenfritz, E -M; Perlt, H; Schiller, A

    2010-01-01

    By means of Numerical Stochastic Perturbation Theory (NSPT), we calculate the lattice gluon propagator up to three loops of perturbation theory in the limits of infinite volume and vanishing lattice spacing. Based on known anomalous dimensions and a parametrization of both the hypercubic symmetry group H(4) and finite-size effects, we calculate the non-leading-log and non-logarithmic contributions iteratively, starting with the first-loop expression.

  7. Direct observation of the coalescence process between nanoscale dislocation loops with different Burgers vectors

    Energy Technology Data Exchange (ETDEWEB)

    Arakawa, K., E-mail: arakawak@uhvem.osaka-u.ac.jp [Research Center for Ultra-High Voltage Electron Microscopy, Osaka University, 7-1 Mihogaoka, Ibaraki, Osaka 567-0047 (Japan); CREST, JST, 5 Sanbancho, Chiyoda-ku, Tokyo 102-0075 (Japan); Amino, T.; Mori, H. [Research Center for Ultra-High Voltage Electron Microscopy, Osaka University, 7-1 Mihogaoka, Ibaraki, Osaka 567-0047 (Japan)

    2011-01-15

    The dynamic behavior of nanoscale prismatic dislocation loops can significantly affect the microstructural variation in crystalline materials upon processes such as plastic deformation and high-energy particle irradiation. Using in situ transmission electron microscopy, this study experimentally demonstrates a reaction which follows the collision between two loops with different Burgers vectors in {alpha}-iron. Even after the formation of the junction, the reaction progresses further, unlike conventional reactions between dislocations of macroscopic length, and the larger loop finally absorbs the smaller one.

  8. Study of the effect of loop inductance on the RF transmission line to cavity coupling coefficient.

    Science.gov (United States)

    Lal, Shankar; Pant, K K

    2016-08-01

    Coupling of RF power is an important aspect in the design and development of RF accelerating structures. RF power coupling employing coupler loops has the advantage of tunability of β, the transmission line to cavity coupling coefficient. Analytical expressions available in literature for determination of size of the coupler loop using Faraday's law of induction show reasonably good agreement with experimentally measured values of β below critical coupling (β ≤ 1) but show large deviation with experimentally measured values and predictions by simulations for higher values of β. In actual accelerator application, many RF cavities need to be over-coupled with β > 1 for reasons of beam loading compensation, reduction of cavity filling time, etc. This paper discusses a modified analytical formulation by including the effect of loop inductance in the determination of loop size for any desired coupling coefficient. The analytical formulation shows good agreement with 3D simulations and with experimentally measured values. It has been successfully qualified by the design and development of power coupler loops for two 476 MHz pre-buncher RF cavities, which have successfully been conditioned at rated power levels using these coupler loops.

  9. Study of the effect of loop inductance on the RF transmission line to cavity coupling coefficient

    Science.gov (United States)

    Lal, Shankar; Pant, K. K.

    2016-08-01

    Coupling of RF power is an important aspect in the design and development of RF accelerating structures. RF power coupling employing coupler loops has the advantage of tunability of β, the transmission line to cavity coupling coefficient. Analytical expressions available in literature for determination of size of the coupler loop using Faraday's law of induction show reasonably good agreement with experimentally measured values of β below critical coupling (β ≤ 1) but show large deviation with experimentally measured values and predictions by simulations for higher values of β. In actual accelerator application, many RF cavities need to be over-coupled with β > 1 for reasons of beam loading compensation, reduction of cavity filling time, etc. This paper discusses a modified analytical formulation by including the effect of loop inductance in the determination of loop size for any desired coupling coefficient. The analytical formulation shows good agreement with 3D simulations and with experimentally measured values. It has been successfully qualified by the design and development of power coupler loops for two 476 MHz pre-buncher RF cavities, which have successfully been conditioned at rated power levels using these coupler loops.

  10. Theoretical Study of Sodium-Water Surface Reaction Mechanism

    Science.gov (United States)

    Kikuchi, Shin; Kurihara, Akikazu; Ohshima, Hiroyuki; Hashimoto, Kenro

    Computational study of the sodium-water reaction at the gas (water) - liquid (sodium) interface has been carried out using the ab initio (first-principle) method. A possible reaction channel has been identified for the stepwise OH bond dissociations of a single water molecule. The energetics including the binding energy of a water molecule on the sodium surface, the activation energies of the bond cleavages, and the reaction energies, have been evaluated, and the rate constants of the first and second OH bond-breakings have been compared. It was found that the estimated rate constant of the former was much larger than the latter. The results are the basis for constructing the chemical reaction model used in a multi-dimensional sodium-water reaction code, SERAPHIM, being developed by Japan Atomic Energy Agency (JAEA) toward the safety assessment of the steam generator (SG) in a sodium-cooled fast reactor (SFR).

  11. Theoretical Study on Reaction Mechanism of Aluminum-Water System

    Institute of Scientific and Technical Information of China (English)

    Yun-lan Sun; Yan Tian; Shu-fen Li

    2008-01-01

    A theoretical study on the reaction of aluminum with water in the gas phase was performed using the hybrid density functional B3LYP and QCISD(T) methods with the 6-311+G(d,p) and the 6-311++G(d,p) basis sets. The results show that there are three possible reaction pathways that involve four isomers, seven transition structures, and two possible products for the reaction of aluminum with water. The two most favorable reaction pathways were found, whose intermediates and products agreed quite well with experimental results. The enthalpy and Gibbs free energy change of the reaction between AI and H2O at 298 and 2000 K were calculated. Some results are also in good agreement with the previous calculations or experimental results.

  12. A pedigree-based study of mitochondrial D-loop DNA sequence variation among Arabian horses.

    Science.gov (United States)

    Bowling, A T; Del Valle, A; Bowling, M

    2000-02-01

    Through DNA sequence comparisons of a mitochondrial D-loop hypervariable region, we investigated matrilineal diversity for Arabian horses in the United States. Sixty-two horses were tested. From published pedigrees they traced in the maternal line to 34 mares acquired primarily in the mid to late 19th century from nomadic Bedouin tribes. Compared with the reference sequence (GenBank X79547), these samples showed 27 haplotypes with altogether 31 base substitution sites within 397 bp of sequence. Based on examination of pedigrees from a random sampling of 200 horses in current studbooks of the Arabian Horse Registry of America, we estimated that this study defined the expected mtDNA haplotypes for at least 89% of Arabian horses registered in the US. The reliability of the studbook recorded maternal lineages of Arabian pedigrees was demonstrated by haplotype concordance among multiple samplings in 14 lines. Single base differences observed within two maternal lines were interpreted as representing alternative fixations of past heteroplasmy. The study also demonstrated the utility of mtDNA sequence studies to resolve historical maternity questions without access to biological material from the horses whose relationship was in question, provided that representatives of the relevant female lines were available for comparison. The data call into question the traditional assumption that Arabian horses of the same strain necessarily share a common maternal ancestry.

  13. Theoretical Studies of Elementary Hydrocarbon Species and Their Reactions

    Energy Technology Data Exchange (ETDEWEB)

    Allen, Wesley D. [Univ. of Georgia, Athens, GA (United States). Dept. of Chemistry. Center for Computational Quantum Chemistry; Schaefer, III, Henry F. [Univ. of Georgia, Athens, GA (United States). Dept. of Chemistry. Center for Computational Quantum Chemistry

    2015-11-14

    This is the final report of the theoretical studies of elementary hydrocarbon species and their reactions. Part A has a bibliography of publications supported by DOE from 2010 to 2016 and Part B goes into recent research highlights.

  14. Studies on Absorption and Elimination of Dietary Maillard Reaction Products

    National Research Council Canada - National Science Library

    FÖRSTER, ANKE; KÜHNE, YVONNE; HENLE, T.OMAS

    2005-01-01

    A bstract : A nine‐day dietary study involving 18 healthy volunteers was performed in order to investigate the influence of nutrition on the urinary excretion of the Maillard reaction products (MRPs...

  15. Leprosy Reaction in Thai Population: A 20-Year Retrospective Study

    Directory of Open Access Journals (Sweden)

    Poonkiat Suchonwanit

    2015-01-01

    Full Text Available Background. Leprosy is a chronic infectious disease that presents with varying dermatological and neurological symptoms. The leprosy reactions occur over the chronic course of the disease and lead to extensive disability and morbidity. Objective. To analyze and identify the risk factors which contribute to leprosy reactions. Methods. In a retrospective study, we reviewed the medical records of leprosy patients registered at the leprosy clinic, Ramathibodi Hospital, Thailand, between March 1995 and April 2015. One hundred and eight patients were included; descriptive analysis was used for baseline characteristics and a binary logistic regression model was applied for identifying risk factors correlated with leprosy reactions. Results. Of the 108 cases analyzed, 51 were male and 57 were female. The mean age of presentation was 45 years. The borderline tuberculoid type was the most common clinical form. Leprosy reactions were documented in 61 cases (56.5%. The average time to reaction was 8.9 months. From multivariate analysis, risk factors for leprosy reactions were being female, positive bacillary index status, and MB treatment regimen. Conclusions. Leprosy reactions are common complications in leprosy patients. Being female, positive bacillary index status, and multibacillary treatment regimen are significantly associated with the reactions. Early detection in cases with risk factors followed by appropriate treatment could prevent the morbidity of leprosy patients.

  16. Density Functional Study on the Reaction Mechanism for the Reaction of Ni+ with Ethane

    Institute of Scientific and Technical Information of China (English)

    ZHANG,Dong-Ju(张冬菊); LIU,Cheng-Bu(刘成卜); LIU,Yong-Jun(刘永军); HU,Hai-Quan(胡海泉)

    2002-01-01

    The mechanism of the reaction of Ni+ (2D) with ethane in the gas-phase was studied by using density functional theory. Both the B3LYP and BLYP functionals with standard all-electron basis sets are used to give the detailed information of the potential energy surface (PES) of [Ni, C2, H6 ] +. Tne mechanisms forming the products CH4 and H2 in the reaction of Ni+with ethane are proposed. The reductive eliminations of CH4and H2 are typical addition-elimination reactions. Each of the two reactions consists of two elementary steps: C-C or CH bond activations to form inserted species followed by isomerizations to form product-like intermediate. The rate determining steps for the elimination reatcions of forming CH4 and H2 are the isomerizations of the inserted species rather than C-C or C-H bond activations. The elimination reaction of forming H2 was found to be thermodynamically favored compared to that of CH4.

  17. Enhanced Oceanic Operations Human-In-The-Loop In-Trail Procedure Validation Simulation Study

    Science.gov (United States)

    Murdoch, Jennifer L.; Bussink, Frank J. L.; Chamberlain, James P.; Chartrand, Ryan C.; Palmer, Michael T.; Palmer, Susan O.

    2008-01-01

    The Enhanced Oceanic Operations Human-In-The-Loop In-Trail Procedure (ITP) Validation Simulation Study investigated the viability of an ITP designed to enable oceanic flight level changes that would not otherwise be possible. Twelve commercial airline pilots with current oceanic experience flew a series of simulated scenarios involving either standard or ITP flight level change maneuvers and provided subjective workload ratings, assessments of ITP validity and acceptability, and objective performance measures associated with the appropriate selection, request, and execution of ITP flight level change maneuvers. In the majority of scenarios, subject pilots correctly assessed the traffic situation, selected an appropriate response (i.e., either a standard flight level change request, an ITP request, or no request), and executed their selected flight level change procedure, if any, without error. Workload ratings for ITP maneuvers were acceptable and not substantially higher than for standard flight level change maneuvers, and, for the majority of scenarios and subject pilots, subjective acceptability ratings and comments for ITP were generally high and positive. Qualitatively, the ITP was found to be valid and acceptable. However, the error rates for ITP maneuvers were higher than for standard flight level changes, and these errors may have design implications for both the ITP and the study's prototype traffic display. These errors and their implications are discussed.

  18. Adjoint sensitivity studies of loop current and eddy shedding in the Gulf of Mexico

    KAUST Repository

    Gopalakrishnan, Ganesh

    2013-07-01

    Adjoint model sensitivity analyses were applied for the loop current (LC) and its eddy shedding in the Gulf of Mexico (GoM) using the MIT general circulation model (MITgcm). The circulation in the GoM is mainly driven by the energetic LC and subsequent LC eddy separation. In order to understand which ocean regions and features control the evolution of the LC, including anticyclonic warm-core eddy shedding in the GoM, forward and adjoint sensitivities with respect to previous model state and atmospheric forcing were computed using the MITgcm and its adjoint. Since the validity of the adjoint model sensitivities depends on the capability of the forward model to simulate the real LC system and the eddy shedding processes, a 5 year (2004–2008) forward model simulation was performed for the GoM using realistic atmospheric forcing, initial, and boundary conditions. This forward model simulation was compared to satellite measurements of sea-surface height (SSH) and sea-surface temperature (SST), and observed transport variability. Despite realistic mean state, standard deviations, and LC eddy shedding period, the simulated LC extension shows less variability and more regularity than the observations. However, the model is suitable for studying the LC system and can be utilized for examining the ocean influences leading to a simple, and hopefully generic LC eddy separation in the GoM. The adjoint sensitivities of the LC show influences from the Yucatan Channel (YC) flow and Loop Current Frontal Eddy (LCFE) on both LC extension and eddy separation, as suggested by earlier work. Some of the processes that control LC extension after eddy separation differ from those controlling eddy shedding, but include YC through-flow. The sensitivity remains stable for more than 30 days and moves generally upstream, entering the Caribbean Sea. The sensitivities of the LC for SST generally remain closer to the surface and move at speeds consistent with advection by the high-speed core of

  19. Trojan Horse Method for neutrons-induced reaction studies

    Science.gov (United States)

    Gulino, M.; Asfin Collaboration

    2017-09-01

    Neutron-induced reactions play an important role in nuclear astrophysics in several scenario, such as primordial Big Bang Nucleosynthesis, Inhomogeneous Big Bang Nucleosynthesis, heavy-element production during the weak component of the s-process, explosive stellar nucleosynthesis. To overcome the experimental problems arising from the production of a neutron beam, the possibility to use the Trojan Horse Method to study neutron-induced reactions has been investigated. The application is of particular interest for reactions involving radioactive nuclei having short lifetime.

  20. Studying the triple - α reaction in hyperspherical harmonic approach

    Science.gov (United States)

    Nguyen, Ngoc; Nunes, Filomena

    2010-11-01

    The triple-α reaction is studied by using hyperspherical harmonic (HH) method [1]. Starting from three body model, we determine the 2^+ state and the 0^+ resonance as well as the quadrupole strength function B(E2). The triple-α reaction rate are calculated. We also carefully consider the contributions of the nonresonant continuum states to the reaction rate at low temperature (T Ogata, M.Kan, M.Kamimura, Prog. Theor. Phys. 122, 1055 (2009).[0pt] [3] R. de Diego, E. Garrido, D.V. Fedorov, A.S. Jensen, arXiv:1005.5647v1.

  1. On the extended loop calculus

    CERN Document Server

    Griego, J R

    1995-01-01

    Some features of extended loops are considered. In particular, the behaviour under diffeomorphism transformations of the wavefunctions with support on the extended loop space are studied. The basis of a method to obtain analytical expressions of diffeomorphism invariants via extended loops are settled. Applications to knot theory and quantum gravity are considered.

  2. Study on the radiative decays of h{sub c} via intermediate meson loops model

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Qi; Li, Gang; Zhang, Yawei [Qufu Normal University, College of Physics and Engineering, Qufu (China)

    2017-05-15

    Recently, the BESIII Collaboration reported two new decay processes: h{sub c}(1P) → γη and γη{sup '}. Inspired by this measurement, we propose to study the radiative decays of h{sub c} via intermediate charmed meson loops in an effective Lagrangian approach. With the acceptable cutoff parameter range, the calculated branching ratios of h{sub c}(1P) → γη and γη{sup '} are of the orders of 10{sup -4} to 10{sup -3} and 10{sup -3} to 10{sup -2}, respectively. The ratio R{sub h{sub c}} = B(h{sub c} → γη)/ B(h{sub c} → γη{sup '}) can reproduce the experimental measurements with the commonly acceptable α range. This ratio provide us with some information on the η-η{sup '} mixing, which may be helpful for us to test the SU(3)-flavor symmetries in QCD. (orig.)

  3. Experimental Study on the Hydrodynamics and Mass Transfer Characteristics of Airlift Loop Reactors(ALR)

    Institute of Scientific and Technical Information of China (English)

    Tang Lixin; Han Pingfang; Lu Xiaoping

    2007-01-01

    The promoting effect of ultrasonic wave on the hydrodynamics and mass transfer characteristics of the airlift loop reactor was studied. The effect of the airlift reactor and ultrasonic wave on the reactor's gas holdup, liquid circulation velocity, mixing time and overall volumetric mass transfer coefficient respectively with and without the presence of ultrasonic wave is empathetically examined and compared. The experiment has proven that the incorporation of ultrasonic wave has no effect on the gas holdup but has the tendency to gradually decrease the liquid circulation velocity and increase the overall volumetric mass transfer coefficient; the effect on the mixing time is relatively complex. At low gas velocity, low powered ultrasonic wave promotes the radial mixing of fluid; with the increase of ultrasonic power, ultrasonic vibration obstructs the radial mixing of fluid. Therefore, there exists an optimal ultrasonic power. Moreover, the effect of ultrasonic wave on the mixing time gradually decreases with the increase of the superficial gas velocity. Correlations were also proposed for the hydrodynamics and mass transfer characteristics of the reactor.

  4. A Study of the Closed-Loop Supply Chain Coordination on Waste Glass Bottles Recycling

    Directory of Open Access Journals (Sweden)

    Wenxue Ran

    2016-01-01

    Full Text Available The recycling of waste products can sharply save manufacturing cost and improve the economic efficiency and corporate-reputation. It also has a great effect on the environment and resources protection. In the management of the closed-loop supply chain, the recycling of waste products and decision-making on pricing often directly affect the supply and demand of products and the operation efficiency of supply chain. Therefore, first we take waste glass bottles as an example and establish a mathematical model to solve the profit of manufacturers and retailers solely. Then, we analyzed whole supply chain profit under a dual-channel recycling condition which is directly recycled by consumers or by retailers. Finally, we concluded that no matter what product’s price, quality, profit, or operational efficiency of supply chain is, the overall recycling is better than the single node recycling model. Based on the analysis, we developed a new model to coordinate the profit of manufacturers and retailers in the supply chain with revenue-sharing contract. A numerical study shows that this approach is applicable and effective.

  5. Opportunities for nuclear reaction studies at future facilities

    CERN Document Server

    Veselsky, Martin; Vujisicova, Nikoleta; Souliotis, Georgios A

    2016-01-01

    Opportunities for investigations of nuclear reactions at the future nuclear physics facilities such as radioactive ion beam facilities and high-power laser facilities are considered. Post-accelerated radioactive ion beams offer possibilities for study of the role of isospin asymmetry in the reaction mechanisms at various beam energies. Fission barrier heights of neutron-deficient nuclei can be directly determined at low energies. Post-accelerated radioactive ion beams, specifically at the future facilities such as HIE-ISOLDE, SPIRAL-2 or RAON-RISP can be also considered as a candidate for production of very neutron-rich nuclei via mechanism of multi-nucleon transfer. High-power laser facilities such as ELI-NP offer possibilities for nuclear reaction studies with beams of unprecedented properties. Specific cases such as ternary reactions or even production of super-heavy elements are considered.

  6. Study on Immobilized Lipase Catalyzed Transesterification Reaction of Tung Oil

    Institute of Scientific and Technical Information of China (English)

    XU Gui-zhuan; ZHANG Bai-liang; LIU Sheng-yong; YUE Jian-zhi

    2006-01-01

    The transesterification reaction conditions of tung oil with methanol have been studied in this article, with immobilized lipase NOVO435 as catalyst. The response surface methodology was used to optimize the transesterification reaction of tung oil in a nonsolvent system. The optimal conditions were rotation rate 200 r/min, molar ratio of methanol to oil 2.2:1,reaction temperature 43℃, and the catalyst amount 14% (based on the weight of oil). After reacting for 18 h, 67.5% of the oil was converted to its corresponding methyl esters (the theoretical ester conversion was 73.3%). The lipase was washed by organic solvents after each reaction and was reused again. The esters conversion of tung oil was decreased by 6% after the lipase was reused for 120 h. The theoretical amount of methanol was added in two steps, 85% ester conversion was obtained after 36 h of reaction (theoretical ester conversion was 100%). The molar ratio of methanol to oil, the catalyst amount, the reaction temperature, and reaction time were all highly significant factors, and there was a relative significant interaction between every two factors.

  7. NMR spectroscopic study on methanolysis reaction of vegetable oil

    Energy Technology Data Exchange (ETDEWEB)

    Fangming Jin; Kohei Kawasaki; Hisanori Kishida; Kazuyuki Tohji; Takehoko Moriya; Heiji Enomoto [Tohoku University, Sendai (Japan). Graduate School of Environmental Studies

    2007-05-15

    This study is to clarify the pathways of the transesterification of vegetable oil by applying NMR to the identification of intermediates in the transesterification reaction. Results showed that the significant methanolysis product was sn-1,3-diglycerides in diglycerides, and sn-2-monoglycerides was not found. These analytical results suggest that the methanolysis reaction may occur easily at the sn-2-position for both sn-tri- and sn-1,2-diglycerides. Short communication. 16 refs., 6 figs., 2 tabs.

  8. Catalytic Studies of Sodium Hydroxide and Carbon Monoxide Reaction

    Directory of Open Access Journals (Sweden)

    Surendra K. Saxena

    2012-11-01

    Full Text Available We have studied the effect of ball milling on alumina mixed nickel, magnetite and Raney nickel on the reaction: 2NaOH(s + CO (g = Na2CO3 (s + H2 (g and determined the optimum particle size for the catalysts. The best performance was shown by a 2 h ball milled Raney nickel with average crystallite size of 209 Å. This reaction serves the dual purpose of carbon sequestration and yielding hydrogen gas.

  9. Unmanned Aircraft Systems Human-in-the-Loop Controller and Pilot Acceptability Study: Collision Avoidance, Self-Separation, and Alerting Times (CASSAT)

    Science.gov (United States)

    Comstock, James R., Jr.; Ghatas, Rania W.; Vincent, Michael J.; Consiglio, Maria C.; Munoz, Cesar; Chamberlain, James P.; Volk, Paul; Arthur, Keith E.

    2016-01-01

    The Federal Aviation Administration (FAA) has been mandated by the Congressional funding bill of 2012 to open the National Airspace System (NAS) to Unmanned Aircraft Systems (UAS). With the growing use of unmanned systems, NASA has established a multi-center "UAS Integration in the NAS" Project, in collaboration with the FAA and industry, and is guiding its research efforts to look at and examine crucial safety concerns regarding the integration of UAS into the NAS. Key research efforts are addressing requirements for detect-and-avoid (DAA), self-separation (SS), and collision avoidance (CA) technologies. In one of a series of human-in-the-loop experiments, NASA Langley Research Center set up a study known as Collision Avoidance, Self-Separation, and Alerting Times (CASSAT). The first phase assessed active air traffic controller interactions with DAA systems and the second phase examined reactions to the DAA system and displays by UAS Pilots at a simulated ground control station (GCS). Analyses of the test results from Phase I and Phase II are presented in this paper. Results from the CASSAT study and previous human-in-the-loop experiments will play a crucial role in the FAA's establishment of rules, regulations, and procedures to safely, efficiently, and effectively integrate UAS into the NAS.

  10. Recent direct reaction experimental studies with radioactive tin beams

    CERN Document Server

    Jones, K L; Allmond, J M; Ayres, A; Bardayan, D W; Baugher, T; Bazin, D; Berryman, J S; Bey, A; Bingham, C; Cartegni, L; Cerizza, G; Chae, K Y; Cizewski, J A; Gade, A; Galindo-Uribarri, A; Garcia-Ruiz, R F; Grzywacz, R; Howard, M E; Kozub, R L; Liang, J F; Manning, B; Matos, M; McDaniel, S; Miller, D; Nesaraja, C D; O'Malley, P D; Padgett, S; Padilla-Rodal, E; Pain, S D; Pittman, S T; Radford, D C; Ratkiewicz, A; Schmitt, K T; Shore, A; Smith, M S; Stracener, D W; Stroberg, S R; Tostevin, J; Varner, R L; Weisshaar, D; Wimmer, K; Winkler, R

    2015-01-01

    Direct reaction techniques are powerful tools to study the single-particle nature of nuclei. Performing direct reactions on short-lived nuclei requires radioactive ion beams produced either via fragmentation or the Isotope Separation OnLine (ISOL) method. Some of the most interesting regions to study with direct reactions are close to the magic numbers where changes in shell structure can be tracked. These changes can impact the final abundances of explosive nucleosynthesis. The structure of the chain of tin isotopes is strongly influenced by the Z=50 proton shell closure, as well as the neutron shell closures lying in the neutron-rich, N=82, and neutron-deficient, N=50, regions. Here we present two examples of direct reactions on exotic tin isotopes. The first uses a one-neutron transfer reaction and a low-energy reaccelerated ISOL beam to study states in 131Sn from across the N=82 shell closure. The second example utilizes a one-neutron knockout reaction on fragmentation beams of neutron-deficient 106,108Sn...

  11. A closed-loop photon beam control study for the Advanced Light Source

    Energy Technology Data Exchange (ETDEWEB)

    Portmann, G.; Bengtsson, J.

    1993-05-01

    The third generation Advanced Light Source (ALS) will produce extremely bright photon beams using undulators and wigglers. In order to position the photon beams accurate to the micron level, a closed-loop feedback system is being developed. Using photon position monitors and dipole corrector magnets, a closed-loop system can automatically compensate for modeling uncertainties and exogenous disturbances. The following paper will present a dynamics model for the perturbations of the closed orbit of the electron beam in the ALS storage ring including the vacuum chamber magnetic field penetration effects. Using this reference model, two closed-loop feedback algorithms will be compared -- a classical PI controller and a two degree-of-freedom approach. The two degree-of-freedom method provides superior disturbance rejection while maintaining the desired performance goals. Both methods will address the need to gain schedule the controller due to the time varying dynamics introduced by changing field strengths when scanning the insertion devices.

  12. A ``perfect'' Late Phase Flare Loop: X-ray And Radio Studies

    Science.gov (United States)

    Bain, Hazel; Fletcher, L.

    2009-05-01

    We present observations of a GOES X3.1 class flare which occurred on the 24th August 2002. The event was observed by a number of instruments including RHESSI, TRACE and NoRH. This flare is particularly interesting due to its position and orientation on the west limb of the Sun. The flare appears to be perpendicular to the line of sight making it possible to ascertain the geometrical parameters of the post flare arcade loops. We investigate the decay phase of the flare by comparing X-ray and radio observations of the post flare arcade loops with models of soft x-ray and thermal gyrosynchrotron emission to characterise the electron distribution present within the loop. HMB gratefully acknowledges the support of an SPD and STFC studentship. LF gratefully acknowledges the support of an STFC Rolling Grant, and financial support by the European Commission through the SOLAIRE Network (MTRN-CT_2006-035484)

  13. SNR radio spectral index distribution and its correlation with polarization: a case study of Lupus Loop

    CERN Document Server

    Jovanović, V Borka; Borka, D

    2016-01-01

    We use radio-continuum all-sky surveys at 1420 and 408 MHz with the aim to investigate properties of the Galactic radio source Lupus Loop. The survey data at 1435 MHz, with the linear polarization of the southern sky, is also used. We calculate properties of this supernova remnant: the brightness temperature, surface brightness and radio spectral index. For determining borders and calculation of its properties, we use the method we have developed. The non-thermal nature of its radiation is confirmed. The distribution of spectral index over its area is also given. A significant correlation between the radio spectral index distribution and the corresponding polarized intensity distribution inside the loop borders is found, indicating that the polarization maps could provide us information about the distribution of interstellar medium, and thus could represent one additional way to search for new Galactic loops.

  14. SNR radio spectral index distribution and its correlation with polarization. a case study: the Lupus Loop

    Science.gov (United States)

    Borka Jovanović, V.; Jovanović, P.; Borka, D.

    2017-04-01

    We use radio-continuum all-sky surveys at 1420 and 408 MHz with the aim to investigate properties of the Galactic radio source Lupus Loop. The survey data at 1435 MHz, with the linear polarization of the southern sky, are also used. We calculate properties of this supernova remnant: the brightness temperature, surface brightness and radio spectral index. To determine its borders and to calculate its properties, we use the method we have developed. The non-thermal nature of its radiation is confirmed. The distribution of spectral index over its area is also given. A significant correlation between the radio spectral index distribution and the corresponding polarized intensity distribution inside the loop borders is found, indicating that the polarization maps could provide us information about the distribution of the interstellar medium, and thus could represent one additional way to search for new Galactic loops.

  15. Temperature-dependent loop formation kinetics in flexible peptides studied by time-resolved fluorescence spectroscopy

    Directory of Open Access Journals (Sweden)

    Harekrushna Sahoo

    2006-01-01

    Full Text Available Looping rates in short polypeptides can be determined by intramolecular fluorescence quenching of a 2,3-diazabicyclo[2.2.2]oct-2-ene-labeled asparagine (Dbo by tryptophan. By this methodology, the looping rates in glycine-serine peptides with the structure Trp-(Gly-Sern-Dbo-NH2 of different lengths (n = 0–10 were determined in dependence on temperature in D2O and the activation parameters were derived. In general, the looping rate increases with decreasing peptide length, but the shortest peptide (n=0 shows exceptional behavior because its looping rate is slower than that for the next longer ones (n=1,2. The activation energies increase from 17.5 kJ mol−1 for the longest peptide (n=10 to 20.5 kJ mol−1 for the shortest one (n=0, while the pre-exponential factors (log⁡(A/s−1 range from 10.20 to 11.38. The data are interpreted in terms of an interplay between internal friction (stiffness of the biopolymer backbone and steric hindrance effects and solvent friction (viscosity-limited diffusion. For the longest peptides, the activation energies resemble more and more the value expected for solvent viscous flow. Internal friction is most important for the shortest peptides, causing a negative curvature and a smaller than ideal slope (ca. –1.1 of the double-logarithmic plots of the looping rates versus the number of peptide chain segments (N. Interestingly, the corresponding plot for the pre-exponential factors (logA versus logN shows the ideal slope (–1.5. While the looping rates can be used to assess the flexibility of peptides in a global way, it is suggested that the activation energies provide a measure of the “thermodynamic” flexibility of a peptide, while the pre-exponential factors reflect the “dynamic” flexibility.

  16. Synthesis of medium chain glycerides by jet loop reaction process%喷射式环路反应器制备中碳链三甘油酯的新工艺

    Institute of Scientific and Technical Information of China (English)

    史修启; 孙永强; 杨卉艳; 张勇

    2012-01-01

    分别采用喷射式环路反应器工艺和搅拌釜式工艺,以辛葵酸和甘油为原料,在碱性催化剂作用下合成了中碳链三甘油酯,从反应进程、产品色泽、能源及氮气消耗、产品后处理、产品质量等方面对两种生产工艺进行了比较.实验结果表明,在反应温度250℃,n(辛葵酸)∶n(甘油)=3.2∶1,催化剂用量为辛葵酸质量的0.25%条件下,与搅拌釜式反应工艺相比,采用喷射式环路反应器反应工艺具有反应时间短、产品色泽好、能源及氮气消耗量低、反应过程对环境无污染、产品羟值低等优点,喷射式环路反应器工艺可完全替代搅拌釜式工艺用于制备中碳链三甘油酯.%Medium chain glyceride (MCT) is prepared separately in a jet loop reaction process and in a stirred tank reactor system by esterification of C8_10 fatty acid and glycerol with a base catalyst. The performances of esterification in the two reaction systems are compared in respect of reaction rate, product color arid quality, energy and nitrogen consumptions and post-treatment. At the following reaction conditions, 250t of reaction temperature, 3. 2: 1 of mole ratio of C8-10 fatty acid to glycerol and 0. 25 % of catalyst dosage ( based on mass of fatty acid) , Compared with the stirred tank reactor system,the jet loop reaction process to achieve MCT needed shorter time,less consumption of energy and nitrogen and has no pollution emission. The color of the obtained product is lighter and the hydroxyl value is lower. Therefore,the jet loop reaction process is preferred in producing MCT.

  17. Towards the use of Structural Loop Analysis to Study System Behaviour of Socio-Ecological Systems.

    Science.gov (United States)

    Abram, Joseph; Dyke, James

    2016-04-01

    Maintaining socio-ecological systems in desirable states is key to developing a growing economy, alleviating poverty and achieving a sustainable future. While the driving forces of an environmental system are often well known, the dynamics impacting these drivers can be hidden within a tangled structure of causal chains and feedback loops. A lack of understanding of a system's dynamic structure and its influence on a system's behaviour can cause unforeseen side-effects during model scenario testing and policy implementation. Structural Loop analysis of socio-ecological system models identifies dominant feedback structures during times of behavioural shift, allowing the user to monitor key influential drivers during model simulation. This work carries out Loop Eigenvalue Elasticity Analysis (LEEA) on three system dynamic models, exploring tipping points in lake systems undergoing eutrophication. The purpose is to explore the potential benefits and limitations of the technique in the field of socio-ecology. The LEEA technique shows promise for socio-ecological systems which undergo regime shifts or express oscillatory trends, but shows limited usefulness with large models. The results of this work highlight changes in feedback loop dominance, years prior to eutrophic tipping events in lake systems. LEEA could be used as an early warning signal to impending system changes, complementary to other known early warning signals. This approach could improve our understanding during critical times of a system's behaviour, changing how we approach model analysis and the way scenario testing and policy implementation are addressed in socio-ecological system models.

  18. Reaction studies of hot silicon, germanium and carbon atoms

    Energy Technology Data Exchange (ETDEWEB)

    Gaspar, P.P.

    1990-11-01

    The goal of this project was to increase the authors understanding of the interplay between the kinetic and electronic energy of free atoms and their chemical reactivity by answering the following questions: (1) what is the chemistry of high-energy carbon silicon and germanium atoms recoiling from nuclear transformations; (2) how do the reactions of recoiling carbon, silicon and germanium atoms take place - what are the operative reaction mechanisms; (3) how does the reactivity of free carbon, silicon and germanium atoms vary with energy and electronic state, and what are the differences in the chemistry of these three isoelectronic atoms This research program consisted of a coordinated set of experiments capable of achieving these goals by defining the structures, the kinetic and internal energy, and the charge states of the intermediates formed in the gas-phase reactions of recoiling silicon and germanium atoms with silane, germane, and unsaturated organic molecules, and of recoiling carbon atoms with aromatic molecules. The reactions of high energy silicon, germanium, and carbon atoms created by nuclear recoil were studied with substrates chosen so that their products illuminated the mechanism of the recoil reactions. Information about the energy and electronic state of the recoiling atoms at reaction was obtained from the variation in end product yields and the extent of decomposition and rearrangement of primary products (usually reactive intermediates) as a function of total pressure and the concentration of inert moderator molecules that remove kinetic energy from the recoiling atoms and can induce transitions between electronic spin states. 29 refs.

  19. Reaction dynamics studies for the system 7Be+58Ni

    Science.gov (United States)

    Torresi, D.; Mazzocco, M.; Acosta, L.; Boiano, A.; Boiano, C.; Diaz-Torres, A.; Fierro, N.; Glodariu, T.; Grilj, L.; Guglielmetti, A.; Keeley, N.; La Commara, M.; Martel, I.; Mazzocchi, C.; Molini, P.; Pakou, A.; Parascandolo, C.; Parkar, V. V.; Patronis, N.; Pierroutsakou, D.; Romoli, M.; Rusek, K.; Sanchez-Benitez, A. M.; Sandoli, M.; Signorini, C.; Silvestri, R.; Soramel, F.; Stiliaris, E.; Strano, E.; Stroe, L.; Zerva, K.

    2015-04-01

    The study of reactions induced by exotic weakly bound nuclei at energies around the Coulomb barrier had attracted a large interest in the last decade, since the features of these nuclei can deeply affect the reaction dynamics. The discrimination between different reaction mechanisms is, in general, a rather difficult task. It can be achieved by using detector arrays covering high solid angle and with high granularity that allow to measure the reaction products and, possibly, coincidences between them, as, for example, recently done for stable weakly bound nuclei [1, 2]. We investigated the collision of the weakly bound nucleus 7Be on a 58Ni target at the beam energy of 1.1 times the Coulomb barrier, measuring the elastic scattering angular distribution and the energy and angular distributions of 3He and 4He. The 7Be radioactive ion beam was produced by the facility EXOTIC at INFN-LNL with an energy of 22 MeV and an intensity of ~3×105 pps. Results showed that the 4He yeld is about 4 times larger than 3He yield, suggesting that reaction mechanisms other than the break-up mostly produce the He isotopes. Theoretical calculations for transfer channels and compound nucleus reactions suggest that complete fusion accounts for (41±5%) of the total reaction cross section extracted from optical model analysis of the elastic scattering data, and that 3He and 4He stripping are the most populated reaction channels among direct processes. Eventually estimation of incomplete fusion contributions to the 3,4He production cross sections was performed through semi-classical calculations with the code PLATYPUS [3].

  20. Study on the requirement for the fuel test loop performance in the HANARO

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Byung Chul; Kim, Hark Rho

    2000-06-01

    The requirement of the FTL (Fuel Test Loop) performance were investigated to reaffirm the technical feasibility of the FTL facility which is in consideration to install at the HANARO. LH hole in the reflector region and OR3 in the outer core region are considered as candidate sites for the IPS (In-Pile Section) for the analysis purpose. The achievable linear power at test fuel pin(s) and neutron flux levels at the cladding are analyzed in the IPS, which accommodates CANDU or PWR test fuel. The enrichment of test fuels is assumed as natural uranium for CANDU and 3.5% or 5% for PWR. The test fuel configuration is bundle or 7-pin in LH hole but 1-pin in OR site. For the CANDU test fuel, the target linear power of 60kW/m can not be achieved for all cases. For the PWR test fuel, the target linear power of 40kW/m is obtained at fuels located in the direction of the core for only the case of 5% bundle irradiation. From a sensitivity study, the linear power at test fuel is expected to increase at least 30% of the present results if the core bumup effect, optimization of the ratio of fuel-to-moderator number density, etc., are considered in the detail design. Thus, the linear power for PWR fuel is expected to reach the target value, and that for CANDU fuel will reach the target value if enriched fuel is used. The fast neutron flux at the test fuel cladding is estimated for most cases to be lower than one-third of the target value of 10{sup 1}4 n/cm{sup 2}-sec and expected not to reach the target value.

  1. Controlling the oscillation phase through precisely timed closed-loop optogenetic stimulation: a computational study

    Science.gov (United States)

    Witt, Annette; Palmigiano, Agostina; Neef, Andreas; El Hady, Ahmed; Wolf, Fred; Battaglia, Demian

    2013-01-01

    Dynamic oscillatory coherence is believed to play a central role in flexible communication between brain circuits. To test this communication-through-coherence hypothesis, experimental protocols that allow a reliable control of phase-relations between neuronal populations are needed. In this modeling study, we explore the potential of closed-loop optogenetic stimulation for the control of functional interactions mediated by oscillatory coherence. The theory of non-linear oscillators predicts that the efficacy of local stimulation will depend not only on the stimulation intensity but also on its timing relative to the ongoing oscillation in the target area. Induced phase-shifts are expected to be stronger when the stimulation is applied within specific narrow phase intervals. Conversely, stimulations with the same or even stronger intensity are less effective when timed randomly. Stimulation should thus be properly phased with respect to ongoing oscillations (in order to optimally perturb them) and the timing of the stimulation onset must be determined by a real-time phase analysis of simultaneously recorded local field potentials (LFPs). Here, we introduce an electrophysiologically calibrated model of Channelrhodopsin 2 (ChR2)-induced photocurrents, based on fits holding over two decades of light intensity. Through simulations of a neural population which undergoes coherent gamma oscillations—either spontaneously or as an effect of continuous optogenetic driving—we show that precisely-timed photostimulation pulses can be used to shift the phase of oscillation, even at transduction rates smaller than 25%. We consider then a canonic circuit with two inter-connected neural populations oscillating with gamma frequency in a phase-locked manner. We demonstrate that photostimulation pulses applied locally to a single population can induce, if precisely phased, a lasting reorganization of the phase-locking pattern and hence modify functional interactions between the

  2. Controlling the oscillation phase through precisely timed closed-loop optogenetic stimulation: a computational study

    Directory of Open Access Journals (Sweden)

    Annette eWitt

    2013-04-01

    Full Text Available Dynamic oscillatory coherence is believed to play a central role in flexible communication between brain circuits. To test this communication-through-coherence hypothesis, experimental protocols that allow a reliable control of phase-relations between neuronal populations are needed. In this modeling study, we explore the potential of closed-loop optogenetic stimulation for the control of functional interactions mediated by oscillatory coherence. The theory of nonlinear oscillators predicts that the efficacy of local stimulation will depend not only on the stimulation intensity but also on its timing relative to the ongoing oscillation in the target area. Induced phase-shifts are expected to be stronger when the stimulation is applied within specific narrow phase intervals. Conversely, stimulations with the same or even stronger intensity are less effective when timed randomly. Stimulation should thus be properly phased with respect to ongoing oscillations (in order to optimally perturb them and the timing of the stimulation onset must be determined by a real-time phase analysis of simultaneously recorded local field potentials (LFPs.Here, we introduce an electrophysiologically calibrated model of Channelrhodopsin 2 (ChR2-induced photocurrents, based on fits holding over two decades of light intensity. Through simulations of a neural population which undergoes coherent gamma oscillations —either spontaneously or as an effect of continuous optogenetic driving—, we show that precisely-timed photostimulation pulses can be used to shift phase, even at transduction rates smaller than 25%. We consider then a canonic circuit with two inter-connected neural populations oscillating with gamma frequency in a phase-locked manner. We demonstrate that photostimulation pulses applied locally to a single population can induce, if precisely phased, a lasting reorganization of the phase-locking pattern and hence modify functional interactions between the two

  3. Loop-to-loop coupling.

    Energy Technology Data Exchange (ETDEWEB)

    Warne, Larry Kevin; Lucero, Larry Martin; Langston, William L.; Salazar, Robert Austin; Coleman, Phillip Dale; Basilio, Lorena I.; Bacon, Larry Donald

    2012-05-01

    This report estimates inductively-coupled energy to a low-impedance load in a loop-to-loop arrangement. Both analytical models and full-wave numerical simulations are used and the resulting fields, coupled powers and energies are compared. The energies are simply estimated from the coupled powers through approximations to the energy theorem. The transmitter loop is taken to be either a circular geometry or a rectangular-loop (stripline-type) geometry that was used in an experimental setup. Simple magnetic field models are constructed and used to estimate the mutual inductance to the receiving loop, which is taken to be circular with one or several turns. Circuit elements are estimated and used to determine the coupled current and power (an equivalent antenna picture is also given). These results are compared to an electromagnetic simulation of the transmitter geometry. Simple approximate relations are also given to estimate coupled energy from the power. The effect of additional loads in the form of attached leads, forming transmission lines, are considered. The results are summarized in a set of susceptibility-type curves. Finally, we also consider drives to the cables themselves and the resulting common-to-differential mode currents in the load.

  4. Theoretical study of reaction mechanism for NCO + HCNO

    Science.gov (United States)

    Zhang, Weichao; Du, Benni; Feng, Changjun

    2007-07-01

    A detailed quantum chemical study is performed on the mechanism of the NCO + HCNO reaction, which has never been studied by theory. The potential energy surface for this reaction is characterized at the B3LYP/6-311++G(d,p) level of theory, combined with high-level CBS-QB3 single point energy calculation. Four possible product channels have been investigated. From the calculations it can be seen that the formation of HCN + NO + CO is the dominant product channel, while the pathway to products of HCNN + CO 2 is expected to be minor one, and these conclusions are in good agreement with the experimental results.

  5. Quantum Chemical Study on Reaction of Acetaldehyde with Hydroxyl Radical

    Institute of Scientific and Technical Information of China (English)

    LI,Ming(李明); ZHANG,Jin-Sheng(张金生); SHEN,Wei(申伟); MENG,Qing-Xi(孟庆喜)

    2004-01-01

    The reaction of acetaldehyde with hydroxyl radical was studied by means of quantum chemical methods. The geometries for all the stationary points on the potential energy surfaces were optimized fully, respectively, at the G3MP2, G3, and MP2/6-311++G(d,p) levels. Single-point energies of all the species were calculated at the QCISD/6-311 + +G(d,p) level. The mechanism of the reaction studied was confirmed. The predicted product is acetyl radical that is in agreement with the experiment.

  6. 废弃咖啡渣化学链气化反应特性%Reaction characteristics of chemical-looping gasification for waste coffee grounds

    Institute of Scientific and Technical Information of China (English)

    张云鹏; 刘永卓; 杨勤勤; 郭庆杰

    2016-01-01

    Iron-based composite oxygen carrier (OC) (Fe4ATP6K1) was prepared by sol-gel method, which features Fe2O3 as an active component, and natural attapugite (ATP) as an inert support, as well as being modified by KNO3. Effects of reaction temperature, flow rate of steam and molar ratio of O/C on chemical looping gasification (CLG) of coffee grounds were investigated in a high temperature fluidized bed using steam as gasification agent. It suggests that the Fe4ATP6K1 oxygen carrier as bed material could facilitate carbon conversion in CLG of coffee grounds from 71.38% to 86.25%, compared with that of SiO2. Under optimized conditions for CLG such as 900℃, 0.23 g·min−1of steam flow rate and 1 of molar ratio of O/C, up to 52.75% of average concentration of H2, 83.79 g·kg−1 of H2 production rate, and 1.30 m3·kg−1 of syngas production rate were achieved. The OC samples before and after reaction at 900℃ were characterized by X-ray diffraction (XRD) and scanning electron microscope-energy dispersive spectrometer (SEM-EDS). The interactions within phases of Fe, K and Si, and K in presence of KFeSi3O8 phase in the OCs were observed. Twenty redox cycles testing demonstrated that the Fe4ATP6K1 oxygen carrier possessed a good cyclic stability, over 75% of both carbon conversion and cold gas efficiency, while the average concentration of each gas kept almost stable.%利用溶胶-凝胶法制备了以Fe2O3为活性组分,天然凹凸棒土(ATP)为惰性载体,KNO3修饰的Fe4ATP6K1铁基复合载氧体。在高温流化床中考察了反应温度、水蒸气流量和O/C摩尔比对咖啡渣化学链气化过程的影响。结果表明,与以石英砂为床料的咖啡渣气化相比,以Fe4ATP6K1载氧体为床料的咖啡渣化学链气化对应的碳转化率由71.38%提高到86.25%。咖啡渣化学链气化的较优操作条件为:反应温度900℃、水蒸气量0.23 g·min−1、O/C摩尔比1;在此操作条件下,合成气产量达到1.30 m3

  7. Singlet oxygen reactions with flavonoids. A theoretical-experimental study.

    Directory of Open Access Journals (Sweden)

    Javier Morales

    Full Text Available Detection of singlet oxygen emission, λ(max = 1270 nm, following laser excitation and steady-state methods were employed to measure the total reaction rate constant, k(T, and the reactive reaction rate constant, k(r, for the reaction between singlet oxygen and several flavonoids. Values of k(T determined in deuterated water, ranging from 2.4×10(7 M(-1 s(-1 to 13.4×10(7 M(-1 s(-1, for rutin and morin, respectively, and the values measured for k(r, ranging from 2.8×10(5 M(-1 s(-1 to 65.7×10(5 M(-1 s(-1 for kaempferol and morin, respectively, being epicatechin and catechin chemically unreactive. These results indicate that all the studied flavonoids are good quenchers of singlet oxygen and could be valuable antioxidants in systems under oxidative stress, in particular if a flavonoid-rich diet was previously consumed. Analysis of the dependence of rate constant values with molecular structure in terms of global descriptors and condensed Fukui functions, resulting from electronic structure calculations, supports the formation of a charge transfer exciplex in all studied reactions. The fraction of exciplex giving reaction products evolves through a hydroperoxide and/or an endoperoxide intermediate produced by singlet oxygen attack on the double bond of the ring C of the flavonoid.

  8. Singlet Oxygen Reactions with Flavonoids. A Theoretical – Experimental Study

    Science.gov (United States)

    Morales, Javier; Günther, Germán; Zanocco, Antonio L.; Lemp, Else

    2012-01-01

    Detection of singlet oxygen emission, λmax = 1270 nm, following laser excitation and steady-state methods were employed to measure the total reaction rate constant, kT, and the reactive reaction rate constant, kr, for the reaction between singlet oxygen and several flavonoids. Values of kT determined in deuterated water, ranging from 2.4×107 M−1s−1 to 13.4×107 M−1s−1, for rutin and morin, respectively, and the values measured for kr, ranging from 2.8×105 M−1s−1 to 65.7×105 M−1s−1 for kaempferol and morin, respectively, being epicatechin and catechin chemically unreactive. These results indicate that all the studied flavonoids are good quenchers of singlet oxygen and could be valuable antioxidants in systems under oxidative stress, in particular if a flavonoid-rich diet was previously consumed. Analysis of the dependence of rate constant values with molecular structure in terms of global descriptors and condensed Fukui functions, resulting from electronic structure calculations, supports the formation of a charge transfer exciplex in all studied reactions. The fraction of exciplex giving reaction products evolves through a hydroperoxide and/or an endoperoxide intermediate produced by singlet oxygen attack on the double bond of the ring C of the flavonoid. PMID:22802966

  9. Computational Studies on Cinchona Alkaloid-Catalyzed Asymmetric Organic Reactions.

    Science.gov (United States)

    Tanriver, Gamze; Dedeoglu, Burcu; Catak, Saron; Aviyente, Viktorya

    2016-06-21

    Remarkable progress in the area of asymmetric organocatalysis has been achieved in the last decades. Cinchona alkaloids and their derivatives have emerged as powerful organocatalysts owing to their reactivities leading to high enantioselectivities. The widespread usage of cinchona alkaloids has been attributed to their nontoxicity, ease of use, stability, cost effectiveness, recyclability, and practical utilization in industry. The presence of tunable functional groups enables cinchona alkaloids to catalyze a broad range of reactions. Excellent experimental studies have extensively contributed to this field, and highly selective reactions were catalyzed by cinchona alkaloids and their derivatives. Computational modeling has helped elucidate the mechanistic aspects of cinchona alkaloid catalyzed reactions as well as the origins of the selectivity they induce. These studies have complemented experimental work for the design of more efficient catalysts. This Account presents recent computational studies on cinchona alkaloid catalyzed organic reactions and the theoretical rationalizations behind their effectiveness and ability to induce selectivity. Valuable efforts to investigate the mechanisms of reactions catalyzed by cinchona alkaloids and the key aspects of the catalytic activity of cinchona alkaloids in reactions ranging from pharmaceutical to industrial applications are summarized. Quantum mechanics, particularly density functional theory (DFT), and molecular mechanics, including ONIOM, were used to rationalize experimental findings by providing mechanistic insights into reaction mechanisms. B3LYP with modest basis sets has been used in most of the studies; nonetheless, the energetics have been corrected with higher basis sets as well as functionals parametrized to include dispersion M05-2X, M06-2X, and M06-L and functionals with dispersion corrections. Since cinchona alkaloids catalyze reactions by forming complexes with substrates via hydrogen bonds and long

  10. Polyakov loop and spin correlators on finite lattices a study beyond the mass gap

    CERN Document Server

    Engels, J; Neuhaus, T; Engels, J; Mitrjushkin, V K; Neuhaus, T

    1995-01-01

    We derive an analytic expression for point-to-point correlation functions of the Polyakov loop based on the transfer matrix formalism. For the 2d Ising model we show that the results deduced from point-point spin correlators are coinciding with those from zero momentum correlators. We investigate the contributions from eigenvalues of the transfer matrix beyond the mass gap and discuss the limitations and possibilities of such an analysis. The finite size behaviour of the obtained 2d Ising model matrix elements is examined. The point-to-point correlator formula is then applied to Polyakov loop data in finite temperature SU(2) gauge theory. The leading matrix element shows all expected scaling properties. Just above the critical point we find a Debye screening mass ~\\mu_D/T\\approx4~, independent of the volume.

  11. Toluene pyrolysis studies and high temperature reactions of propargyl chloride

    Energy Technology Data Exchange (ETDEWEB)

    Kern, R.D.; Chen, H.; Qin, Z. [Univ. of New Orleans, LA (United States)

    1993-12-01

    The main focus of this program is to investigate the thermal decompositions of fuels that play an important role in the pre-particle soot formation process. It has been demonstrated that the condition of maximum soot yield is established when the reaction conditions of temperature and pressure are sufficient to establish a radical pool to support the production of polyaromatic hydrocarbon species and the subsequent formation of soot particles. However, elevated temperatures result in lower soot yields which are attributed to thermolyses of aromatic ring structures and result in the bell-shaped dependence of soot yield on temperature. The authors have selected several acyclic hydrocarbons to evaluate the chemical thermodynamic and kinetic effects attendant to benzene formation. To assess the thermal stability of the aromatic ring, the authors have studied the pyrolyses of benzene, toluene, ethylbenzene, chlorobenzene and pyridine. Time-of-flight mass spectrometry (TOF) is employed to analyze the reaction zone behind reflected shock waves. Reaction time histories of the reactants, products, and intermediates are constructed and mechanisms are formulated to model the experimental data. The TOF work is often performed with use of laser schlieren densitometry (LS) to measure density gradients resulting from the heats of various reactions involved in a particular pyrolytic system. The two techniques, TOF and LS, provide independent and complementary information about ring formation and ring rupture reactions.

  12. A model study of sequential enzyme reactions and electrostatic channeling.

    Science.gov (United States)

    Eun, Changsun; Kekenes-Huskey, Peter M; Metzger, Vincent T; McCammon, J Andrew

    2014-03-14

    We study models of two sequential enzyme-catalyzed reactions as a basic functional building block for coupled biochemical networks. We investigate the influence of enzyme distributions and long-range molecular interactions on reaction kinetics, which have been exploited in biological systems to maximize metabolic efficiency and signaling effects. Specifically, we examine how the maximal rate of product generation in a series of sequential reactions is dependent on the enzyme distribution and the electrostatic composition of its participant enzymes and substrates. We find that close proximity between enzymes does not guarantee optimal reaction rates, as the benefit of decreasing enzyme separation is countered by the volume excluded by adjacent enzymes. We further quantify the extent to which the electrostatic potential increases the efficiency of transferring substrate between enzymes, which supports the existence of electrostatic channeling in nature. Here, a major finding is that the role of attractive electrostatic interactions in confining intermediate substrates in the vicinity of the enzymes can contribute more to net reactive throughput than the directional properties of the electrostatic fields. These findings shed light on the interplay of long-range interactions and enzyme distributions in coupled enzyme-catalyzed reactions, and their influence on signaling in biological systems.

  13. KINETIC MODELS STUDY OF HYDRODESULPHURIZATION VACUUM DISTILLATE REACTION

    Directory of Open Access Journals (Sweden)

    AbdulMunem A. Karim

    2013-05-01

    Full Text Available    This study deals with  kinetics of hydrodesulphurization (HDS reaction of vacuum gas oil (611-833 K which was distillated from Kirkuk crude oil and which was obtained by blending the fractions, light vacuum gas oil (611 - 650 K, medium vacuum gas oil (650-690 K, heavy vacuum gas oil (690-727 K and very heavy vacuum gas oil (727-833 K.   The vacuum gas oil was hydrotreated on a commercial cobalt-molybdenum alumina catalyst presulfied at specified conditions in a laboratory trickle bed reactor. The reaction temperature range (583-643 K,liquid hourly space velocity range (1.5-3.75 h-1 and hydrogen pressure was kept constant at 3.5 MPa with hydrogen to oil ratio about 250 lt/lt.           The conversion results for desulphurization reaction appeared to obey the second order reaction. According to this model, the rate constants for desulphurization reaction were determined. Finally, the apparent activation energy (Ea, enthalpy of activation ( H* and entropy ( S* were calculated based on the values of rate constant (k2 and were equal 80.3792 KJ/mole, 75.2974 KJ/mole and 197.493 J/mole, respectively.

  14. Experimental Studies on Heat Transfer Characteristics In Inverted Evaporator of Micaro/Miniature Capillary Pumped Loop

    Institute of Scientific and Technical Information of China (English)

    ZhuNing; HouZengqi; 等

    1996-01-01

    This paperpresents the experimental inverstigation on the heat transfer characteristics in inverted evaporator of Micro/Miniature Capillary Pumped Loop(MCPL).THe evaporation heat transfer coefficients as a function of the heat flux density,the geometrical sizes of capillary wick structure and the vapor grooves are shown.Qualitative analysis of the heat transfer characteristics of the inverted evaporator of MCPL is also made.

  15. Study of Wilson loop functionals in 2D Yang-Mills theories

    CERN Document Server

    Aroca, J M; Kubyshin, Yu.A.

    1998-01-01

    The derivation of the explicit formula for the vacuum expectation value of the Wilson loop functional for an arbitrary gauge group on an arbitrary orientable two-dimensional manifold is considered both in the continuum case and on the lattice. A contribution to this quantity, coming from the space of invariant connections, is also analyzed and is shown to be similar to the contribution of the monopoles.

  16. Integral Reduction by Unitarity Method for Two-loop Amplitudes: A Case Study

    CERN Document Server

    Feng, Bo; Huang, Rijun; Zhou, Kang

    2014-01-01

    In this paper, we generalize the unitarity method to two-loop diagrams and use it to discuss the integral bases of reduction. To test out method, we focus on the four-point double-box diagram as well as its related daughter diagrams, i.e., the double-triangle diagram and the triangle-box diagram. For later two kinds of diagrams, we have given complete analytical results in general (4-2\\eps)-dimension.

  17. Reaction pathways of the dissociation of methylal: A DFT study

    Energy Technology Data Exchange (ETDEWEB)

    Frey, H.-M.; Beaud, P.; Gerber, T.; Mischler, B.; Radi, P.P.; Tzannis, A.-P. [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

    1999-08-01

    Schemata for modelling combustion processes do not yet include reaction rates for oxygenated fuels like methylal (DMM) which is considered as an additive or replacement for diesel due to its low sooting propensity. Density functional theory (DFT) studies of the possible reaction pathways for different dissociation steps of methylal are presented. Cleavage of a hydrogen bond to the methoxy group or the central carbon atom were simulated at the BLYP/6-311++G{sup **} level of theory. The results are compared to the experiment when dissociating and/or ionising DMM with femtosecond pulses. (author) 1 fig., 1 tab., 1 ref.

  18. Theoretical Study on Catalyst Activation of Palladacycles in Heck Reaction

    Institute of Scientific and Technical Information of China (English)

    WANG Chen; FU Yao; LI Zhe; GUO Qing-Xiang

    2008-01-01

    A computational study with the B3PW91 density functional theory was carried out on the activation process of palladacycles as catalysts in the Heck reaction.Two possible pathways (i.e.anion reductive cleavage of the Pd-C bond,and olefin insertion into the Pd-C bond followed by β-H elimination)were taken into consideration.Computational results indicate that the palladacycles are activated via olefin insertion into the Pd-C bond followed by β-H elimination in the reaction conditions.

  19. Studies on the cyclization reaction of D-aspartic acid

    Institute of Scientific and Technical Information of China (English)

    Yu Chuan Li; Si Ping Pang; Yong Zhong Yu

    2007-01-01

    The cyclization reaction of D-aspartic acid was studied, the carboxyl groups of D-aspartic acid were protected by benzyl alcohol to give compound D-dibenzyl aspartate. Then (4R)-benzyl azetidine-2-one-4-carboxylate and meso-3,6-disubstituted piperazine2,5-diones were synthesized via intramolecular cyclization and intermolecular cyclization of D-dibenzyl aspartate, respectively, and their structures were confirmed by 1H NMR and MS. Both cyclization reaction conditions were also investigated in detail.

  20. Theoretical studies of the reaction e+ e- --> K+ K- gamma

    CERN Document Server

    Lesniak, Leonard

    2016-01-01

    We present studies of the e+ e- --> K+ K- gamma reaction for the e+e- center-of-mass energies close to the phi(1020) meson mass. Different mechanisms leading to the final state are considered. The strong interaction amplitudes of the K+K- pairs in the S-wave are taken into account. In addition, the photon emission in the initial state, the final state radiation effects and all the possible interference terms are included in the transition matrix elements. The K+K- effective mass distributions and the angular dependence of the reaction cross-section are calculated.

  1. Study of Daedalus Interstellar Spacecraft Reaction Chamber and Thrust Structure

    Science.gov (United States)

    Reddy, S. K.; Benaroya, H.

    Project Daedalus was the 1978 trade study that proved the feasibility of space travel utilizing fusion-based propulsion (Inertial Confinement Fusion). This paper analyzes some of the key structural aspects of the Daedalus spacecraft, in particular, the reaction chamber and thrust structure that is integral to the Daedalus spacecraft, which supports the loads resulting from the fusion reactions. First, the reaction chamber is studied computationally in terms of static loading and vibrational characteristics utilizing the finite element method. Next, a proposed bracing system is integrated into the reaction chamber and the effects are studied. Lastly, the field coils with their supporting truss structure are added to the assembly. Concepts are introduced for actuators and course-correction mechanisms that ensure the spacecraft maintains the required trajectory to rendezvous with the target system. Present-day materials and manufacturing considerations are explored based on the assumptions made in the Daedalus study. Testing, qualification, and assembly of the spacecraft are also discussed. This paper is a summary of the first author's Master's Thesis at Rutgers University.

  2. Theoretical studies of the dynamics of chemical reactions

    Energy Technology Data Exchange (ETDEWEB)

    Wagner, A.F. [Argonne National Laboratory, IL (United States)

    1993-12-01

    Recent research effort has focussed on several reactions pertinent to combustion. The formation of the formyl radical from atomic hydrogen and carbon monoxide, recombination of alkyl radicals and halo-alkyl radicals with halogen atoms, and the thermal dissociation of hydrogen cyanide and acetylene have been studied by modeling. In addition, the inelastic collisions of NCO with helium have been investigated.

  3. [The contamination under polymerase chain reaction studies: problems and solutions].

    Science.gov (United States)

    Titov, V N; Ameliushkina, V A; Rozhkova, T A

    2015-01-01

    The study was carried out to determine risk factors of false positive and false negative results under polymerase chain reaction-analysis of clinical material. The samples with high viral load can be the source of false positive results. The contamination with nucleic acids can occur at any section of polymerase chain reaction analysis. The study data permitted to establish that the most sensitive stage is isolation and purification of nucleic acids especially under manual mode of operation. The detection of positive signal in most samples of one setting indicates total contamination. The cases when only several samples are polluted are special challenge. The presence of sample with high concentration of viral nucleic acid and several samples with low concentration in one setting means necessity of repeated analysis beginning with stage of isolation of nucleic acid. The analysis of curves of accumulation of products of amplification, their forms and positioning on chart is the obligatory stage of polymerase chain reaction study in real time regimen. These actions permit to exclude the readouts of false negative testing results to departments. The study conclusions are equipotent for polymerase chain reaction testing of any nucleic acid targets.

  4. Sum Frequency Generation Studies of Hydrogenation Reactions on Platinum Nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Krier, James M. [Univ. of California, Berkeley, CA (United States)

    2013-08-31

    Sum Frequency Generation (SFG) vibrational spectroscopy is used to characterize intermediate species of hydrogenation reactions on the surface of platinum nanoparticle catalysts. In contrast to other spectroscopy techniques which operate in ultra-high vacuum or probe surface species after reaction, SFG collects information under normal conditions as the reaction is taking place. Several systems have been studied previously using SFG on single crystals, notably alkene hydrogenation on Pt(111). In this thesis, many aspects of SFG experiments on colloidal nanoparticles are explored for the first time. To address spectral interference by the capping agent (PVP), three procedures are proposed: UV cleaning, H2 induced disordering and calcination (core-shell nanoparticles). UV cleaning and calcination physically destroy organic capping while disordering reduces SFG signal through a reversible structural change by PVP.

  5. NATO Advanced Study Institute on Advances in Chemical Reaction Dynamics

    CERN Document Server

    Capellos, Christos

    1986-01-01

    This book contains the formal lectures and contributed papers presented at the NATO Advanced Study Institute on. the Advances in Chemical Reaction Dynamics. The meeting convened at the city of Iraklion, Crete, Greece on 25 August 1985 and continued to 7 September 1985. The material presented describes the fundamental and recent advances in experimental and theoretical aspects of, reaction dynamics. A large section is devoted to electronically excited states, ionic species, and free radicals, relevant to chemical sys­ tems. In addition recent advances in gas phase polymerization, formation of clusters, and energy release processes in energetic materials were presented. Selected papers deal with topics such as the dynamics of electric field effects in low polar solutions, high electric field perturbations and relaxation of dipole equilibria, correlation in picosecond/laser pulse scattering, and applications to fast reaction dynamics. Picosecond transient Raman spectroscopy which has been used for the elucidati...

  6. Study on Hardware-in-loop Simulation of Twin-screw Extruder Experiment System

    Institute of Scientific and Technical Information of China (English)

    2010-01-01

    <正>In order to facilitate the teaching of industrial processes and experiments on the twin-screw extruder control debugging,and be closer to the actual testing,to reduce the debugging costs and the risk of debugging process,the paper designs a hardware-in-loop simulation of twin-screw extruder experiment system which is closer to scene,low cost and high safety.The system through the establishment of twin-screw extruder’s mathematical model on computer to simulate the realistic system and there is hardware practicality in the computer simulation loop.The hardware based on C8051F020 can operate in the simulation loop in real time.In computer software design, we desigh man-machine interface that is intuitive and easy to operate,can reflect twin-screw extruder main operation information vividly.Finally,twin-screw extruder’s 3 heater temperature mathematical model and PID incremental control algorithm are presented.

  7. Study on rejection characteristic of current loop to the base disturbance of optical communication system

    Science.gov (United States)

    Mao, Yao; Deng, Chao; Liu, Qiong; Cao, Zheng

    2016-10-01

    As laser has narrow transmitting beam and small divergence angle, the LOS (Line of Sight) stabilization of optical communication system is a primary precondition of laser communication links. Compound axis control is usually adopted in LOS stabilization of optical communication system, in which coarse tracking and fine tracking are included. Rejection against high frequency disturbance mainly depends on fine tracking LOS stabilization platform. Limited by different factors such as mechanical characteristic of the stabilization platform and bandwidth/noise of the sensor, the control bandwidth of LOS stabilization platform is restricted so that effective rejection of high frequency disturbance cannot be achieved as it mainly depends on the isolation characteristic of the platform itself. It is proposed by this paper that current loop may reject the effect of back-EMF. By adopting the method of electric control, high frequency isolation characteristic of the platform can be improved. The improvement effect is similar to increasing passive vibration reduction devices. Adopting the double closed loop control structure of velocity and current with the combining of the rejection effect of back-EMF caused by current loop is equivalent to reducing back-EMF coefficient, which can enhance the isolation ability of the LOS stabilization platform to high frequency disturbance.

  8. (n,xn γ reaction cross section measurements for (n,xn reaction studies

    Directory of Open Access Journals (Sweden)

    Rouki Chariklia

    2013-03-01

    Full Text Available In the context of improvement of nuclear data bases for future nuclear reactor researches, we study (n,xn reactions experimentally with the help of the (n,xn γ technique. The experiments are performed at the GELINA facility which delivers a pulsed, white neutron beam. Several measurement campaigns have been performed on 235U, 232Th, 182,183,184,186W and 238U isotopes. A compilation of all these experimental cross sections (mostly still preliminary compared to theoretical predictions will be discussed.

  9. CLINICOPATHOLOGICAL STUDY OF LICHENOID REACTIONS: A RETROSPECTIVE ANALYSIS

    Directory of Open Access Journals (Sweden)

    Ravikant

    2015-04-01

    Full Text Available BACKGROUND: Lichenoid dermatose s refer to various, clinically different inflammatory dermatoses which share in common, various essential lichenoid histologic features. AIMS AND OBJECTIVE: In this study we have analysed the different clinicopathological aspects in lichenoid reactions, as prompt diagnosis of these lesions can greatly influence the morbidity associated with the disease. STUDY DESIGN: This was a 14 month retrospective analysis of cases presenting to the department of dermatology from June 2013 till July 2014. MATERIALS AND METHODS: All new patients diagnosed with lichenoid reaction clinically and histopathologically were included in the study. INCLUSION CRITERIA: All newly diagnosed cases of Lichenoid tissue reactions within the time period mentioned above . EXCLUSION CRITERI A: Patients whose adequate records were unavailable Statistical Analysis: The SPSS, version 13 software was used to statistically analyse the data. RESULTS: A total of 66 cases were diagnosed as lichenoid reactions, 51 were lichen planus and 15 had licheno id eruptions. Males (53% were more commonly affected than female s (47%, with lower limbs (69. 69% being the most common site of predilection. Oral lesions were seen among eleven patients. Histopathologically, the most consistent findings with lichenoid r eaction was the presence of a lymphocytic infiltrate followed by vacuolar degeneration of basal cell layer, hyperkeratosis, hypergranulosis, acanthosis, pigment incontinence and a band like infiltrate over the basal layer. CONCLUSION: In our study, Licheno id reactions were more common among adults from the 2 nd to 4 th decade and can show ed a male preponderance, with the most frequent archetype being lichen planus. Thus this study emphasises on the need of histological analysis in various clinically similar c ases of lichenoid dermatoses in order to arrive at a definitive diagnosis.

  10. 压敏胶带Loop Tack试验方法初探%Preliminary study on Loop Tack method for pressure-sensitive adhesive tape

    Institute of Scientific and Technical Information of China (English)

    吴巨永; 徐社阳; 范德明; 邓小华

    2010-01-01

    以SBSC苯乙烯-丁二烯-苯乙烯嵌段共聚物)弹性体为热熔型压敏胶(PSA)的基体树脂,采用Loop Tack(环形或胶圈初粘力)法和斜面滚球法测定PSA的初粘力,并探讨了胶层厚度、PSA的储能模量以及黏贴材料的种类等对PSA初粘力测试结果的影响.结果表明:Loop Tack法中基材因折痕作用力给胶层施加了瞬间应力;在储能模量相差不大的情况下,斜面滚球法测试结果不理想的胶体却在Loop Tack测试中表现出良好的初粘力值;同一PSA在玻璃面板上测得的最大剥离力均大于镜面钢板上测得的数据(两者相差2.56%~6.12%).

  11. Feasibility Study of a 6.6kV, 1MW Transformerless BTB-Based Loop Controller

    Science.gov (United States)

    Yonetani, Shinsuke; Fujita, Hideaki; Akagi, Hirofumi; Okada, Naotaka

    This paper achieves a feasibility study of a 6.6kV, 1MW loop controller that consists of a transformerless back-to-back configuration using two 5-level diode-clamped converters. However, the loop controller requires reducing the zero-sequence current circulating between the two distribution lines below than 0.2 A in rms, in order to avoid malfunction of line-to-ground fault protection relays. Moreover, all the dc voltages across four capacitors in the dc link have to be controlled equally. This paper presents a solution to these problems. Two common-mode chokes are installed at the ac side of each converter to suppress high-frequency zero-sequence currents, while feedback control is applied to eliminate low-frequency zero-sequence currents. Two bidirectional buck-boost dc-dc converters are employed to keep the four capacitor voltages equal. Simulation results verify viability and effectiveness of the loop controller, along with the developed theoretical analysis.

  12. Theoretical study of closed-loop recycling liquid-liquid chromatography and experimental verification of the theory.

    Science.gov (United States)

    Kostanyan, Artak E; Erastov, Andrey A

    2016-09-02

    The non-ideal recycling equilibrium-cell model including the effects of extra-column dispersion is used to simulate and analyze closed-loop recycling counter-current chromatography (CLR CCC). Previously, the operating scheme with the detector located before the column was considered. In this study, analysis of the process is carried out for a more realistic and practical scheme with the detector located immediately after the column. Peak equation for individual cycles and equations describing the transport of single peaks and complex chromatograms inside the recycling closed-loop, as well as equations for the resolution between single solute peaks of the neighboring cycles, for the resolution of peaks in the recycling chromatogram and for the resolution between the chromatograms of the neighboring cycles are presented. It is shown that, unlike conventional chromatography, increasing of the extra-column volume (the recycling line length) may allow a better separation of the components in CLR chromatography. For the experimental verification of the theory, aspirin, caffeine, coumarin and the solvent system hexane/ethyl acetate/ethanol/water (1:1:1:1) were used. Comparison of experimental and simulated processes of recycling and distribution of the solutes in the closed-loop demonstrated a good agreement between theory and experiment.

  13. A randomized, placebo-controlled study of loop diuretics in patients with essential hypertension : The bumetanide and furosemide on lipid profile (BUFUL) clinical study report

    NARCIS (Netherlands)

    Donders, SH; Cleophas, TJ; Niemeyer, MG; van der Meulen, J; Bernink, PJ; de Planque, BA; van der Wall, EE

    1998-01-01

    This study was conducted to determine whether loop diuretics are more effective than placebo in reducing blood pressure without raising serum lipid levels, and whether bumetanide is more effective than furosemide in this respect In a double-blind, 24-week placebo-controlled crossover study, 27 patie

  14. Study on the Reaction Mechanism of Naphthalene with Oxalyl Chloride

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The reaction of naphthalene with oxalyl chloride in the presence of anhydrous AlCl3 was investigated. The homolog of dinaphthyl methanone can be obtained mainly from this reaction. Naphthalene conversion does not have evident correlation with the amount of AlCl3. The results show that the reaction proceeds via carbon cation electrophilic substitution reaction-free radical substitution reaction pathway.

  15. Unified studies of structure and reactions in light unstable nuclei

    Directory of Open Access Journals (Sweden)

    Ito Makoto

    2016-01-01

    Full Text Available The generalized two-center cluster model (GTCM, which can treat covalent, ionic and atomic configurations in general systems with two inert cores plus valence nucleons, is formulated in the basis of the microscopic cluster model. In this model, the covalent configurations constructed by the molecular orbital (MO method and the atomic (or ionic configuration obtained by the valence bonding (VB method can be described in a consistent manner. GTCM is applied to the light neutron-rich system, 10,12Be = α + α + XN (X = 2,4, and the unified studies of the structural changes and the reaction problem are performed. In the structure study, the calculated energy levels are characterized in terms of the chemical bonding like structures, such as the covalent MO or ionic VB structures. The chemical bonding structures changes from level to level within a small energy interval. In the unbound region, the structure problem with the total system of α + α + XN and the reaction problem, induced by the collision of an asymptotic VB state of α+6,8He, are combined by GTCM. The properties of unbound resonant states are discussed in a close connection to the reaction mechanism, and some enhancement factors originated from the properties of the intrinsic states are predicted in the reaction observables. The unified calculation of the structures and the reactions is applied to the Coulomb shift problem in the mirror system, such the 10Be and 10C nuclei. The Coulomb displacement energy of the mirror systems are discussed.

  16. Importance of closed quark loops for lattice QCD studies of tetraquarks

    CERN Document Server

    Berlin, Joshua; Alexandrou, Constantia; Brida, Mattia Dalla; Finkenrath, Jacob; Gravina, Mario; Leontiou, Theodoros; Wagner, Marc

    2016-01-01

    To investigate the light scalar tetraquark candidate $a_0(980)$ (quantum numbers $J^P =0^+$), a correlation matrix including a variety of two- and four-quark interpolating operators has to be computed. We discuss efficient techniques to compute the elements of this correlation matrix, in particular diagrams with closed quark loops. Furthermore, we present evidence that such diagrams are not negligible given our precision, and their contribution is essential to obtain physically meaningful results. In particular, we find indications of the existence of an "additional" state around the two-particle thresholds of $K+ \\bar K$ and $\\eta +\\pi$, which could correspond to the $a_0(980)$ meson.

  17. Study on bifurcation and stability of the closed-loop current-programmed boost converters

    Institute of Scientific and Technical Information of China (English)

    Zhao Yi-Bo; Zhang Dao-Yang; Zhang Chi-Jian

    2007-01-01

    In order to predict bifurcation point of the closed-loop current-programmed boost converter and enable this converter to operate at stable parameter space, this paper firstly establishes stroboscopic maps for this converter in the continuous conduction mode according to operating characteristics and topple of this converter. Parameter space at the steady state and bifurcation types are analysed together with stability theory of nonlinear equation. In the solving course, the duty cycle is avoided because of inversive solution, and accuracy is increased. Finally, correction is proved by numerical calculation.

  18. Molecular-dynamics study of detonation. II. The reaction mechanism

    Science.gov (United States)

    Rice, Betsy M.; Mattson, William; Grosh, John; Trevino, S. F.

    1996-01-01

    In this work, we investigate mechanisms of chemical reactions that sustain an unsupported detonation. The chemical model of an energetic crystal used in this study consists of heteronuclear diatomic molecules that, at ambient pressure, dissociate endothermically. Subsequent association of the products to form homonuclear diatomic molecules provides the energy release that sustains the detonation. A many-body interaction is used to simulate changes in the electronic bonding as a function of local atomic environment. The consequence of the many-body interaction in this model is that the intramolecular bond is weakened with increasing density. The mechanism of the reaction for this model was extracted by investigating the details of the molecular properties in the reaction zone with two-dimensional molecular dynamics. The mechanism for the initiation of the reaction in this model is pressure-induced atomization. There was no evidence of excitation of vibrational modes to dissociative states. This particular result is directly attributable to the functional form and choice of parameters for this model, but might also have more general applicability.

  19. Loop-mediated isothermal amplification applied to filarial parasites detection in the mosquito vectors: Dirofilaria immitis as a study model

    Directory of Open Access Journals (Sweden)

    Nelson Bryce

    2009-03-01

    Full Text Available Abstract Background Despite recent advances in our understanding of the basic biology behind transmission of zoonotic infectious diseases harbored by arthropod vectors these diseases remain threatening public health concerns. For effective control of vector and treatment, precise sampling indicating the prevalence of such diseases is essential. With an aim to develop a quick and simple method to survey zoonotic pathogen-transmitting vectors, LAMP (loop-mediated isothermal amplification was applied to the detection of filarial parasites using a filarial parasite-transmitting experimental model that included one of the mosquito vectors, Aedes aegypti, and the canine heartworm, Dirofilaria immitis. Results LAMP reactions amplifying the cytochrome oxidase subunit I gene demonstrated high sensitivity when a single purified D. immitis microfilaria was detected. Importantly, the robustness of the LAMP reaction was revealed upon identification of an infected mosquito carrying just a single parasite, a level easily overlooked using conventional microscopic analysis. Furthermore, successful detection of D. immitis in wild-caught mosquitoes demonstrated its applicability to field surveys. Conclusion Due to its simplicity, sensitivity, and reliability, LAMP is suggested as an appropriate diagnostic method for routine diagnosis of mosquito vectors carrying filarial parasites. This method can be applied to the survey of not only canine filariasis but also lymphatic filariasis, another major public health problem. Therefore, this method offers great promise as a useful diagnostic method for filarial parasite detection in endemic filariasis regions.

  20. Comparative study in LTC Combustion between a short HP EGR loop without cooler and a variable lift and duration system

    Energy Technology Data Exchange (ETDEWEB)

    Bression, Guillaume; Pacaud, Pierre; Soleri, Dominique; Cessou, Jerome [IFP (France); Azoulay, David [Renault Powertrain Div. (France); Lawrence, David [Mechadyne (United Kingdom); Doradoux, Laurent; Guerrassi, Noureddine [Delphi Diesel Systems (France)

    2008-07-01

    achieve an advantageous higher burnt gas temperature at idle speed (HC-CO emissions reduced by 35% compared to the HP EGR loop) and at low engine temperature. Even more, the VLD system's faster response time detailed in this study offers new possibilities in burnt rate transient control, especially in association with a low pressure EGR loop. (orig.)

  1. Crossed-beam studies of the dynamics of radical reactions

    Energy Technology Data Exchange (ETDEWEB)

    Liu, K. [Argonne National Laboratory, IL (United States)

    1993-12-01

    The objective of this program is to characterize the detailed dynamics of elementary radical reactions and to provide a better understanding of radical reactivity in general. The radical beam is typically generated by a laser photolysis method. After colliding with the reacting molecule in a crossed-beam apparatus, the reaction product state distribution is interrogated by laser spectroscopic techniques. Several radicals of combustion significance, such as O, CH, OH, CN and NCO have been successfully generated and their collisional behavior at the state-to-state integral cross section level of detail has been studied in this manner. During the past year, the detection system has been converted from LIF to REMPI schemes, and the emphasis of this program shifted to investigate the product angular distributions. Both inelastic and reactive processes have been studied.

  2. Keeping Energy Savings in the LOOP: Mesa Lane Partners Case Study

    Energy Technology Data Exchange (ETDEWEB)

    None

    2013-03-01

    Mesa Lane Partners (MLP) partnered with the U.S. Department of Energy (DOE) to develop and implement solutions to a build a new, low-energy mixed-use building that consumes at least 50% less energy than requirements set by Energy Standard 90.1-2007 of the American Society of Heating, Refrigerating, and Air-conditioning Engineers (ASHRAE), the American National Standards Institute (ANSI), and the Illuminating Engineering Society of America (IESNA), as part of DOE’s Commercial Building Partnerships (CBP) Program. Lawrence Berkeley National Laboratory (LBNL) provided technical expertise in support of this DOE program. The privately developed 46,000-square-foot LOOP project, which is intended to provide affordable off-campus student housing in an underserved community next to University of California at Santa Barbara, will contain more than 7,000 square feet of retail space, a roof deck, an event space, a gym, and 48 apartments. The project developer, MLP, is aiming to exceed CBP requirement, targeting energy consumption that is at least 65% less than that required by the standard. If the LOOP meets this goal, it is expected to achieve Leadership in Energy and Environmental Design (LEED) Gold certification.

  3. A Langevin dynamics simulation study of the tribology of polymer loop brushes.

    Science.gov (United States)

    Yin, Fang; Bedrov, Dmitry; Smith, Grant D; Kilbey, S Michael

    2007-08-28

    The tribology of surfaces modified with doubly bound polymer chains (loops) has been investigated in good solvent conditions using Langevin dynamics simulations. The density profiles, brush interpenetration, chain inclination, normal forces, and shear forces for two flat substrates modified by doubly bound bead-necklace polymers and equivalent singly bound polymers (twice as many polymer chains of 12 the molecular weight of the loop chains) were determined and compared as a function of surface separation, grafting density, and shear velocity. The doubly bound polymer layers showed less interpenetration with decreasing separation than the equivalent singly bound layers. Surprisingly, this difference in interpenetration between doubly bound polymer and singly bound polymer did not result in decreased friction at high shear velocity possibly due to the decreased ability of the doubly bound chains to deform in response to the applied shear. However, at lower shear velocity, where deformation of the chains in the flow direction is less pronounced and the difference in interpenetration is greater between the doubly bound and singly bound chains, some reduction in friction was observed.

  4. Study of highly efficient power generation system based on chemical-looping combustion; Chemical loop nenshoho ni yoru kokoritsu hatsuden system no kaihatsu ni kansuru kenkyu

    Energy Technology Data Exchange (ETDEWEB)

    Ishida, S.; Suzuki, T.; Yamamoto, M. [Tokyo Institute of Technology, Tokyo (Japan). Research Laboratory of Resources Utilization

    1997-02-01

    This paper describes the research and development of power generation system by means of chemical-looping combustion. For this system, fuel flows in a reduction reactor and air flows in an oxidation reactor. These two flows are separated. As a result, recovery of CO2 without energy consumption, drastic improvement of power generation efficiency, and suppression of NOx emission are expected. To realize the above, two promising candidates, NiCoO2/YSZ and NiO2/NiAl2O4, have been found as recycle solid particles between the both reactors. These have excellent oxidation/reduction cycle characteristics. By these particles as well as the existing particle, NiO/YSZ, practical application of the chemical-looping combustion is realized. Besides LNG, coal and hydrogen were considered as fuels. When using coal or hydrogen, it was found that temperature of the reduction reactor should be increased the same as that of the oxidation reactor. This is a different point from a case using LNG as a fuel. 5 refs., 2 figs.

  5. Some studies on the reaction between fly ash and lime

    Indian Academy of Sciences (India)

    A Basumajumdar; A K Das; N Bandyopadhyay; S Maitra

    2005-04-01

    The reaction between fly ash (FA) and lime is extensively exploited for the manufacture of building bricks, blocks and aggregates. To get a better idea of this reaction, FA from different sources were mixed in different ratios with lime and compacted. The compacts were treated both by ordinary water and hydrothermal curing to promote lime bearing hydrate bond formation e.g. CaO–SiO2–H2O (C–S–H), CaO–Al2O3–H2O (C–A–H) etc. The decrease in free lime content in these compacts was measured as a function of curing time and curing process. This drop in this content was correlated to the chemical composition of the fly ashes. The mathematical relationships between free lime remaining in the compacts after its maximum decrease in concentration and lime binding modulus (a ratio between the amount of added lime and the total amount of lime binding constituents present in FA) for both types of curing were developed. Further, the rate of decrease in free CaO content under both types of curing conditions was compared from kinetic study. From this study the orders of the reactions and rate constants were found out.

  6. Chemical reaction and dust formation studies in laboratory hydrocarbon plasmas.

    Science.gov (United States)

    Hippler, Rainer; Majumdar, Abhijit; Thejaswini, H. C.

    Plasma chemical reaction studies with relevance to, e.g., Titan's atmosphere have been per-formed in various laboratory plasmas [1,2]. Chemical reactions in a dielectric barrier discharge at medium pressure of 250-300 mbar have been studied in CH4 /N2 and CH4 /Ar gas mixtures by means of mass spectrometry. The main reaction scheme is production of H2 by fragmenta-tion of CH4 , but also production of larger hydrocarbons like Cn Hm with n up to 10 including formation of different functional CN groups is observed. [1] A. Majumdar and R. Hippler, Development of dielectric barrier discharge plasma processing apparatus for mass spectrometry and thin film deposition, Rev. Sci. Instrum. 78, 075103 (2007) [2] H.T. Do, G. Thieme, M. Frühlich, H. Kersten, and R. Hippler, Ion Molecule and Dust Particle Formation in Ar/CH4 , Ar/C2 H2 and Ar/C3 H6 Radio-frequency Plasmas, Contrib. Plasma Phys. 45, No. 5-6, 378-384 (2005)

  7. Direct reaction experimental studies with beams of radioactive tin ions

    Energy Technology Data Exchange (ETDEWEB)

    Jones, K. L., E-mail: kgrzywac@utk.edu; Ayres, A.; Bey, A.; Burcher, S.; Cartegni, L.; Cerizza, G. [Department of Physics and Astronomy, University of Tennessee, Knoxville, TN 37996 (United States); Ahn, S. [Department of Physics and Astronomy, University of Tennessee, Knoxville, TN 37996 (United States); National Superconducting Cyclotron Laboratory and Department of Physics and Astronomy, Michigan State University, East Lansing, MI 48824 (United States); Allmond, J. M.; Beene, J. R.; Galindo-Uribarri, A.; Liang, J. F.; Nesaraja, C. D.; Pain, S. D.; Radford, D. C.; Schmitt, K. T.; Smith, M. S.; Stracener, D. W.; Varner, R. L. [Physics Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831 (United States); Bardayan, D. W. [Physics Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831 (United States); Department of Physics, University of Notre Dame, Notre Dame, IN 46556 (United States); Baugher, T. [National Superconducting Cyclotron Laboratory and Department of Physics and Astronomy, Michigan State University, East Lansing, MI 48824 (United States); Department of Physics and Astronomy, Rutgers University, New Brunswick, NJ 08903 (United States); and others

    2015-10-15

    The tin chain of isotopes provides a unique region in which to investigate the evolution of single-particle structure, spreading from N = 50 at {sup 100}Sn, through 10 stable isotopes and the N = 82 shell closure at {sup 132}Sn out into the r-process path. Direct reactions performed on radioactive ion beams are sensitive spectroscopic tools for studying exotic nuclei. Here we present one experiment knocking out neutrons from tin isotopes that are already neutron deficient and two reactions that add a neutron to neutron-rich {sup 130}Sn. Both techniques rely on selective particle identification and the measurement of γ rays in coincidence with charged ions. We present the goals of the two experiments and the particle identification for the channels of interest. The final results will be presented in future publications.

  8. Direct Reaction Experimental Studies with Beams of Radioactive Tin Ions

    Energy Technology Data Exchange (ETDEWEB)

    Jones, K. L. [University of Tennessee, Knoxville (UTK); Ahn, S.H. [University of Tennessee, Knoxville (UTK); Allmond, James M [ORNL; Ayres, A. [University of Tennessee, Knoxville (UTK); Bardayan, Daniel W [ORNL; Baugher, T. [Michigan State University, East Lansing; Bazin, D. [Michigan State University, National Superconducting Cyclotron Laboratory (NSCL); Beene, James R [ORNL; Berryman, J. S. [Michigan State University, East Lansing; Bey, A. [University of Tennessee, Knoxville (UTK); Bingham, C. R. [University of Tennessee, Knoxville (UTK); Cartegni, L. [University of Tennessee, Knoxville (UTK); Chae, K. Y. [University of Tennessee, Knoxville (UTK)/Sungkyunkwan University, Korea; Cizewski, J. A. [Rutgers University; Gade, A. [Michigan State University, National Superconducting Cyclotron Laboratory (NSCL); Galindo-Uribarri, Alfredo {nmn} [ORNL; Garcia-Ruiz, R.F. [Instituut voor Kernen Stralingsfysica, KU Leuven, B-3001, Leuven, Belgium; Grzywacz, Robert Kazimierz [ORNL; Howard, Meredith E [ORNL; Kozub, R. L. [Tennessee Technological University (TTU); Liang, J Felix [ORNL; Manning, Brett M [ORNL; Matos, M. [Louisiana State University; McDaniel, S. [Michigan State University, East Lansing; Miller, D. [University of Tennessee, Knoxville (UTK); Nesaraja, Caroline D [ORNL; O' Malley, Patrick [Rutgers University; Padgett, S [University of Tennessee, Knoxville (UTK); Padilla-Rodal, Elizabeth [Universidad Nacional Autonoma de Mexico (UNAM); Pain, Steven D [ORNL; Pittman, S. T. [University of Tennessee (UTK) and Oak Ridge National Laboratory (ORNL); Radford, David C [ORNL; Ratkiewicz, Andrew J [ORNL; Schmitt, Kyle [ORNL; Smith, Michael Scott [ORNL; Stracener, Daniel W [ORNL; Stroberg, S. [Michigan State University, East Lansing; Tostevin, Jeffrey A [ORNL; Varner Jr, Robert L [ORNL; Weisshaar, D. [Michigan State University, East Lansing; Wimmer, K. [Michigan State University, National Superconducting Cyclotron Laboratory (NSCL)/Central Michigan University; Winkler, R. [Michigan State University, East Lansing

    2015-01-01

    The tin chain of isotopes provides a unique region in which to investigate the evolution of single-particle structure, spreading from N = 50 at Sn-100, through 10 stable isotopes and the N = 82 shell closure at Sn-132 out into the r-process path. Direct reactions performed on radioactive ion beams are sensitive spectroscopic tools for studying exotic nuclei. Here we present one experiment knocking out neutrons from tin isotopes that are already neutron deficient and two reactions that add a neutron to neutron-rich Sn-130. Both techniques rely on selective particle identification and the measurement of gamma rays in coincidence with charged ions. We present the goals of the two experiments and the particle identification for the channels of interest. The final results will be presented in future publications.

  9. Evaluation of chemokines in gingival crevicular fluid in children with band and loop space maintainers: A clinico-biochemical study

    OpenAIRE

    Kumar, Naveen Kommineni; Reddy, Veera Kishore Kasa; Padakandla, Prathyusha; Togaru, Harshini; Kalagatla, Swathi; Vinay Chand M Reddy

    2016-01-01

    Background: Chemokines are pro-inflammatory cells that can be induced during an immune response to recruit cells of the immune system to a site of infection. Aim: This study was conducted to detect the presence of chemokines, macrophage inflammatory protein-1α (MIP-1α), and 1β (MIP-1β) and estimate their levels in gingival crevicular fluid (GCF) in children with band and loop space maintainers. Materials and Methods: MIP-1α and MIP-1β levels were estimated in GCF samples from twenty healthy c...

  10. Experimental Study of Flexible Plate Vibration Control by Using Two-Loop Sliding Mode Control Strategy

    Science.gov (United States)

    Yang, Jingyu; Lin, Jiahui; Liu, Yuejun; Yang, Kang; Zhou, Lanwei; Chen, Guoping

    2016-06-01

    It is well known that intelligent control theory has been used in many research fields, novel modeling method (DROMM) is used for flexible rectangular active vibration control, and then the validity of new model is confirmed by comparing finite element model with new model. In this paper, taking advantage of the dynamics of flexible rectangular plate, a two-loop sliding mode (TSM) MIMO approach is introduced for designing multiple-input multiple-output continuous vibration control system, which can overcome uncertainties, disturbances or unstable dynamics. An illustrative example is given in order to show the feasibility of the method. Numerical simulations and experiment confirm the effectiveness of the proposed TSM MIMO controller.

  11. Experimental Study of Flexible Plate Vibration Control by Using Two-Loop Sliding Mode Control Strategy

    Science.gov (United States)

    Yang, Jingyu; Lin, Jiahui; Liu, Yuejun; Yang, Kang; Zhou, Lanwei; Chen, Guoping

    2017-08-01

    It is well known that intelligent control theory has been used in many research fields, novel modeling method (DROMM) is used for flexible rectangular active vibration control, and then the validity of new model is confirmed by comparing finite element model with new model. In this paper, taking advantage of the dynamics of flexible rectangular plate, a two-loop sliding mode (TSM) MIMO approach is introduced for designing multiple-input multiple-output continuous vibration control system, which can overcome uncertainties, disturbances or unstable dynamics. An illustrative example is given in order to show the feasibility of the method. Numerical simulations and experiment confirm the effectiveness of the proposed TSM MIMO controller.

  12. Utilization of chemical looping strategy in coal gasification processes

    Institute of Scientific and Technical Information of China (English)

    Liangshih Fan; Fanxing Li; Shwetha Ramkumar

    2008-01-01

    Three chemical looping gasification processes, i. e. Syngas Chemical Looping (SCL) process, Coal Direct Chemical Looping (CDCL) process, and Calcium Looping process (CLP), are being developed at the Ohio State University (OSU). These processes utilize simple reaction schemes to convert carbonaceous fuels into products such as hydrogen, electricity, and synthetic fuels through the transformation of a highly reactive, highly recyclable chemical intermediate. In this paper, these novel chemical looping gasification processes are described and their advantages and potential challenges for commercialization are discussed.

  13. Loop electrosurgical excisional procedure.

    Science.gov (United States)

    Mayeaux, E J; Harper, M B

    1993-02-01

    Loop electrosurgical excisional procedure, or LEEP, also known as loop diathermy treatment, loop excision of the transformation zone (LETZ), and large loop excision of the transformation zone (LLETZ), is a new technique for outpatient diagnosis and treatment of dysplastic cervical lesions. This procedure produces good specimens for cytologic evaluation, carries a low risk of affecting childbearing ability, and is likely to replace cryotherapy or laser treatment for cervical neoplasias. LEEP uses low-current, high-frequency electrical generators and thin stainless steel or tungsten loops to excise either lesions or the entire transformation zone. Complication rates are comparable to cryotherapy or laser treatment methods and include bleeding, incomplete removal of the lesion, and cervical stenosis. Compared with other methods, the advantages of LEEP include: removal of abnormal tissue in a manner permitting cytologic study, low cost, ease of acquiring necessary skills, and the ability to treat lesions with fewer visits. Patient acceptance of the procedure is high. Widespread use of LEEP by family physicians can be expected.

  14. Numerical Modeling of a Thermal-Hydraulic Loop and Test Section Design for Heat Transfer Studies in Supercritical Fluids

    Science.gov (United States)

    McGuire, Daniel

    A numerical tool for the simulation of the thermal dynamics of pipe networks with heat transfer has been developed with the novel capability of modeling supercritical fluids. The tool was developed to support the design and deployment of two thermal-hydraulic loops at Carleton University for the purpose of heat transfer studies in supercritical and near-critical fluids. First, the system was characterized based on its defining features; the characteristic length of the flow path is orders of magnitude larger than the other characteristic lengths that define the system's geometry; the behaviour of the working fluid in the supercritical thermodynamic state. An analysis of the transient thermal behaviour of the model's domains is then performed to determine the accuracy and range of validity of the modeling approach for simulating the transient thermal behaviour of a thermal-hydraulic loop. Preliminary designs of three test section geometries, for the purpose of heat transfer studies, are presented in support of the overall design of the Carleton supercritical thermal-hydraulic loops. A 7-rod-bundle, annular and tubular geometries are developed with support from the new numerical tool. Materials capable of meeting the experimental requirements while operating in supercritical water are determined. The necessary geometries to satisfy the experimental goals are then developed based on the material characteristics and predicted heat transfer behaviour from previous simulation results. An initial safety analysis is performed on the test section designs, where they are evaluated against the ASME Boiler, Pressure Vessel, and Pressure Piping Code standard, required for safe operation and certification.

  15. Association of mitochondrial DNA displacement loop polymorphisms and aggressive periodontitis in a Chinese population: a pilot study.

    Science.gov (United States)

    Wang, Xiaoxuan; Guo, Yuan; Luan, Qingxian

    2015-06-01

    To examine whether certain mitochondrial DNA (mtDNA) haplogroups and/or alterations affect susceptibility to aggressive periodontitis (AgP), we analyzed the mtDNA D-Loop region in a Han Chinese population. The mtDNA haplogroups were analyzed in 58 patients with AgP and 50 periodontally healthy controls. The frequency of haplogroups A in AgP group was significantly higher than that in the control group (p=0.007). Furthermore, the frequency of haplogroup D was higher in the control group than that in AgP group (p=0.007). The frequencies of D-Loop polymorphisms m.16126T>C, m.16290C>T and m.152 T> C were significantly higher in patients with AgP compared with controls (p=0.029, 0.014 and 0.022, respectively). Additionally, the frequencies of three other D-Loop polymorphisms, m.16223C>T m.489 T>C and m.515CA deletion (del) were significantly lower in patients with AgP compared with controls (p=0.042, 0.003 and 0.026, respectively). Our study showed for the first time, an association between AgP and mtDNA haplogroups. Haplogroups A was implicated as a risk factor for AgP, while haplogroups D exhibited a protective effect in this disease. These observations may provide a new perspective on the study of the pathogenesis of periodontitis.

  16. In situ infrared (FTIR) study of the borohydride oxidation reaction

    Energy Technology Data Exchange (ETDEWEB)

    Concha, B. Molina; Chatenet, M. [Laboratoire d' Electrochimie et de Physico-chimie, des Materiaux et des Interfaces (LEPMI), UMR 5631 CNRS/Grenoble-INP/UJF, 1130 Rue de la Piscine, BP75, 38402 Saint Martin d' Heres Cedex (France); Coutanceau, C.; Hahn, F. [Laboratoire de Catalyse en Chimie Organique (LACCO), UMR 6503 CNRS, Universite de Poitiers, 40 Av. du, Recteur Pineau, 86000 Poitiers (France)

    2009-01-15

    The direct borohydride fuel cell (DBFC) is an interesting alternative for the electrochemical power generation at lower temperatures due to its high anode theoretical specific capacity (5 A h g{sup -1}). However, the borohydride oxidation reaction (BOR) is a very complex eight-electron reaction, influenced by the nature of the electrode material (catalytic or not with respect to BH{sub 4}{sup -} hydrolysis), the [BH{sub 4}{sup -}][OH{sup -}] ratio and the temperature. In order to understand the BOR mechanism, we performed in situ infrared reflectance spectroscopy measurements (SPAIRS technique) in 1 M NaOH/1 M NaBH{sub 4} with the aim to study intermediate reactions occurring on a gold electrode (a poor BH{sub 4}{sup -} hydrolysis catalyst). We monitored several bands in B-H (1184 cm{sup -1}) and B-O bond regions (1326 and 1415 cm{sup -1}), appearing sequentially with increasing electrode polarisation. Thanks to these experimental findings, we propose possible initial elementary steps for the BOR. (author)

  17. Neutrino-nucleus reactions based on recent structure studies

    Energy Technology Data Exchange (ETDEWEB)

    Suzuki, Toshio [Department of Physics and Graduate School of Integrated Basic Sciences, College of Humanities and Sciences, Nihon University, Sakurajosui 3-25-40, Setagaya-ku, Tokyo 156-8550 (Japan); National Astronomical Observatory of Japan, Mitaka, Tokyo 181-8588 (Japan)

    2015-05-15

    Neutrino-nucleus reactions are studied with the use of new shell model Hamiltonians, which have proper tensor components in the interactions and prove to be successful in the description of Gamow-Teller (GT) strengths in nuclei. The new Hamiltonians are applied to obtain new neutrino-nucleus reaction cross sections in {sup 12}C, {sup 13}C, {sup 56}Fe and {sup 56}Ni induced by solar and supernova neutrinos. The element synthesis by neutrino processes in supernova explosions is discussed with the new cross sections. The enhancement of the production yields of {sup 7}Li, {sup 11}B and {sup 55}Mn is obtained while fragmented GT strength in {sup 56}Ni with two-peak structure is found to result in smaller e-capture rates at stellar environments. The monopole-based universal interaction with tensor force of π+ρ meson exchanges is used to evaluate GT strength in {sup 40}Ar and ν-induced reactions on {sup 40}Ar. It is found to reproduce well the experimental GT strength in {sup 40}Ar.

  18. Heck-type reactions of imine derivatives: a DFT study.

    Science.gov (United States)

    Li, Zhe; Fu, Yao; Zhang, Song-Lin; Guo, Qing-Xiang; Liu, Lei

    2010-06-01

    The mechanism of a recently discovered intramolecular Heck-type coupling of oximes with aryl halides (Angew. Chem. Int. Ed. 2007, 46, 6325) was systematically studied by using density functional methods enhanced with a polarized continuum solvation model. The overall catalytic cycle of the reaction was found to consist of four steps: oxidative addition, migratory insertion, beta-H elimination, and catalyst regeneration, whereas an alternative base-promoted C-H activation pathway was determined to be less favorable. Migratory insertion was found to be the rate determining step in the catalytic cycle. The apparent activation barrier of migratory insertion of the (E)-oxime was +20.5 kcal mol(-1), whereas the barrier of (Z)-oxime was as high as +32.7 kcal mol(-1). However, (Z)-oxime could isomerize to form the more active (E)-oxime with the assistance of K(2)CO(3), so that both the (E)- and (Z)-oxime substrates could be transformed to the desired product. Our calculations also indicated that the Z product was predominant in the equilibrium of the isomerization of the imine double bond, which constituted the reason for the good Z-selectivity observed for the reaction. Furthermore, we examined the difference between the intermolecular Heck-type reactions of imines and of olefins. It was found that in the intermolecular Heck-type coupling of imines, the apparent activation barrier of migratory insertion was as high as +35 kcal mol(-1), which should be the main obstacle of the reaction. The analysis also revealed the main problem for the intermolecular Heck-type reactions of imines, which was that the breaking of a C=N pi bond was much more difficult than the breaking of a C=C pi bond. After systematic examination of a series of substituted imines, (Z)-N-amino imine and N-acetyl imine were found to have relatively low barriers of migratory insertion, so that they might be possible substrates for intermolecular Heck-type coupling.

  19. A Study on the D-loop Region of Mitochondrial DNA (mtDNA) Mutation in Cervical Carcinomas

    Institute of Scientific and Technical Information of China (English)

    XUE Wen-qun; CHEN Dao-zhen

    2009-01-01

    Objective Background-study on genesis and development of tumor is mainly concentrated on gene mutation in nucleus. In recent years, however, the role of mitochondrial DNA (mtDNA) mutation in tumor genesis has been given more and more attention, which is the only extra-nucleus DNA in cells of higher animals. Carcinoma of the uterine cervix is a common tumor in gynecology, but there are few reports of mtDNA mutation in this area. The focus of this study was to investigate the mtDNA mutation in tumor tissues of cervical carcinomas and their relationship to tumorigenesis and tumor development. Methods The D-loop region of 24 cervical carcinomas together with the adjacent normal tissues were amplified by PCR and sequenced. Results Among the 24 cervical carcinomas, 30 mutations in 9 patients′ specimen were identified with the mutations rate of 37.5%(9/24). There were 8 microsatellite instabilities among the mutations and 13 new polymorphisms which were not reported previously in the Genbank. Conclusions The D-loop region of mitochondrial DNA is a highly polymorphoric and mutable region and the mutation rate is relatively high in patients with cervical carcinomas.

  20. An experimental study on the performance of closed loop pulsating heat pipe (CLPHP) with methanol as a working fluid

    Science.gov (United States)

    Rahman, Md. Lutfor; Nourin, Farah Nazifa; Salsabil, Zaimaa; Yasmin, Nusrat; Ali, Mohammad

    2016-07-01

    Thermal control is an important topic for thermal management of small electrical and electronic devices. Closed loop pulsating heat pipe (CLPHP) arises as the best solution for thermal control. The aim of this experimental study is to search a CLPHP of better thermal performance for cooling different electrical and electronic devices. In this experiment, methanol is used as working fluid. The effect of using methanol as a working fluid is studied on thermal performance in different filling ratios and angles of inclination. A copper capillary tube is used where the inner diameter is 2mm,outer diameter is 2.5mm and 250mm long. The CLPHP has 8 loops where the evaporation section is 50mm, adiabatic section is 120mm and condensation section is 80mm. The experiment is done using FR of 40%-70% with 10% of interval and angles of inclination 0° (vertical), 30°, 45°, 60° varying heat input. The results are compared on the basis of evaporator temperature, condenser temperature and their differences, thermal resistance, heat transfer co-efficient, power input and pulsating time. The results demonstrate the effect of methanol in different filling ratios and angles of inclination. M ethanol shows better performance at 30° inclination with 40% FR.

  1. Physicochemical studies on the reaction between formaldehyde and DNA.

    Science.gov (United States)

    FREIFELDER, D; DAVISON, P F

    1963-01-01

    The reaction between formaldehyde and phage T7 DNA has been studied by optical absorbance and sedimentation measurements. Through the course of denaturation, OD(200) and s(20, w) rise; after the attainment of full hyperchromicity the s(20, w) falls sharply, suggesting a decrease in molecular weight. Conditions in which formaldehyde causes cross-linking are defined. Some experimental applications of the denaturation technique are given. Evidence which suggests that preformed single-strand interruptions may exist in phage DNA is briefly discussed.

  2. Physicochemical Studies on the Reaction between Formaldehyde and DNA

    Science.gov (United States)

    Freifelder, David; Davison, Peter F.

    1963-01-01

    The reaction between formaldehyde and phage T7 DNA has been studied by optical absorbance and sedimentation measurements. Through the course of denaturation, OD200 and s20, w rise; after the attainment of full hyperchromicity the s20, w falls sharply, suggesting a decrease in molecular weight. Conditions in which formaldehyde causes cross-linking are defined. Some experimental applications of the denaturation technique are given. Evidence which suggests that preformed single-strand interruptions may exist in phage DNA is briefly discussed. PMID:13959526

  3. Recent studies in heavy ion induced fission reactions

    Science.gov (United States)

    Choudhury, R. K.

    2001-08-01

    Nuclear fission process involves large scale shape changes of the nucleus, while it evolves from a nearly spherical configuration to two separated fission fragments. The dynamics of these shape changes in the nuclear many body system is governed by a strong interplay of the collective and single particle degrees of freedom. With the availability of heavy ion accelerators, there has been an impetus to study the nuclear dynamics through the investigations of nucleus--nucleus collisions involving fusion and fission process. From the various investigations carried out in the past years, it is now well recognized that there is large scale damping of collective modes in heavy ion induced fission reactions, which in other words implies that nuclear motion is highly viscous. In recent years, there have been many experimental observations in heavy ion induced fission reactions at medium bombarding energies, which suggest possible occurrence of various non-equilibrium modes of fission such as quasi-fission, fast fission and pre-equilibrium fission, where some of the internal degrees of freedom of the nucleus is not fully equilibrated. We have carried out extensive investigations on the fission fragment angular distributions at near barrier bombarding energies using heavy fissile targets. The measured fragment anisotropies when compared with the standard saddle point model (SSPM) calculations show that for projectile-target systems having zero or low ground state spins, the angular anisotropy exhibits a peak-like behaviour at the sub barrier energies, which cannot be explained by the SSPM calculations. For projectiles or targets with large ground state spins, the anomalous peaking gets washed out due to smearing of the K-distribution by the intrinsic entrance channel spins. Recently studies have been carried out on the spin distributions of fission fragments through the gamma ray multiplicity measurements. The fission fragments acquire spin mainly from two sources: (i) due to

  4. A new setup for the underground study of capture reactions

    CERN Document Server

    Casella, C; Lemut, A; Limata, B; Bemmerer, D; Bonetti, R; Broggini, C; Campajola, L; Cocconi, P; Corvisiero, P; Cruz, J; D'Onofrio, A; Formicola, A; Fülöp, Z; Gervino, G; Gialanella, L; Guglielmetti, A; Gustavino, C; Gyürky, G; Loiano, A; Imbriani, G; Jesus, A P; Junker, M; Musico, P; Ordine, A; Parodi, F; Parolin, M; Pinto, J V; Prati, P; Ribeiro, J P; Roca, V; Rogalla, D; Rolfs, C; Romano, M; Rossi-Alvarez, C; Rottura, A; Schuemann, F; Somorjai, E; Strieder, F; Terrasi, F; Trautvetter, H P; Vomiero, A; Zavatarelli, S

    2002-01-01

    For the study of astrophysically relevant capture reactions in the underground laboratory LUNA a new setup of high sensitivity has been implemented. The setup includes a windowless gas target, a 4 pi BGO summing crystal, and beam calorimeters. The setup has been recently used to measure the d(p,gamma) sup 3 He cross-section for the first time within its solar Gamow peak, i.e. down to 2.5 keV c.m. energy. The features of the optimized setup are described.

  5. Study of all Reaction Channels in Deuteron-Deuteron Scattering

    Science.gov (United States)

    Ramazani-Moghaddam-Arani, A.; Amir-Ahmadi, H. R.; Bacher, A. D.; Bailey, C. D.; Biegun, A.; Eslami-Kalantari, M.; Gašparić, I.; Joulaeizadeh, L.; Kalantar-Nayestanaki, N.; Kistryn, St.; Kozela, A.; Mardanpour, H.; Messchendorp, J. G.; Micherdzinska, A. M.; Moeini, H.; Shende, S. V.; Stephan, E.; Stephenson, E. J.; Sworst, R.

    Few-nucleon systems can be used as fundamental laboratories for studying details of the nuclear force effects. We performed a series of deuteron-deuteron scattering experiments at intermediate energies. The experiments exploited BINA and BBS experimental setups and polarized deuteron beams with kinetic energies of 65 and 90 MeV/nucleon. These experiments aim to measure differential cross sections, vector and tensor analyzing powers of all available reaction channels in deuteron-deuteron scattering. With these data we will provide a systematic database, which will be used to test present theoretical approximations and upcoming ab-initio calculations in four-nucleon system.

  6. Electrochemical studies of reaction of ciprofloxcin and DNA

    Institute of Scientific and Technical Information of China (English)

    Qiaocui SHI; Sufen WANG; Bin ZHU; Min JI

    2008-01-01

    The electrochemical behavior of ciprofloxacin (CFX) and its interaction with the natural calf thymus DNA (ctDNA) is studied by using pulse difference voltammetry on a carbon electrode. CFX shows a well-defined oxidative peak at+0.88 V. As a result of reaction with ctDNA,the oxidative peak of CFX decreased markedly. According to the electrochemical equation deduced in this paper, the binding constant of 1.36 × 105 (mol/L)-1 and the binding size of 1.94 (base pairs) of CFX with ctDNA were obtained by nonlinear fit analysis of the electrochemical data. The mechanism of the interaction was explored.

  7. Reaction mechanism study of 7Li(7Li, 6He) reaction at above Coulomb barrier energies

    Indian Academy of Sciences (India)

    V V Parkar; V Jha; S Santra; B J Roy; K Ramachandran; A Shrivastava; K Mahata; A Chatterjee; S Kailas

    2009-02-01

    The elastic scattering and the 6He angular distributions were measured in 7Li + 7Li reaction at two energies, lab = 20 and 25 MeV. FRDWBA calculations have been performed to explain the measured 6He data. The calculations were very sensitive to the choice of the optical model potentials in entrance and exit channels. The one-step proton transfer was found to be the dominant reaction mechanism in 6He production.

  8. A Review of Haptoglobin Typing Methods for Disease Association Study and Preventing Anaphylactic Transfusion Reaction

    Directory of Open Access Journals (Sweden)

    Dae-Hyun Ko

    2013-01-01

    Full Text Available Haptoglobin, the product of the gene, is a glycoprotein involved in the scavenging of free hemoglobin. Haptoglobin levels increase or decrease in response to various acquired conditions, and they are also influenced by genetic predisposition. There were 2 major alleles, and , and 1 minor allele, . Many researchers have attempted to study the haptoglobin types and their association with disease; however, no definitive conclusions have been reached yet. It is reported that patients who are genetically deficient in haptoglobin are at risk of anaphylaxis against blood components containing haptoglobin. Haptoglobin genotypes also affect the reference intervals of haptoglobin levels. Many studies have attempted to establish simple and accurate typing methods. In this paper, we have broadly reviewed several methods for haptoglobin typing—phenotyping, Southern blotting, conventional PCR, real-time PCR, and loop-mediated isothermal amplification. We discuss their characteristics, clinical applications, and limitations. The phenotyping methods are time consuming and labor intensive and not designed to detect patients harboring . The rapid and robust haptoglobin genotyping may help in preventing fatal anaphylactic reactions and in establishing the relationships between the haptoglobin phenotypes and diseases.

  9. Study of the (p,d/sup 3/He) reaction as a quasi-free reaction process

    Energy Technology Data Exchange (ETDEWEB)

    Cowley, A. A.; Roos, P. G.; Chant, N. S.; Woody, R. III; Holmgren, H. D.; Goldberg, D. A.

    1976-11-01

    The (p,d/sup 3/He) reaction on /sup 6/Li, /sup 7/Li, /sup 9/Be, and /sup 12/C has been investigated in conjunction with studies of the (p,p..cap alpha..) reaction on the same targets. Coincident data for all four targets were obtained at a bombarding energy of 100 MeV for numerous angle pairs in order to test the reaction mechanism. Comparisons of the (p,d/sup 3/He) data to both (p,p..cap alpha..) data and distorted wave impulse approximation calculations (DWIA) indicate a dominance of the direct quasi-free reaction process (p + alpha yields d + /sup 3/He). The absolute alpha-particle spectroscopic factors extracted using DWIA analysis are in agreement with the values obtained in the (p,p..cap alpha..) reaction.

  10. Reaction of Np atom with H₂O in the gas phase: reaction mechanisms and ab initio molecular dynamics study.

    Science.gov (United States)

    Li, Peng; Niu, Wenxia; Gao, Tao; Wang, Hongyan

    2014-10-01

    The gas-phase reaction of an Np atom with H2O was investigated using density functional theory and ab initio molecular dynamics. The reaction mechanisms and the corresponding potential energy profiles for different possible spin states were analyzed. Three reaction channels were found in the mechanism study: the isomerization channel, the H2 elimination channel, and the H atom elimination channel. The latter two were observed in the dynamics simulation. It was found that the branching ratio of the title reaction depends on the initial kinetic energy along the transition vector. Product energy distributions for the reaction were evaluated by performing direct classical trajectory calculations on the lowest sextet potential energy surface. The results indicate that most of the available energy appears as the translational energy of the products. The overall results indicate that the H2 elimination channel with low kinetic energy is thermodynamically favored but competes with the H atom elimination channel with higher kinetic energy.

  11. A statistical study on the brightening propagation of post-flare loops

    Institute of Scientific and Technical Information of China (English)

    LI LePing; DUAN HongYu; ZHANG Jun

    2009-01-01

    After examining the data observed by TRACE 171 and 195 A from May 1998 to December 2006, we choose as our sample 190 (39 X-class and 151 M-class) flare events which display post-flare loops (PFLs). We investigate the brightening propagation of these PFLs of the events in the sample along the magnetic neutral lines. In most of the cases, the length of the flare ribbons (FRs) ranges from 20 to 170 Mm. The propagating duration of the brightening lasts 10-60 min. The velocities of the propagation associated with the flare strenght and the legth of the FRs,range from 5 to 35 km·s~(-1).Furthermore,a greater propagating velocity corresponds to a greater deceleration (or acceleration). These PFLs display three types of propagating patterns: (1) the brightening begins at the middle part of a set of PFLs, and propagates bi-directionally towards its both ends; (2) the brightening first appears at one end of a set of PFLs, and then propagates to the other; (3) the initial brightening takes place at two (or more than two) positions on two (or more than two) sets of PFLs, and each brightening propagates bi-directionally along the magnetic neutral line.

  12. A statistical study on the brightening propagation of post-flare loops

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    After examining the data observed by TRACE 171 and 195  from May 1998 to December 2006, we choose as our sample 190 (39 X-class and 151 M-class) flare events which display post-flare loops (PFLs). We investigate the brightening propagation of these PFLs of the events in the sample along the magnetic neutral lines. In most of the cases, the length of the flare ribbons (FRs) ranges from 20 to 170 Mm. The propagating duration of the brightening lasts 10-60 min. The velocities of the propagation associated with the flare strength and the length of the FRs, range from 5 to 35 km·s-1. Furthermore, a greater propagating velocity corresponds to a greater deceleration (or acceleration). These PFLs display three types of propagating patterns: (1) the brightening begins at the middle part of a set of PFLs, and propagates bi-directionally towards its both ends; (2) the brightening first appears at one end of a set of PFLs, and then propagates to the other; (3) the initial brightening takes place at two (or more than two) positions on two (or more than two) sets of PFLs, and each brightening propagates bi-directionally along the magnetic neutral line.

  13. Studies on the closed-loop digital control of multi-modular reactors. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Bernard, J.A. [Massachusetts Inst. of Tech., Cambridge, MA (United States). Nuclear Reactor Lab.; Henry, A.F.; Lanning, D.D.; Meyer, J.E. [Massachusetts Inst. of Tech., Cambridge, MA (United States). Dept. of Nuclear Engineering

    1992-11-01

    This report describes the theoretical development and the evaluation via both experiment and simulation of digital methods for the closed-loop control of power, temperature, and steam generator level in multi-modular reactors. The major conclusion of the research reported here is that the technology is currently available to automate many aspects of the operation of multi-modular plants. This will in turn minimize the number of required personnel and thus contain both operating and personnel costs, allow each module to be operated at a different power level thereby staggering the times at which refuelings would be needed, and maintain the competitiveness of US industry relative to foreign vendors who are developing and applying advanced control concepts. The technology described in this report is appropriate to the proposed multi-modular reactor designs and to present-generation pressurized water reactors. Its extension to boiling water reactors is possible provided that the commitment is made to create a real-time model of a BWR. The work reported here was performed by the Massachusetts Institute of Technology (MIT) under contract to the Oak Ridge National Laboratory (ORNL) and to the United States Department of Energy (Division of Industry and University Programs, Contract No. DE-FG07-90ER12930.)

  14. Studies on the closed-loop digital control of multi-modular reactors

    Energy Technology Data Exchange (ETDEWEB)

    Bernard, J.A. (Massachusetts Inst. of Tech., Cambridge, MA (United States). Nuclear Reactor Lab.); Henry, A.F.; Lanning, D.D.; Meyer, J.E. (Massachusetts Inst. of Tech., Cambridge, MA (United States). Dept. of Nuclear Engineering)

    1992-11-01

    This report describes the theoretical development and the evaluation via both experiment and simulation of digital methods for the closed-loop control of power, temperature, and steam generator level in multi-modular reactors. The major conclusion of the research reported here is that the technology is currently available to automate many aspects of the operation of multi-modular plants. This will in turn minimize the number of required personnel and thus contain both operating and personnel costs, allow each module to be operated at a different power level thereby staggering the times at which refuelings would be needed, and maintain the competitiveness of US industry relative to foreign vendors who are developing and applying advanced control concepts. The technology described in this report is appropriate to the proposed multi-modular reactor designs and to present-generation pressurized water reactors. Its extension to boiling water reactors is possible provided that the commitment is made to create a real-time model of a BWR. The work reported here was performed by the Massachusetts Institute of Technology (MIT) under contract to the Oak Ridge National Laboratory (ORNL) and to the United States Department of Energy (Division of Industry and University Programs, Contract No. DE-FG07-90ER12930.)

  15. Evaluation of chemokines in gingival crevicular fluid in children with band and loop space maintainers: A clinico-biochemical study

    Science.gov (United States)

    Kumar, Naveen Kommineni; Reddy, Veera Kishore Kasa; Padakandla, Prathyusha; Togaru, Harshini; Kalagatla, Swathi; Reddy, Vinay Chand M.

    2016-01-01

    Background: Chemokines are pro-inflammatory cells that can be induced during an immune response to recruit cells of the immune system to a site of infection. Aim: This study was conducted to detect the presence of chemokines, macrophage inflammatory protein-1α (MIP-1α), and 1β (MIP-1β) and estimate their levels in gingival crevicular fluid (GCF) in children with band and loop space maintainers. Materials and Methods: MIP-1α and MIP-1β levels were estimated in GCF samples from twenty healthy children and twenty children with band and loop space maintainers. Periodontal status was evaluated by measuring gingival index, plaque index, and Russell's periodontal index. The GCF samples were quantified by ELISA, and the levels of MIP-1α and MIP-1β were determined. Results: The mean MIP-1α concentrations in healthy children and those with space maintainers were 395.75 pg/µl and 857.85 pg/µl, respectively, and MIP-1β was 342.55 pg/µl and 685.25 pg/µl, respectively. MIP-1α and MIP-1β levels in GCF from children with space maintainers were significantly higher than in the healthy group, and statistically significant difference existed between these two groups. Conclusion: MIP-1α and MIP-1β can be considered as novel biomarkers in the biological mechanism underlying the pathogenesis of gingival inflammation in children with space maintainers. PMID:27630491

  16. Experimental and Numerical Study on the Semi-Closed Loop Control of a Planar Parallel Robot Manipulator

    Directory of Open Access Journals (Sweden)

    Yong-Lin Kuo

    2014-01-01

    Full Text Available This paper implements the model predictive control to fulfill the position control of a 3-DOF 3-RRR planar parallel manipulator. The research work covers experimental and numerical studies. First, an experimental hardware-in-the-loop system to control the manipulator is constructed. The manipulator is driven by three DC motors, and each motor has an encoder to measure the rotating angles of the motors. The entire system is designed as a semiclosed-loop control system. The controller receives the encoder signals as inputs to produce signals driving the motors. Secondly, the motor parameters are obtained by system identification, and the controllers are designed based on these parameters. Finally, the numerical simulations are performed by incorporating the manipulator kinematics and the motor dynamics; the results are compared with those from the experiments. Both results show that they are in good agreement at steady state. There are two main contributions in this paper. One is the application of the model predictive control to the planar parallel manipulator, and the other one is to overcome the effects of the uncertainties of the DC motors and the performance of the position control due to the dynamic behavior of the manipulator.

  17. Evaluation of chemokines in gingival crevicular fluid in children with band and loop space maintainers: A clinico-biochemical study

    Directory of Open Access Journals (Sweden)

    Naveen Kommineni Kumar

    2016-01-01

    Full Text Available Background: Chemokines are pro-inflammatory cells that can be induced during an immune response to recruit cells of the immune system to a site of infection. Aim: This study was conducted to detect the presence of chemokines, macrophage inflammatory protein-1α (MIP-1α, and 1β (MIP-1β and estimate their levels in gingival crevicular fluid (GCF in children with band and loop space maintainers. Materials and Methods: MIP-1α and MIP-1β levels were estimated in GCF samples from twenty healthy children and twenty children with band and loop space maintainers. Periodontal status was evaluated by measuring gingival index, plaque index, and Russell′s periodontal index. The GCF samples were quantified by ELISA, and the levels of MIP-1α and MIP-1β were determined. Results: The mean MIP-1α concentrations in healthy children and those with space maintainers were 395.75 pg/µl and 857.85 pg/µl, respectively, and MIP-1β was 342.55 pg/µl and 685.25 pg/µl, respectively. MIP-1α and MIP-1β levels in GCF from children with space maintainers were significantly higher than in the healthy group, and statistically significant difference existed between these two groups. Conclusion: MIP-1α and MIP-1β can be considered as novel biomarkers in the biological mechanism underlying the pathogenesis of gingival inflammation in children with space maintainers.

  18. Study of DNA extraction methods for use in loop-mediated isothermal amplification detection of single resting cysts in the toxic dinoflagellates Alexandrium tamarense and A. catenella.

    Science.gov (United States)

    Nagai, Satoshi; Yamamoto, Keigo; Hata, Naotugu; Itakura, Shigeru

    2012-09-01

    In a previous study, we experienced instable amplification and a low amplification success in loop-mediated isothermal amplification (LAMP) reactions from naturally occurring vegetative cells or resting cysts of the toxic dinoflagellates Alexandrium tamarense and Alexandrium catenella. In this study, we examined 4 methods for extracting DNA from single resting cysts of A. tamarense and A. catenella to obtain more stable and better amplification success and to facilitate unambiguous detection using the LAMP method. Apart from comparing the 4 different DNA extraction methods, namely, (1) boiling in Tris-EDTA (TE) buffer, (2) heating at 65 °C in hexadecyltrimethylammonium bromide buffer, (3) boiling in 0.5% Chelex buffer, and (4) boiling in 5% Chelex buffer, we also examined the need for homogenization to crush the resting cysts before DNA extraction in each method. Homogenization of resting cysts was found to be essential for DNA extraction in all 4 methods. The detection time was significantly shorter in 5% Chelex buffer than in the other buffers and the amplification success was 100% (65/65), indicating the importance of DNA extraction and the effectiveness of 5% Chelex buffer in the Alexandrium LAMP.

  19. A study of systolic time intervals in lepra reaction.

    Science.gov (United States)

    Zawar, P B; Chawhan, R N; Mahajani, V V

    1983-10-01

    Systolic time intervals (STI) were measured in 20 control subjects and 20 cases of lepromatous leprosy in lepra reaction. Significant differences in the pre-ejection period (PEP), PEP/LVET and isovolumic contraction (IVCT) were observed between the groups. The abnormalities of STI observed in patients of lepra reaction are characteristic of left ventricular dysfunction in patients of lepra reaction.

  20. A computational study of pyrolysis reactions of lignin model compounds

    Science.gov (United States)

    Thomas Elder

    2010-01-01

    Enthalpies of reaction for the initial steps in the pyrolysis of lignin have been evaluated at the CBS-4m level of theory using fully substituted b-O-4 dilignols. Values for competing unimolecular decomposition reactions are consistent with results previously published for phenethyl phenyl ether models, but with lowered selectivity. Chain propagating reactions of free...

  1. Progress in Nanoscale Studies of Hydrogen Reactions in Construction Materials

    Science.gov (United States)

    Schweitzer, J. S.; Livingston, R. A.; Cheung, J.; Rolfs, C.; Becker, H.-W.; Kubsky, S.; Spillane, T.; Zickefoose, J.; Castellote, M.; Bengtsson, N.; Galan, I.; de Viedma, P. G.; Brendle, S.; Bumrongjaroen, W.; Muller, I.

    Nuclear resonance reaction analysis (NRRA) has been applied to measure the nanoscale distribution of hydrogen with depth in the hydration of cementitious phases. This has provided a better understanding of the mechanisms and kinetics of cement hydration during the induction period that is critical to improved concrete technology. NRRA was also applied to measure the hydrogen depth profiles in other materials used in concrete construction such as fly ash and steel. By varying the incident beam energy one measures a profile with a depth resolution of a few nanometers. Time-resolved measurements are achieved by stopping the chemical reactions at specific times. Effects of temperature, sulfate concentration, accelerators and retarders, and superplasticizers have been investigated. Hydration of fly ashes has been studied with synthetic glass specimens whose chemical compositions are modeled on those of actual fly ashes. A combinatorial chemistry approach was used where glasses of different compositions are hydrated in various solutions for a fixed time. The resulting hydrogen depth profiles show significant differences in hydrated phases, rates of depth penetration and amount of surface etching. Hydrogen embrittlement of steel was studied on slow strain rate specimens under different corrosion potentials.

  2. Kinetic Study of the Austempering Reactions in Ductile Irons

    Science.gov (United States)

    Pérez, M. J.; Cisneros, M. M.; Almanza, E.; Haro, S.

    2012-11-01

    Kinetics of the reaction that occur during the austempering heat treatment in unalloyed and alloyed ductile irons with 1Cu-0.25Mo, 1Ni-0.25Mo, and 0.7Cu-1Ni-0.25Mo, was studied. The austenitization and austempering cycles were achieved by isothermal dilatometry in cylindrical samples of 2 mm in diameter and 12 mm in length. The specimens were austenitized at 870 °C for 120 min, followed by isothermal holding for 300 min at temperatures between 270 and 420 °C. Kinetic parameters such as the order of reaction " n" and the rate of reaction " k" were calculated using the Johnson-Mehl equation while the empirical activation energy was calculated by means of the Arrhenius equation. It was found that the values of " k" decreased with the addition of Cu, Ni, and Mo as well as with the reduction of the isothermal temperature. The activation energy changes with the austempering temperature, in the range 30,348-58,250 J/mol when the heat treatment was carried out between 370 and 420 °C and 10,336-26,683 J/mol when the temperature varied from 270 to 350 °C. The microstructures in samples austempered at 370 and 315 °C were observed by transmission electron microscopy. No carbides precipitation was observed on samples heat treated at 370 °C for less than 120 min, while at 315 °C carbides of hexagonal structure ɛ(Fe2.4C) were found from the beginning of the transformation. The smallest value of activation energy and a slower kinetic transformation seem to be related with the presence of a carbide phase. Additionally, the time results obtained for transformation fractions of 0.05 and 0.95 by the dilatometry analysis were used to build the temperature-time-transformation diagrams for the irons.

  3. Study of the Six-Loop Beta Function of the $\\lambda\\phi^4_4$ Theory

    OpenAIRE

    Shrock, Robert

    2016-01-01

    We investigate whether the six-loop beta function of the $\\lambda \\phi^4_4$ theory exhibits evidence for an ultraviolet zero. As part of our analysis, we calculate and analyze Pad\\'e approximants to this beta function. Extending our earlier results at the five-loop level, we find that in the range of $\\lambda$ where the perturbative calculation of the six-loop beta function is reliable, the theory does not exhibit robust evidence for an ultraviolet zero.

  4. Study of the Six-Loop Beta Function of the $\\lambda\\phi^4_4$ Theory

    CERN Document Server

    Shrock, Robert

    2016-01-01

    We investigate whether the six-loop beta function of the $\\lambda \\phi^4_4$ theory exhibits evidence for an ultraviolet zero. As part of our analysis, we calculate and analyze Pad\\'e approximants to this beta function. Extending our earlier results at the five-loop level, we find that in the range of $\\lambda$ where the perturbative calculation of the six-loop beta function is reliable, the theory does not exhibit robust evidence for an ultraviolet zero.

  5. Speedup Studies of Leading Iteration Model for Non—DO Loops in Comparison with Sequential Interation Model

    Institute of Scientific and Technical Information of China (English)

    陈海波; 慈云桂

    1989-01-01

    In this paper,we present an approximate formula for calculating th speedup of a concurrent non-DO loop.The execution pattern of a concurrent non-Do loop is analyzed.As a result,the optimal concurrent step for a non-DO loop is presened and proved.With the analysis of the speedup of a concurrent non-DO loop,a simple and useful approximate formula is deduced,which is just the mathematical limit of speedup when the number of iterations is approaching infinity.

  6. Transcription-driven twin supercoiling of a DNA loop: A Brownian dynamics study

    Science.gov (United States)

    Mielke, Steven P.; Fink, William H.; Krishnan, V. V.; Grønbech-Jensen, Niels; Benham, Craig J.

    2004-10-01

    The torque generated by RNA polymerase as it tracks along double-stranded DNA can potentially induce long-range structural deformations integral to mechanisms of biological significance in both prokaryotes and eukaryotes. In this paper, we introduce a dynamic computer model for investigating this phenomenon. Duplex DNA is represented as a chain of hydrodynamic beads interacting through potentials of linearly elastic stretching, bending, and twisting, as well as excluded volume. The chain, linear when relaxed, is looped to form two open but topologically constrained subdomains. This permits the dynamic introduction of torsional stress via a centrally applied torque. We simulate by Brownian dynamics the 100 μs response of a 477-base pair B-DNA template to the localized torque generated by the prokaryotic transcription ensemble. Following a sharp rise at early times, the distributed twist assumes a nearly constant value in both subdomains, and a succession of supercoiling deformations occurs as superhelical stress is increasingly partitioned to writhe. The magnitude of writhe surpasses that of twist before also leveling off when the structure reaches mechanical equilibrium with the torsional load. Superhelicity is simultaneously right handed in one subdomain and left handed in the other, as predicted by the "transcription-induced twin-supercoiled-domain" model [L. F. Liu and J. C. Wang, Proc. Natl. Acad. Sci. U.S.A. 84, 7024 (1987)]. The properties of the chain at the onset of writhing agree well with predictions from theory, and the generated stress is ample for driving secondary structural transitions in physiological DNA.

  7. Substrate dependent reaction channels of the Wolff–Kishner reduction reaction: A theoretical study

    Directory of Open Access Journals (Sweden)

    Shinichi Yamabe

    2014-01-01

    Full Text Available Wolff–Kishner reduction reactions were investigated by DFT calculations for the first time. B3LYP/6-311+G(d,p SCRF=(PCM, solvent = 1,2-ethanediol optimizations were carried out. To investigate the role of the base catalyst, the base-free reaction was examined by the use of acetone, hydrazine (H2N–NH2 and (H2O8. A ready reaction channel of acetone → acetone hydrazine (Me2C=N–NH2 was obtained. The channel involves two likely proton-transfer routes. However, it was found that the base-free reaction was unlikely at the N2 extrusion step from the isopropyl diimine intermediate (Me2C(H–N=N–H. Two base-catalyzed reactions were investigated by models of the ketone, H2N–NH2 and OH−(H2O7. Here, ketones are acetone and acetophenone. While routes of the ketone → hydrazone → diimine are similar, those from the diimines are different. From the isopropyl diimine, the N2 extrusion and the C–H bond formation takes place concomitantly. The concomitance leads to the propane product concertedly. From the (1-phenylethyl substituted diimine, a carbanion intermediate is formed. The para carbon of the phenyl ring of the anion is subject to the protonation, which leads to a 3-ethylidene-1,4-cyclohexadiene intermediate. Its [1,5]-hydrogen migration gives the ethylbenzene product. For both ketone substrates, the diimines undergoing E2 reactions were found to be key intermediates.

  8. A discrete model to study reaction-diffusion-mechanics systems.

    Science.gov (United States)

    Weise, Louis D; Nash, Martyn P; Panfilov, Alexander V

    2011-01-01

    This article introduces a discrete reaction-diffusion-mechanics (dRDM) model to study the effects of deformation on reaction-diffusion (RD) processes. The dRDM framework employs a FitzHugh-Nagumo type RD model coupled to a mass-lattice model, that undergoes finite deformations. The dRDM model describes a material whose elastic properties are described by a generalized Hooke's law for finite deformations (Seth material). Numerically, the dRDM approach combines a finite difference approach for the RD equations with a Verlet integration scheme for the equations of the mass-lattice system. Using this framework results were reproduced on self-organized pacemaking activity that have been previously found with a continuous RD mechanics model. Mechanisms that determine the period of pacemakers and its dependency on the medium size are identified. Finally it is shown how the drift direction of pacemakers in RDM systems is related to the spatial distribution of deformation and curvature effects.

  9. Study of Reaction Between Slag and Carbonaceous Materials

    Science.gov (United States)

    Maroufi, Samane; Mayyas, Mohannad; Mansuri, Irshad; O'Kane, Paul; Skidmore, Catherine; Jin, Zheshi; Fontana, Andrea; Sahajwalla, Veena

    2017-10-01

    The chemical interaction of a typical slag of EAF with three different carbon sources, coke, rubber-derived carbon (RDC), coke-RDC blend, was studied in atmospheric pressure at 1823 K (1550 °C). Using an IR-gas analyzer, off-gases evolved from the sample were monitored. While the coke-RDC blend exhibited the best reducing performance in reaction with molten slag, the RDC sample showed poor interaction with the molten slag. The gasification of the coke, RDC, and coke-RDC blend was also carried out under oxidizing conditions using a gas mixture of CO2 (4 wt pct) and Ar (96 wt pct) and it was shown that the RDC sample had the highest rate of gasification step C0 \\mathop{\\longrightarrow}\\limits{{k3 }}{CO} + nCf (11.6 site/g s (×6.023 × 1023/2.24 × 104)). This may be attributed to its disordered structure confirmed by Raman spectra and its nano-particle morphology observed by FE-SEM. The high reactivity of RDC with CO2 provided evidence that the Boudouard reaction was fast during the interaction with molten slag. However, low reduction rate of iron oxide from slag with RDC can be attributed to the initial weak contact between RDC and molten slag implying that the contact between carbonaceous matter and slag plays significant roles in the reduction of iron oxide from slag.

  10. A discrete model to study reaction-diffusion-mechanics systems.

    Directory of Open Access Journals (Sweden)

    Louis D Weise

    Full Text Available This article introduces a discrete reaction-diffusion-mechanics (dRDM model to study the effects of deformation on reaction-diffusion (RD processes. The dRDM framework employs a FitzHugh-Nagumo type RD model coupled to a mass-lattice model, that undergoes finite deformations. The dRDM model describes a material whose elastic properties are described by a generalized Hooke's law for finite deformations (Seth material. Numerically, the dRDM approach combines a finite difference approach for the RD equations with a Verlet integration scheme for the equations of the mass-lattice system. Using this framework results were reproduced on self-organized pacemaking activity that have been previously found with a continuous RD mechanics model. Mechanisms that determine the period of pacemakers and its dependency on the medium size are identified. Finally it is shown how the drift direction of pacemakers in RDM systems is related to the spatial distribution of deformation and curvature effects.

  11. Reaction between Chromium(III) and EDTA Ions: an Overlooked Mechanism of Case Study Reaction of Chemical Kinetics.

    Science.gov (United States)

    Cerar, Janez

    2015-01-01

    Widely cited and accepted explanation of reaction mechanism of the case study reaction of chemical kinetics between Cr(III) ions and ethylenediaminetetraacetic acid (EDTA) contradicts modern chromium(III) coordination chemistry data. Absorption UV and visible light spectra were recorded during the reaction between aqueous solution of Cr(NO(3))(3) and EDTA in order to obtain new information about this reaction. Analysis of the spectra showed that only very small fraction of intermediates may be present in solution during the course of the reaction. The reaction scheme was established and according to it calculations based on a simplified model were carried out. Literature data for constants were used if known, otherwise, adjusted values of their sound estimates were applied. Reasonable agreement of the model calculations with the experimental data was obtained for pH values 3.8 and 4.5 but the model failed to reproduce measured rate of reaction at pH 5.5, probably due to the use of the oversimplified model.

  12. A family-based intervention targeting parents of preschool children with overweight and obesity: conceptual framework and study design of LOOPS- Lund overweight and obesity preschool study

    OpenAIRE

    Önnerfält Jenny; Erlandsson Lena-Karin; Orban Kristina; Broberg Malin; Helgason Christina; Thorngren-Jerneck Kristina

    2012-01-01

    Abstract Background As the rate of overweight among children is rising there is a need for evidence-based research that will clarify what the best interventional strategies to normalize weight development are. The overall aim of the Lund Overweight and Obesity Preschool Study (LOOPS) is to evaluate if a family-based intervention, targeting parents of preschool children with overweight and obesity, has a long-term positive effect on weight development of the children. The hypothesis is that pr...

  13. Use of Multiple Reheat Helium Brayton Cycles to Eliminate the Intermediate Heat Transfer Loop for Advanced Loop Type SFRs

    Energy Technology Data Exchange (ETDEWEB)

    Haihua Zhao; Hongbin Zhang; Samuel E. Bays

    2009-05-01

    The sodium intermediate heat transfer loop is used in existing sodium cooled fast reactor (SFR) plant design as a necessary safety measure to separate the radioactive primary loop sodium from the water of the steam Rankine power cycle. However, the intermediate heat transfer loop significantly increases the SFR plant cost and decreases the plant reliability due to the relatively high possibility of sodium leakage. A previous study shows that helium Brayton cycles with multiple reheat and intercooling for SFRs with reactor outlet temperature in the range of 510°C to 650°C can achieve thermal efficiencies comparable to or higher than steam cycles or recently proposed supercritical CO2 cycles. Use of inert helium as the power conversion working fluid provides major advantages over steam or CO2 by removing the requirement for safety systems to prevent and mitigate the sodium-water or sodium-CO2 reactions. A helium Brayton cycle power conversion system therefore makes the elimination of the intermediate heat transfer loop possible. This paper presents a pre-conceptual design of multiple reheat helium Brayton cycle for an advanced loop type SFR. This design widely refers the new horizontal shaft distributed PBMR helium power conversion design features. For a loop type SFR with reactor outlet temperature 550°C, the design achieves 42.4% thermal efficiency with favorable power density comparing with high temperature gas cooled reactors.

  14. Computational Chemistry in the Undergraduate Laboratory: A Mechanistic Study of the Wittig Reaction

    Science.gov (United States)

    Albrecht, Birgit

    2014-01-01

    The Wittig reaction is one of the most useful reactions in organic chemistry. Despite its prominence early in the organic chemistry curriculum, the exact mechanism of this reaction is still under debate, and this controversy is often neglected in the classroom. Introducing a simple computational study of the Wittig reaction illustrates the…

  15. Reversible hysteresis loop tuning

    Science.gov (United States)

    Berger, A.; Binek, Ch.; Margulies, D. T.; Moser, A.; Fullerton, E. E.

    2006-02-01

    We utilize antiferromagnetically coupled bilayer structures to magnetically tune hysteresis loop properties. Key element of this approach is the non-overlapping switching field distribution of the two magnetic layers that make up the system: a hard magnetic CoPtCrB layer (HL) and a soft magnetic CoCr layer (SL). Both layers are coupled antiferromagnetically through an only 0.6-nm-thick Ru interlayer. The non-overlapping switching field distribution allows the measurement of magnetization reversal in the SL at low fields while keeping the magnetization state of the HL unperturbed. Applying an appropriate high field or high field sequence changes the magnetic state of the HL, which then influences the SL magnetization reversal due to the interlayer coupling. In this way, the position and shape of the SL hysteresis loop can be changed or tuned in a fully reversible and highly effective manner. Here, we study specifically how the SL hysteresis loop characteristics change as we move the HL through an entire high field hysteresis loop sequence.

  16. Studies on Ferromagnetic and Photoluminescence Properties of ITO and Cu-Doped ITO Nanoparticles Synthesized by Solid State Reaction

    Science.gov (United States)

    Babu, S. Harinath; Kaleemulla, S.; Rao, N. Madhusudhana; Krishnamoorthi, C.

    2016-11-01

    Cubic structured indium-tin-oxide (ITO) and copper-doped ITO nanoparticles were synthesized by solid state reaction. The structure, morphology, chemical, magnetic, and photoluminescence properties of the synthesized nanoparticles were studied by x-ray diffraction, field emission scanning electron microscopy, x-ray photoelectron spectroscopy, vibrating sample magnetometry, and photoluminescence spectrophotometry, respectively. Magnetic studies confirmed that the ITO nanoparticles were ferromagnetic at room temperature (300 K) and at 100 K, and it was believed that the observed ferromagnetism may be due to oxygen vacancies and defects present in the system. No hysteresis loop was observed in copper-doped ITO nanoparticles at room temperature and 100 K. The ITO and Cu-doped ITO nanoparticles exhibited two broad emission peaks in the visible region of the electromagnetic spectrum.

  17. Recent studies in heavy ion induced fission reactions

    Indian Academy of Sciences (India)

    R K Choudhury

    2001-08-01

    Nuclear fission process involves large scale shape changes of the nucleus, while it evolves from a nearly spherical configuration to two separated fission fragments. The dynamics of these shape changes in the nuclear many body system is governed by a strong interplay of the collective and single particle degrees of freedom. With the availability of heavy ion accelerators, there has been an impetus to study the nuclear dynamics through the investigations of nucleus–nucleus collisions involving fusion and fission process. From the various investigations carried out in the past years, it is now well recognized that there is large scale damping of collective modes in heavy ion induced fission reactions, which in other words implies that nuclear motion is highly viscous. In recent years, there have been many experimental observations in heavy ion induced fission reactions at medium bombarding energies, which suggest possible occurrence of various non-equilibrium modes of fission such as quasi-fission, fast fission and pre-equilibrium fission, where some of the internal degrees of freedom of the nucleus is not fully equilibrated. We have carried out extensive investigations on the fission fragment angular distributions at near barrier bombarding energies using heavy fissile targets. The measured fragment anisotropies when compared with the standard saddle point model (SSPM) calculations show that for projectile-target systems having zero or low ground state spins, the angular anisotropy exhibits a peak-like behaviour at the sub barrier energies, which cannot be explained by the SSPM calculations. For projectiles or targets with large ground state spins, the anomalous peaking gets washed out due to smearing of the -distribution by the intrinsic entrance channel spins. Recently studies have been carried out on the spin distributions of fission fragments through the gamma ray multiplicity measurements. The fission fragments acquire spin mainly from two

  18. Inhomogenous loop quantum cosmology with matter

    CERN Document Server

    Blas, Daniel Martín-de; Marugán, Guillermo A Mena; 10.1088/1742-6596/360/1/012032

    2013-01-01

    The linearly polarized Gowdy $T^3$ model with a massless scalar field with the same symmetries as the metric is quantized by applying a hybrid approach. The homogeneous geometry degrees of freedom are loop quantized, fact which leads to the resolution of the cosmological singularity, while a Fock quantization is employed for both matter and gravitational inhomogeneities. Owing to the inclusion of the massless scalar field this system allows us to modelize flat Friedmann-Robertson-Walker cosmologies filled with inhomogeneities propagating in one direction. It provides a perfect scenario to study the quantum back-reaction between the inhomogeneities and the polymeric homogeneous and isotropic background.

  19. Zinc ion coordination as a modulating factor of the ZnuA histidine-rich loop flexibility: A molecular modeling and fluorescence spectroscopy study

    Energy Technology Data Exchange (ETDEWEB)

    Castelli, Silvia [Department of Biology, University of Rome Tor Vergata, Via della Ricerca Scientifica, 00133 Rome (Italy); Stella, Lorenzo [Department of Chemical Sciences and Technologies, University of Roma Tor Vergata, Via della Ricerca Scientifica, 00133 Rome (Italy); Neuromed, IRCCS, Pozzilli 86077 (Italy); Petrarca, Patrizia [Department of Biology, University of Rome Tor Vergata, Via della Ricerca Scientifica, 00133 Rome (Italy); Battistoni, Andrea [Department of Biology, University of Rome Tor Vergata, Via della Ricerca Scientifica, 00133 Rome (Italy); Interuniversity Consortium, National Institute Biostructure and Biosystem (INBB), Viale delle Medaglie D' Oro 305, 00136 Rome (Italy); Desideri, Alessandro [Department of Biology, University of Rome Tor Vergata and CIBB, Center of Biostatistics and Bioinformatics, Via della Ricerca Scientifica, 00133 Rome (Italy); Interuniversity Consortium, National Institute Biostructure and Biosystem (INBB), Viale delle Medaglie D' Oro 305, 00136 Rome (Italy); Falconi, Mattia, E-mail: falconi@uniroma2.it [Department of Biology, University of Rome Tor Vergata and CIBB, Center of Biostatistics and Bioinformatics, Via della Ricerca Scientifica, 00133 Rome (Italy); Interuniversity Consortium, National Institute Biostructure and Biosystem (INBB), Viale delle Medaglie D' Oro 305, 00136 Rome (Italy)

    2013-01-11

    Highlights: Black-Right-Pointing-Pointer Fluorescence data indicate that the His-loop of ZnuA interacts with Zn{sup +2} ions. Black-Right-Pointing-Pointer The ZnuA structural model proposed validates these spectroscopic findings. Black-Right-Pointing-Pointer It is proposed that a zinc loaded His-loop may facilitate the ZnuA-ZnuB recognition. -- Abstract: ZnuA is the soluble component of the high-affinity ZnuABC zinc transporter belonging to the ATP-binding cassette-type periplasmic Zn-binding proteins. The zinc transporter ZnuABC is composed by three proteins: ZnuB, the membrane permease, ZnuC, the ATPase component and ZnuA, the soluble periplasmic metal-binding protein which captures Zn and delivers it to ZnuB. The ZnuA protein contains a charged flexible loop, rich in histidines and acidic residues, showing significant species-specific differences. Various studies have established that this loop contributes to the formation of a secondary zinc binding site, which has been proposed to be important in the acquisition of periplasmic Zn for its delivery to ZnuB or for regulation of zinc uptake. Due to its high mobility the structure of the histidine-rich loop has never been solved by X-ray diffraction studies. In this paper, through a combined use of molecular modeling, mutagenesis and fluorescence spectroscopy, we confirm the presence of two zinc binding sites characterized by different affinities for the metal ion and show that the flexibility of the loop is modulated by the binding of the zinc ions to the protein. The data obtained by fluorescence spectroscopy have then be used to validate a 3D model including the unsolved histidine-rich loop.

  20. Mantra, music and reaction times: a study of its applied aspects

    OpenAIRE

    Varun Malhotra, Rinku Garg, Usha Dhar, Neera Goel, Yogesh Tripathy, Iram Jaan, Sachit Goyal, Sumit Arora

    2014-01-01

    Aims &Objectives: The mechanism of the effects of music is still under scientific study and needs to be understood in a better way. We designed this study to see how music affects reaction time and concentration. The aim of our study was to study the effect of Gayatri mantra on reaction time. Material and Methods: 30 healthy subjects were selected for the study. Baseline record of Visual online Reaction time test was taken. Online visual reaction time was measured during listening to Gayatri...

  1. Study on the dynamic performance of a novel buck-boost matrix converter based on double-loop control strategy

    Science.gov (United States)

    Li, Qing; Zhang, Xiao-ping; Chen, Qi

    2011-12-01

    The dynamic performance of a novel Buck-Boost matrix converter (BBMC) based on double-loop control strategy is put forward in this paper. The fundamental principle of BBMC has been elaborated and the method of the double-loop control strategy has been built with Matlab, and then the dynamic performances of BBMC based on the double-loop control strategy are discussed. The results show that the output voltage and frequency can be almost constant with the BBMC and double-loop control strategy despite of the changeable input voltage and frequency. Moreover, a high-quality sine output wave with low harmonic distortion can be directly obtained without filtering. So it can be drawn that the BBMC based on the double-loop control strategy has perfectly dynamic performance and practical importance to the engineering.

  2. Experimental Study of Non-Resonant Self Circulating Heat Transfer Loop Used in Thermoacoustic-Stirling Engines

    Science.gov (United States)

    Gao, B.; Luo, E. C.; Dai, W.; Chen, Y. Y.; Hu, J. Y.

    2010-04-01

    A novel heat transfer loop for thermoacoustic-Stirling engines which could substitute for a traditional heat exchanger was developed. This new heat transfer loop uses a pair of check valves to transform oscillating flow into steady flow that allows the oscillating flow system's own working gas to go through a physically remote high-temperature or cold-temperature heat source. Since the early principle experiment has achieved success, this paper explores the real operating performance of this heat transfer loop by coupling with thermoacoustic-Stirling engine. Furthermore, a new type water-cooled heat exchanger was developed in this paper to deduce the extra acoustic power dissipation. In addition, the influence of two kinds of check valves the heat transfer loop was discussed in this paper. The loop with 0.1 mm valve disc thickness shows that the heat transfer capacity is higher than the traditional heat exchanger. Our experiments have demonstrated its feasibility and flexibility for practical applications.

  3. The stomatogastric nervous system as a model for studying sensorimotor interactions in real-time closed-loop conditions

    Directory of Open Access Journals (Sweden)

    Nelly eDaur

    2012-03-01

    Full Text Available The perception of proprioceptive signals that report the internal state of the body is one of the essential tasks of the nervous system and helps to continuously adapt body movements to changing circumstances. Despite the impact of proprioceptive feedback on motor activity it has rarely been studied in conditions in which motor output and sensory activity interact as they do in behaving animals, i.e. in closed-loop conditions. The interaction of motor and sensory activities, however, can create emergent properties that may govern the functional characteristics of the system. We here demonstrate the use of a well-characterized model system for central pattern generation, the stomatogastric nervous system, for studying these properties in vitro. We created a real-time computer model of a single-cell muscle tendon organ in the gastric mill of the crab foregut that uses intracellular current injections to control the activity of the biological proprioceptor. The resulting motor output of a gastric mill motor neuron is then recorded intracellularly and fed into a simple muscle model consisting of a series of low-pass filters. The muscle output is used to activate a one-dimensional Hodgkin-Huxley type model of the muscle tendon organ in real-time, allowing closed-loop conditions. Model properties were either hand-tuned to achieve the best match with data from semi-intact muscle preparations, or an exhaustive search was performed to determine the best set of parameters. We report the real-time capabilities of our models, its performance and its interaction with the biological motor system.

  4. Closed-loop control of ankle plantarflexors and dorsiflexors using an inverted pendulum apparatus: A pilot study

    Directory of Open Access Journals (Sweden)

    Same Michael B.

    2013-01-01

    Full Text Available Considerable demand exists for a device to facilitate hands-free, stable stance in individuals with neurological disorders such as spinal cord injury (SCI and stroke. In this regard, applying functional electrical stimulation (FES to muscles of the lower limbs in closed loop has shown promise. In particular, it has been suggested that a PID control strategy could offer functional benefits to stability by mimicking the neurological control strategy employed in able-bodied stance. In this proof of concept study, we tested this assertion by examining the potential of a PID control strategy with gravity compensation to effectively maintain balance during quiet stance by regulating FES-induced contractions of the ankle plantarflexors and dorsiflexors in able-bodied individuals. A novel Inverted Pendulum Standing Apparatus (IPSA was employed to simulate quiet stance whilst minimizing the voluntary control of able-bodied subjects. Quiet and perturbed standing trials were performed in 3 able-bodied subjects. Performance metrics including those pertaining to stability during quiet stance (root mean square difference, perturbation rejection capabilities (settling time, peak deviation, and ability to transition from an offset initial position (settling time, were examined. For all 3 subjects and for all of the metrics examined, our results showed that the proposed closed-loop controlled FES system improved performance in comparison to voluntary control. These results indicate that the PID plus gravity control strategy used in this study offers meaningful benefits over voluntary control in terms of standing stability. Thus, the controller could potentially be applied to the problem of improving or restoring standing ability in some neurologic patient populations.

  5. Exploratory study of nuclear reaction data utility framework of Japan charged particle reaction data group (JCPRG)

    Energy Technology Data Exchange (ETDEWEB)

    Masui, Hiroshi; Ohnishi, Akira; Kato, Kiyoshi [Hokkaido Univ., Graduate School of Science, Sapporo, Hokkaido (Japan); Ohbayasi, Yosihide [Hokkaido Univ., Meme Media Lab., Sapporo, Hokkaido (Japan); Aoyama, Shigeyoshi [Kitami Institute of Technology, Information Processing Center, Kitami, Hokkaido (Japan); Chiba, Masaki [Sapporo Gakuin Univ., Faculty of Social Information, Ebetsu, Hokkaido (Japan)

    2002-08-01

    Compilation, evaluation and dissemination are essential pieces of work for the nuclear data activities. We, Japan charged particle data group, have researched the utility framework for the nuclear reaction data on the basis of recent progress of computer and network technologies. These technologies will be not only for the data dissemination but for the compilation and evaluation assistance among the many corresponding researchers of all over the world. In this paper, current progress of our research and development is shown. (author)

  6. Thermal degradation reaction mechanism of xylose: A DFT study

    Science.gov (United States)

    Huang, Jinbao; He, Chao; Wu, Longqin; Tong, Hong

    2016-08-01

    The thermal degradation reaction mechanism of xylose as hemicellulose model compound was investigated by using density functional theory methods M062X with the 6-31++G(d,p) basis set. Eight possible pyrolytic reaction pathways were proposed and the standard kinetic and thermodynamic parameters in all reaction pathways were calculated at different temperatures. In reaction pathway (1), xylose is first transformed into acyclic containing-carbonyl isomer, and then the isomer further decomposes through four possible pyrolysis pathways (1-1)-(1-4). Pathways (2) and (3) depict an immediate ring-opening process through the simultaneous breaking of C-O and C-C bonds. Pathways (4)-(7) describe the pyrolysis processes of various anhydro-xyloses through a direct ring-opening process. Pathway (8) gives the evolutionary process of pyranones. The calculation results show that reaction pathways (1), (2) and (5) are the major reaction channels and reaction pathways (3), (4), and (6)-(8) are the competitive reaction channels in pyrolysis of xylose. The major products of xylose pyrolysis are low molecular products such as 2-furaldehyde, glycolaldehyde, acetaldehyde, methylglyoxal and acetone, and the main competitive products are formaldehyde, formic acid, acetic acid, CO2, CH4, acetol, pyranone, and so on.

  7. Loop Equations in Abelian Gauge Theories

    CERN Document Server

    Di Bartolo, C; Pe~na, F; Bartolo, Cayetano Di; Leal, Lorenzo; Peña, Francisco

    2005-01-01

    The equations obeyed by the vacuum expectation value of the Wilson loop of Abelian gauge theories are considered from the point of view of the loop-space. An approximative scheme for studying these loop-equations for lattice Maxwell theory is presented. The approximation leads to a partial difference equation in the area and length variables of the loop, and certain physically motivated ansatz is seen to reproduce the mean field results from a geometrical perspective.

  8. Development and application of a mouse intestinal loop model to study the in vivo action of Clostridium perfringens enterotoxin.

    Science.gov (United States)

    Caserta, Justin A; Robertson, Susan L; Saputo, Juliann; Shrestha, Archana; McClane, Bruce A; Uzal, Francisco A

    2011-08-01

    Clostridium perfringens enterotoxin (CPE) is responsible for causing the gastrointestinal symptoms of C. perfringens type A food poisoning, the second most commonly identified bacterial food-borne illness in the United States. CPE is produced by sporulating C. perfringens cells in the small intestinal lumen, where it then causes epithelial cell damage and villous blunting that leads to diarrhea and cramping. Those effects are typically self-limiting; however, severe outbreaks of this food poisoning, particularly two occurring in psychiatric institutions, have involved deaths. Since animal models are currently limited for the study of the CPE action, a mouse ligated intestinal loop model was developed. With this model, significant lethality was observed after 2 h in loops receiving an inoculum of 100 or 200 μg of CPE but not using a 50-μg toxin inoculum. A correlation was noted between the overall intestinal histological damage and lethality in mice. Serum analysis revealed a dose-dependent increase in serum CPE and potassium levels. CPE binding to the liver and kidney was detected, along with elevated levels of potassium in the serum. These data suggest that CPE can be absorbed from the intestine into the circulation, followed by the binding of the toxin to internal organs to induce potassium leakage, which can cause death. Finally, CPE pore complexes similar to those formed in tissue culture cells were detected in the intestine and liver, suggesting that (i) CPE actions are similar in vivo and in vitro and (ii) CPE-induced potassium release into blood may result from CPE pore formation in internal organs such as the liver.

  9. Development and Application of a Mouse Intestinal Loop Model To Study the In Vivo Action of Clostridium perfringens Enterotoxin ▿

    Science.gov (United States)

    Caserta, Justin A.; Robertson, Susan L.; Saputo, Juliann; Shrestha, Archana; McClane, Bruce A.; Uzal, Francisco A.

    2011-01-01

    Clostridium perfringens enterotoxin (CPE) is responsible for causing the gastrointestinal symptoms of C. perfringens type A food poisoning, the second most commonly identified bacterial food-borne illness in the United States. CPE is produced by sporulating C. perfringens cells in the small intestinal lumen, where it then causes epithelial cell damage and villous blunting that leads to diarrhea and cramping. Those effects are typically self-limiting; however, severe outbreaks of this food poisoning, particularly two occurring in psychiatric institutions, have involved deaths. Since animal models are currently limited for the study of the CPE action, a mouse ligated intestinal loop model was developed. With this model, significant lethality was observed after 2 h in loops receiving an inoculum of 100 or 200 μg of CPE but not using a 50-μg toxin inoculum. A correlation was noted between the overall intestinal histological damage and lethality in mice. Serum analysis revealed a dose-dependent increase in serum CPE and potassium levels. CPE binding to the liver and kidney was detected, along with elevated levels of potassium in the serum. These data suggest that CPE can be absorbed from the intestine into the circulation, followed by the binding of the toxin to internal organs to induce potassium leakage, which can cause death. Finally, CPE pore complexes similar to those formed in tissue culture cells were detected in the intestine and liver, suggesting that (i) CPE actions are similar in vivo and in vitro and (ii) CPE-induced potassium release into blood may result from CPE pore formation in internal organs such as the liver. PMID:21628512

  10. Initial binding of ions to the interhelical loops of divalent ion transporter CorA: replica exchange molecular dynamics simulation study.

    Directory of Open Access Journals (Sweden)

    Tong Zhang

    Full Text Available Crystal structures of Thermotoga maritima magnesium transporter CorA, reported in 2006, revealed its homo-pentameric constructions. However, the structure of the highly conserved extracellular interhelical loops remains unsolved, due to its high flexibility. We have explored the configurations of the loops through extensive replica exchange molecular dynamics simulations in explicit solvent model with the presence of either Co(III Hexamine ions or Mg(2+ ions. We found that there are multiple binding sites available on the interhelical loops in which the negatively charged residues, E316 and E320, are located notably close to the positively charged ions during the simulations. Our simulations resolved the distinct binding patterns of the two kinds of ions: Co(III Hexamine ions were found to bind stronger with the loop than Mg(2+ ions with binding free energy -7.3 kJ/mol lower, which is nicely consistent with the previous data. Our study provides an atomic basis description of the initial binding process of Mg(2+ ions on the extracellular interhelical loops of CorA and the detailed inhibition mechanism of Co(III Hexamine ions on CorA ions transportation.

  11. Comparison of Transverse Intraosseous Loop Technique and Pull Out Suture for Reinsertion of the Flexor Digitorum Profundus tendon. A Retrospective Study.

    Science.gov (United States)

    Rigó, István Zoltán; Røkkum, Magne

    2013-12-01

    We compared the results of two methods for reinsertion of flexor digitorum profundus tendons retrospectively. In 35 fingers of 29 patients pull-out suture and in 13 fingers of 11 patients transverse intraosseous loop technique was performed with a mean follow-up of 8 and 6 months, respectively. Eleven and nine fingers achieved "excellent" or "good" function according to Strickland and Glogovac at 8 weeks; 20 and ten at the last control in the pull-out and transverse intraosseous loop groups, respectively. The difference at 8 weeks was statistically significant in favour of the transverse intraosseous loop group. Ten patients underwent 12 complications in the pull-out group (four superficial infections; one rerupture, one PIP and one DIP joint contracture, one adhesion, two granulomas, one nail deformity and one carpal tunnel syndrome) and four of them were reoperated (one carpal tunnel release, one teno-arthrolysis and two resections of granuloma). There was no complication and no reoperation in the transverse intraosseous loop group, the difference being statistically significant for the former. In our study the transverse intraosseous loop technique seemed to be a safe alternative with possibly better functional results compared to the pull-out suture.

  12. Initial binding of ions to the interhelical loops of divalent ion transporter CorA: replica exchange molecular dynamics simulation study.

    Science.gov (United States)

    Zhang, Tong; Mu, Yuguang

    2012-01-01

    Crystal structures of Thermotoga maritima magnesium transporter CorA, reported in 2006, revealed its homo-pentameric constructions. However, the structure of the highly conserved extracellular interhelical loops remains unsolved, due to its high flexibility. We have explored the configurations of the loops through extensive replica exchange molecular dynamics simulations in explicit solvent model with the presence of either Co(III) Hexamine ions or Mg(2+) ions. We found that there are multiple binding sites available on the interhelical loops in which the negatively charged residues, E316 and E320, are located notably close to the positively charged ions during the simulations. Our simulations resolved the distinct binding patterns of the two kinds of ions: Co(III) Hexamine ions were found to bind stronger with the loop than Mg(2+) ions with binding free energy -7.3 kJ/mol lower, which is nicely consistent with the previous data. Our study provides an atomic basis description of the initial binding process of Mg(2+) ions on the extracellular interhelical loops of CorA and the detailed inhibition mechanism of Co(III) Hexamine ions on CorA ions transportation.

  13. Structural dynamics of V3 loop with different electrostatics: implications on co-receptor recognition: a molecular dynamics study of HIV gp120.

    Science.gov (United States)

    Chandramouli, Balasubramanian; Chillemi, Giovanni; Giombini, Emanuela; Capobianchi, Maria R; Rozera, Gabriella; Desideri, Alessandro

    2013-04-01

    The HIV's envelope glycoprotein gp120 plays a major role in the entry of the virus into the host cell, through its successive interactions with the cell surface CD4 receptor and a co-receptor (CCR5 or CXCR4). The choice of a specific co-receptor by gp120 has an important consequence on HIV infection and pathogenesis. The third variable region within gp120, the V3 loop, is the principal determinant of the co-receptor usage by gp120. Here, we report the long time molecular dynamics simulations of four gp120 structures, having a V3 loop charge of +3 and +5, from both R5 and X4 specific strains of HIV. The results of the study highlight the properties of the V3 loop that can be critical for dictating the co-receptor recognition and selection in structural context. In detail, we observe that the structural orientation of the V3 loop in the 3D space is modulated by its net charge, whilst its co-receptor choice is likely dictated by a combined effect of both the electrostatics of the loop and its conformational variability at the level of its central crown region.

  14. Closing global material loops

    DEFF Research Database (Denmark)

    Prosman, Ernst-Jan; Wæhrens, Brian Vejrum; Liotta, Giacomo

    2017-01-01

    Replacing virgin materials with waste materials, a practice known as Industrial Symbiosis (IS), has been identified as a key strategy for closing material loops. This article adopts a critical view on geographic proximity and external coordinators – two key enablers of IS. By ‘uncovering’ a case...... where both enablers are absent, this study seeks to explore firm-level challenges of IS. We adopt an exploratory case study approach at a cement manufacturer who engages in cross-border IS without the support of external coordinators. Our research presents insights into two key areas of IS: 1) setting...... for geographic proximity and external coordinators. In doing so, our insights into firm-level challenges of long-distance IS exchanges contribute to closing global material loops by increasing the number of potential circular pathways....

  15. Studies on the runaway reaction of ABS polymerization process.

    Science.gov (United States)

    Hu, Kwan-Hua; Kao, Chen-Shan; Duh, Yih-Shing

    2008-11-15

    Taiwan has the largest acrylonitrile-butadiene-styrene (ABS) copolymer production in the world. Preventing on unexpected exothermic reactions and related emergency relief hazard is essential in the safety control of ABS emulsion polymerization. A VSP2 (Vent Sizing Package 2) apparatus is capable of studying both normal and abnormal conditions (e.g., cooling failure, mischarge, etc.) of industrial process. In this study, the scenarios were verified from the following abnormal conditions: loss of cooling, double charge of initiator, overcharge of monomer, without charge of solvent, and external fire. An external fire with constant heating will promote higher self-heat rate and this is recommended as the worst case scenario of emulsion polymerization on butadiene. Cooling failure coupled with bulk system of reactant was determined to be the credible worst case in ABS emulsion polymerization. Finally, the emergency vent sizing based on thermokinetics from VSP associated with DIERS methodology were used for evaluating the vent sizing and compared to that of the industrial plants.

  16. Theoretical Study on the Mechanism of Sonogashira Coupling Reaction

    Institute of Scientific and Technical Information of China (English)

    CHEN Li-Ping; HONG San-Guo; HOU Hao-Qing

    2008-01-01

    The mechanism of palladium-catalyzed Sonogashira cross-coupling reaction has been studied theoretically by DFT (density functional theory) calculations. The model system studied consists of Pd(PH3)2 as the starting catalyst complex, phenyl bromide as the substrate and acetylene as the terminal alkyne, without regarding to the co-catalyst and base. Mechanistically and energetically plausible catalytic cycles for the cross-coupling have been identified. The DFT analysis shows that the catalytic cycle occurs in three stages: oxidative addition of phenyl bromide to the palladium center, alkynylation of palladium(II) intermediate, and reductive elimination to phenylacetylene. In the oxidative addition, the neutral and anionic pathways have been investigated, which could both give rise to cis-configured palladium(II) diphosphine intermediate. Starting from the palladium(II) diphosphine intermediate, the only identifiable pathway in alkynylation involves the dissociation of Br group and the formation of square-planar palladium(II) intermediate, in which the phenyl and alkynyl groups are oriented cis to each other. Due to the close proximity of phenyl and alkynyl groups, the reductive elimination of phenylacetylene proceeds smoothly.

  17. Nuclear structure and reaction studies at medium energies

    Energy Technology Data Exchange (ETDEWEB)

    Hoffmann, G.W.; Ray, R.L.

    1990-10-01

    This document constitutes the (1988--1991) technical progress report for the ongoing medium energy physics research program supported by the US Department of Energy through special Research Grant FG05-88ER40444. The experiments discussed are conducted at the Los Alamos National Laboratory's (LANL) Clinton P. Anderson Meson Physics Facility (LAMPF), the Alternating Gradient Synchrotron (AGS) facility of the Brookhaven National Laboratory (BNL), and at the Fermi National Accelerator Laboratory (FNAL). The overall motivation for the work discussed in this document is driven by three main objectives: (1) provide hadron-nucleon and hadron-nucleus scattering data which serve to facilitate the study of effective two-body interactions, test (and possibly determine) nuclear structure, and help study reaction mechanisms and dynamics;(2) provide unique, first-of-a-kind exploratory'' hadron-nucleus scattering data in the hope that such data will lead to discovery of new phenomena and new physics; and (3) perform precision tests of fundamental interactions, such as rare decay searches, whose observation would imply fundamental new physics.

  18. Loop electrosurgical excision of the cervix and subsequent risk for spontaneous preterm delivery: a population-based study of singleton deliveries during a 9-year period

    DEFF Research Database (Denmark)

    Noehr, Bugge; Jensen, Allan; Frederiksen, Kirsten;

    2009-01-01

    OBJECTIVE: Our aim was to assess the association between loop electrosurgical excision procedure (LEEP) and the subsequent risk for spontaneous preterm delivery, with the use of population-based data from various nationwide registries. STUDY DESIGN: The study population consisted of all singleton...

  19. Exploring the suitability of causal loop diagrams to assess the Value chains of aquatic ecosystem services: A case study of the Baviaanskloof, South Africa

    CSIR Research Space (South Africa)

    Rawlins, JM

    2015-11-01

    Full Text Available This study explores the suitability of causal loop diagrams (CLDs) to assess the value chains of AESs in South Africa within the context of a case study. AESs do not usually have finite market values nor are they traded in formal markets, thus a...

  20. Energetics of formation process of a <001> prismatic dislocation loop via the collision between two 1/2<111> loops in {alpha}-iron

    Energy Technology Data Exchange (ETDEWEB)

    Arakawa, K; Mori, H [Research Center for Ultra-High Voltage Electron Microscopy, Osaka University, 7-1 Mihogaoka, Ibaraki, Osaka 567-0047 (Japan)], E-mail: arakawak@uhvem.osaka-u.ac.jp

    2009-05-01

    It has been proposed by Marian et al. [1] that a [001] interstitial-type dislocation loop can be formed in body-centered cubic iron via the collision between a 1/2[111] loop and 1/ 2[111] loop, which undergo one-dimensional glide diffusion, and the subsequent shear reaction. However, the formation of [001] loops through this reaction has not been reproduced by other works even though the two 1/2<111> loops collided with each other. In the present paper, the origin of the difficulty in this reaction is discussed within the framework of isotropic elasticity theory. The sign of the driving force for the reaction is heavily dependent on the reaction path. The two 1/2<111> loops colliding to form a [110] junction can transform to a single [001] loop when a shear loop generated within the 1/2[111] loop propagates in sync with the other shear loop within the 1/ 2[111] loop. However, unsynchronized motion of the two shear loops significantly suppresses the propagation of the shear loops, which might be caused by the thermal fluctuation at finite temperatures. This will be one of the origins of the difficulty in the formation of [001] loops through the collision between the two 1/2<111> loops.

  1. Study on the Reaction of Benzimidazolium Salt with Amine Compounds

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    The addition-hydrolysis reaction of benzimidazolium salt with some mono- andbifunctional amine nucleophiles is reported, and a novel method of biomimetic synthesis forformamides and heterocycle compounds is provided.

  2. Results of theoretical and experimental studies of hydrodynamics of circulation loops in circulating fluidized bed reactors and systems with interconnected reactors

    Science.gov (United States)

    Ryabov, G. A.; Folomeev, O. M.; Sankin, D. A.; Melnikov, D. A.

    2015-02-01

    Problems of the calculation of circulation loops in circulating fluidized bed reactors and systems with interconnected reactors (polygeneration systems for the production of electricity, heat, and useful products and chemical cycles of combustion and gasification of solid fuels)are considered. A method has been developed for the calculation of circulation loop of fuel particles with respect to boilers with circulating fluidized bed (CFB) and systems with interconnected reactors with fluidized bed (FB) and CFB. New dependences for the connection between the fluidizing agent flow (air, gas, and steam) and performance of reactors and for the whole system (solids flow rate, furnace and cyclone pressure drops, and bed level in the riser) are important elements of this method. Experimental studies of hydrodynamics of circulation loops on the aerodynamic unit have been conducted. Experimental values of pressure drop of the horizontal part of the L-valve, which satisfy the calculated dependence, have been obtained.

  3. Study on Unexpected Cycloaddition Reactions of Imines with THF

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    An unexpected tricyclic compound 2,3,3a,4,5,9b-hexahydrophenylfuro[3,2-c] quinoline 4 and its aromatized product 6 were obtained when the cycloaddtion of imine 1 and substituted norbornene 2 was carried out in THF with a catalytic amount of boron trifluoride. The structures of the products were determined by spectral data, and the mechanism of reaction was substantiated by the imitation reaction.

  4. New Reaction Timer for Physiological and Psychological Studies

    Directory of Open Access Journals (Sweden)

    A. K. Gupta

    1983-07-01

    Full Text Available In physiological and psychological measurements, the response to some form of external stimulus is required. The instrumentation used for the measurement of Reaction Time is vital part of the main instrument system. Instrument design reported here is suitable for the measurement of Reaction. Time under environmental stress. The stimulus are visual (flash of light andauditory tone. This instrument is solidstate, portable and can be used with any electronic timer.

  5. Kinetic Studies of Reactions in Solution Using Fast Mass Spectrometry

    Science.gov (United States)

    2013-08-13

    REPORT Directorate of Chemistry and Materials Research NUMBER(S) AFOSR/RSA, 875 Randolph St., Suite 325, Rm 3112, Arlington, VA 222C 3 12...Mass Spectrometry to detect transient intermediates and decomposition products of catalyzed organometallic reactions Identifying intermediates is...in organometallic catalysis. HV N2 45o 5 mm 2 mm Reagent A Reagent B MS Secondary microdroplets Surface ~2-5 ms reaction time

  6. a Model Study of Complex Behavior in the Belousov - Reaction.

    Science.gov (United States)

    Lindberg, David Mark

    1988-12-01

    We have studied the complex oscillatory behavior in a model of the Belousov-Zhabotinskii (BZ) reaction in a continuously-fed stirred tank reactor (CSTR). The model consisted of a set of nonlinear ordinary differential equations derived from a reduced mechanism of the chemical system. These equations were integrated numerically on a computer, which yielded the concentrations of the constituent chemicals as functions of time. In addition, solutions were tracked as functions of a single parameter, the stability of the solutions was determined, and bifurcations of the solutions were located and studied. The intent of this study was to use this BZ model to explore further a region of complex oscillatory behavior found in experimental investigations, the most thorough of which revealed an alternating periodic-chaotic (P-C) sequence of states. A P-C sequence was discovered in the model which showed the same qualitative features as the experimental sequence. In order to better understand the P-C sequence, a detailed study was conducted in the vicinity of the P-C sequence, with two experimentally accessible parameters as control variables. This study mapped out the bifurcation sets, and included examination of the dynamics of the stable periodic, unstable periodic, and chaotic oscillatory motion. Observations made from the model results revealed a rough symmetry which suggests a new way of looking at the P-C sequence. Other nonlinear phenomena uncovered in the model were boundary and interior crises, several codimension-two bifurcations, and similarities in the shapes of areas of stability for periodic orbits in two-parameter space. Each earlier model study of this complex region involved only a limited one-parameter scan and had limited success in producing agreement with experiments. In contrast, for those regions of complex behavior that have been studied experimentally, the observations agree qualitatively with our model results. Several new predictions of the model

  7. CH 1 Introduction to Chemistry. Study Guide to Minicourse I - 13 Chemical Reaction Principles.

    Science.gov (United States)

    Schlenker, Richard

    Provided is a study guide for an introductory minicourse to the principles of chemical reactions. This written text is designed to accompany a series of audio tapes and 35mm slides which the student studies at his own pace. The course presents chemical kinetics, reaction mechanisms, reaction rates, and equilibrium. (SL)

  8. Studies of the steam generator degraded tubes behavior on BRUTUS test loop

    Energy Technology Data Exchange (ETDEWEB)

    Chedeau, C.; Rassineux, B. [EDF/DER/MTC, Moret Sur Loing (France); Flesch, B. [EDF/EPN/DMAINT, Paris (France)] [and others

    1997-04-01

    Studies for the evaluation of steam generator tube bundle cracks in PWR power plants are described. Global tests of crack leak rates and numerical calculations of crack opening area are discussed in some detail. A brief overview of thermohydraulic studies and the development of a mechanical probabilistic design code is also given. The COMPROMIS computer code was used in the studies to quantify the influence of in-service inspections and maintenance work on the risk of a steam generator tube rupture.

  9. Relations between the loop transposition of DNA G-quadruplex and the catalytic function of DNAzyme.

    Science.gov (United States)

    Cheng, Mingpan; Zhou, Jun; Jia, Guoqing; Ai, Xuanjun; Mergny, Jean-Louis; Li, Can

    2017-08-01

    The structures of DNA G-quadruplexes are essential for their functions in vivo and in vitro. Our present study revealed that sequential order of the three G-quadruplex loops, that is, loop transposition, could be a critical factor to determinate the G-quadruplex conformation and consequently improved the catalytic function of G-quadruplex based DNAzyme. In the presence of 100mM K(+), loop transposition induced one of the G-quadruplex isomers which shared identical loops but differed in the sequential order of loops into a hybrid topology while the others into predominately parallel topologies. (1)D NMR spectroscopy and mutation analysis suggested that the hydrogen bonding from loops residues with nucleotides in flanking sequences may be responsible for the stabilization of the different conformations. A well-known DNAzyme consisting of G-quadruplex and hemin (Ferriprotoporphyrin IX chloride) was chosen to test the catalytic function. We found that the loop transposition could enhance the reaction rate obviously by increasing the hemin binding affinity to G-quadruplex. These findings disclose the relations between the loop transposition, G-quadruplex conformation and catalytic function of DNAzyme. Copyright © 2017 Elsevier B.V. All rights reserved.

  10. Tissue reactions to abutment shift: an experimental study in dogs.

    Science.gov (United States)

    Abrahamsson, Ingemar; Berglundh, Tord; Sekino, Satoshi; Lindhe, Jan

    2003-01-01

    Standard protocols for the clinical use of dental implants often include the placement of healing abutments prior to standard or custom-made abutments. The tissue response to a single shift from a healing abutment to a permanent abutment has not been studied. The aim of the present experiment was to study tissue reactions that may occur following the removal of a healing abutment and the placement of a permanent abutment. In six beagle dogs, all mandibular premolars were extracted. Three months later three fixtures of the Astra Tech Implants Dental System (Astra Tech AB, Mölndal, Sweden) were installed in each edentulous premolar region. An additional 3 months later, the first abutment connection was performed. In two sites on each side of the mandible, healing abutments were placed; in the remaining site, a Uni-abutment (Astra Tech AB) was used. The two healing abutments were removed 2 weeks later, and one Uni-abutment and one prepable abutment were placed. A plaque-control period was initiated, and 6 months later block biopsies were obtained. The biopsies were prepared for histometric and morphometric examination. Radiographs were obtained at fixture placement, 2 weeks after the first abutment connection, and 6 months later. The length of the barrier epithelium, the height of the connective tissue attachment, and the level of the marginal bone did not differ between the three abutment groups. The major part of the radiographic bone loss during the experiment took place prior to or immediately after abutment connection; only small bone level alterations occurred during the subsequent 6-month period. The shift from a healing abutment to a permanent abutment resulted in the establishment of a transmucosal attachment, the dimension and quality of which did not differ from those of the mucosal barrier formed to a permanent abutment placed during a second-stage surgery.

  11. Density functional theory study on water-gas-shift reaction over molybdenum disulfide

    DEFF Research Database (Denmark)

    Shi, X. R.; Wang, Shengguang; Hu, J.

    2009-01-01

    Density functional theory calculations have been carried out to investigate the adsorption of reaction intermediates appearing during water-gas-shift reaction at the sulfur covered MoS2 (1 0 0)surfaces, Mo-termination with 37.5% S coverage and S-termination with 50% S coverage using periodic slabs....... The pathway for water-gas-shift reaction on both terminations has been carefully studied where the most favorable reaction path precedes the redox mechanism, namely the reaction takes place as follows: CO + H2O --> CO + OH + H --> CO + O + 2H --> CO2 + H-2. The most likely reaction candidates for the formate...

  12. Hard Loops, Soft Loops, and High Density Effective Field Theory

    CERN Document Server

    Schäfer, T

    2003-01-01

    We study several issues related to the use of effective field theories in QCD at large baryon density. We show that the power counting is complicated by the appearance of two scales inside loop integrals. Hard dense loops involve the large scale $mu^2$ and lead to phenomena such as screening and damping at the scale $gmu$. Soft loops only involve small scales and lead to superfluidity and non-Fermi liquid behavior at exponentially small scales. Four-fermion operators in the effective theory are suppressed by powers of $1/mu$, but they get enhanced by hard loops. As a consequence their contribution to the pairing gap is only suppressed by powers of the coupling constant, and not powers of $1/mu$. We determine the coefficients of four-fermion operators in the effective theory by matching quark-quark scattering amplitudes. Finally, we introduce a perturbative scheme for computing corrections to the gap parameter in the superfluid phase

  13. Continuous tubular flow reactor for XAFS studies of organometallic reactions: Possibilities and limitations for studies of the Soai reaction

    Energy Technology Data Exchange (ETDEWEB)

    Nchari, Luanga N; Hembury, Guy A; Beesley, Angela M; Tsapatsaris, Nikolaos; Hudson, Matthew; Schroeder, Sven L M [School of Chemical Engineering and Analytical Science, University of Manchester, PO Box 88, Manchester, M60 1QD (United Kingdom); Meehan, David J; Thomason, Matthew, E-mail: s.schroeder@manchester.ac.u [School of Chemistry, University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom)

    2009-11-15

    A computer-controlled continuous tubular flow reactor system has been commissioned that permits time-resolved in situ XAFS measurements of organometallic reactions. The system was commissioned by Zn K-edge measurements of products formed during the Soai reaction. XANES data are shown that illustrate the quality of the data that can be achieved. The XANES spectra are compatible with the presence of dimer, trimer or other oligomeric alkoxide species in the Soai process. It is shown how heterogeneity in the Soai reaction system leads to considerable complications with the measurements due to the formation of floating particles of the aldehyde/iPr{sub 2}Zn adduct formed in the reaction; additionally, decomposition of iPr{sub 2}Zn with residual air and moisture leads to deposits on cell walls.

  14. 47 CFR 36.622 - National and study area average unseparated loop costs.

    Science.gov (United States)

    2010-10-01

    ... nationwide average shall be used in determining the additional interstate expense allocation for companies... reflect the update filings shall not affect the amount of the additional interstate expense allocation for... study area. (1) If a company elects to, or is required to, update the data which it has filed with...

  15. Experimental Study of Single Phase Flow in a Closed-Loop Cooling System with Integrated Mini-Channel Heat Sink

    Directory of Open Access Journals (Sweden)

    Lei Ma

    2016-06-01

    Full Text Available The flow and heat transfer characteristics of a closed-loop cooling system with a mini-channel heat sink for thermal management of electronics is studied experimentally. The heat sink is designed with corrugated fins to improve its heat dissipation capability. The experiments are performed using variable coolant volumetric flow rates and input heating powers. The experimental results show a high and reliable thermal performance using the heat sink with corrugated fins. The heat transfer capability is improved up to 30 W/cm2 when the base temperature is kept at a stable and acceptable level. Besides the heat transfer capability enhancement, the capability of the system to transfer heat for a long distance is also studied and a fast thermal response time to reach steady state is observed once the input heating power or the volume flow rate are varied. Under different input heat source powers and volumetric flow rates, our results suggest potential applications of the designed mini-channel heat sink in cooling microelectronics.

  16. Loop Quantum Cosmology

    Directory of Open Access Journals (Sweden)

    Bojowald Martin

    2008-07-01

    Full Text Available Quantum gravity is expected to be necessary in order to understand situations in which classical general relativity breaks down. In particular in cosmology one has to deal with initial singularities, i.e., the fact that the backward evolution of a classical spacetime inevitably comes to an end after a finite amount of proper time. This presents a breakdown of the classical picture and requires an extended theory for a meaningful description. Since small length scales and high curvatures are involved, quantum effects must play a role. Not only the singularity itself but also the surrounding spacetime is then modified. One particular theory is loop quantum cosmology, an application of loop quantum gravity to homogeneous systems, which removes classical singularities. Its implications can be studied at different levels. The main effects are introduced into effective classical equations, which allow one to avoid the interpretational problems of quantum theory. They give rise to new kinds of early-universe phenomenology with applications to inflation and cyclic models. To resolve classical singularities and to understand the structure of geometry around them, the quantum description is necessary. Classical evolution is then replaced by a difference equation for a wave function, which allows an extension of quantum spacetime beyond classical singularities. One main question is how these homogeneous scenarios are related to full loop quantum gravity, which can be dealt with at the level of distributional symmetric states. Finally, the new structure of spacetime arising in loop quantum gravity and its application to cosmology sheds light on more general issues, such as the nature of time.

  17. Loop Quantum Cosmology

    Directory of Open Access Journals (Sweden)

    Bojowald Martin

    2005-12-01

    Full Text Available Quantum gravity is expected to be necessary in order to understand situations where classical general relativity breaks down. In particular in cosmology one has to deal with initial singularities, i.e., the fact that the backward evolution of a classical space-time inevitably comes to an end after a finite amount of proper time. This presents a breakdown of the classical picture and requires an extended theory for a meaningful description. Since small length scales and high curvatures are involved, quantum effects must play a role. Not only the singularity itself but also the surrounding space-time is then modified. One particular realization is loop quantum cosmology, an application of loop quantum gravity to homogeneous systems, which removes classical singularities. Its implications can be studied at different levels. Main effects are introduced into effective classical equations which allow to avoid interpretational problems of quantum theory. They give rise to new kinds of early universe phenomenology with applications to inflation and cyclic models. To resolve classical singularities and to understand the structure of geometry around them, the quantum description is necessary. Classical evolution is then replaced by a difference equation for a wave function which allows to extend space-time beyond classical singularities. One main question is how these homogeneous scenarios are related to full loop quantum gravity, which can be dealt with at the level of distributional symmetric states. Finally, the new structure of space-time arising in loop quantum gravity and its application to cosmology sheds new light on more general issues such as time.

  18. Density Function Theory Studies on Reaction of HCS with OH

    Institute of Scientific and Technical Information of China (English)

    PEI Ke-Mei; LI Yi-Min; LI Hai-Yang

    2003-01-01

    The exothermic reaction of HCS with OH on the single-state potential energy surface was explored by means of Density Function Theory(DFT). The equilibrium structural parameters, the harmonic vibrational frequencies, the total energies and the zero point energies(ZPE) of all the species in the reaction were computed. Six intermediates and seven transition states were located, three exothermic channels were found. The frequency analysis and the Intrinsic Reaction Coordinate(IRC) calculation confirm that the transitions are truthful. The results indicate that there are three exothermic channels and their corresponding products are: P1(H2O+CS), P2(H2S+CO), P3(OCS+H2), and P1 has a larger branch ratio.

  19. Experimental study of electroinsulating coatings in gallium coolant related to the divertor cooling loop

    Science.gov (United States)

    Beznosov, A. V.; Sherbakov, R. V.; Karatushina, I. V.; Romanov, P. V.

    1996-10-01

    Experimental investigation of electroinsulating coatings stability on the samples made of stainless stell, vanadium alloy and beryllium has been conducted at 80-350°C. The impact of gas pressure upon the liquid gallium open surface was studied. The stability of electroinsulating film parameters on divertor structure materials was confirmed for the divertor with open liquid metal coolant surface in the vacuum chamber.

  20. The Projectile inside the Loop

    OpenAIRE

    Varieschi, Gabriele U.

    2005-01-01

    In this paper we describe an alternative use of the loop-the-loop apparatus, which can be used to study an interesting case of projectile motion. We also present an effective way to perform and analyze these experiments, by using video capture software together with a digital video camera. These experiments can be integrated into classroom demonstrations for general physics courses, or become part of laboratory activities.

  1. Bifurcations of nontwisted heteroclinic loop

    Institute of Scientific and Technical Information of China (English)

    田清平; 朱德明

    2000-01-01

    Bifurcations of nontwisted and fine heteroclinic loops are studied for higher dimensional systems. The existence and its associated existing regions are given for the 1-hom orbit and the 1-per orbit, respectively, and bifurcation surfaces of the two-fold periodic orbit are also obtained. At last, these bifurcation results are applied to the fine heteroclinic loop for the planar system, which leads to some new and interesting results.

  2. Studies of Heavy-Ion Reactions and Transuranic Nuclei

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, W. Udo [Univ. of Rochester, NY (United States). Dept. of Chemistry. Dept. of Physics

    2016-07-28

    Studies of heavy-ion reactions and transuranic nuclei performed by the University of Rochester Nuclear Science Research Group have been successful in furthering experimental systematics and theoretical understanding of the behavior of nuclear systems excited to their limits of stability. The theoretical results explain specifically the “boiling” and “vaporization” of atomic nuclei, but are more generally applicable to isolated, quantal many-particle systems which, under thermal or mechanical stresses, all disintegrate by evaporation, via surface cluster emission, or via fission-like processes. Accompanying experimental investigations by the group have demonstrated several new types of dynamical instability of nuclei: In central, “head-on” collisions, target nuclei exhibit limited ability to stop energetic projectile nuclei and to dissipate the imparted linear momentum. Substantial matter overlap (“neck”) between projectile and target nuclei, which is observed at elevated collision energies, can be stretched considerably and break at several places simultaneously. These results provide new testing grounds for microscopic theory of the cohesion of nuclear matter. This property has remained elusive, even though the elementary nucleon-nucleon forces are well known since some time. Technical R&D has resulted in a detailed characterization of a novel plastic material, which can now be used in the design of sensitive diagnostic systems for various types of radio-activity. Innovative application of powerful laser systems has produced intense, controllable sources of exotic particle radioactivity for nuclear investigations. Several students have received their Ph.D. degree in experimental nuclear science for their work on basic nuclear research or R&D projects.

  3. Studies of Heavy-Ion Reactions and Transuranic Nuclei

    Energy Technology Data Exchange (ETDEWEB)

    Schroeder, W. Udo [Univ. of Rochester, NY (United States). Dept. of Chemistry. Dept. of Physics

    2016-07-28

    Studies of heavy-ion reactions and transuranic nuclei performed by the University of Rochester Nuclear Science Research Group have been successful in furthering experimental systematics and theoretical understanding of the behavior of nuclear systems excited to their limits of stability. The theoretical results explain specifically the “boiling” and “vaporization” of atomic nuclei but are more generally applicable to isolated, quantal many-particle systems which, under thermal or mechanical stresses, all disintegrate by evaporation, via surface cluster emission, or via fission-like processes. Accompanying experimental investigations by the group have demonstrated several new types of dynamical instability of nuclei: In central, “head-on” collisions, target nuclei exhibit limited ability to stop energetic projectile nuclei and to dissipate the imparted linear momentum. Substantial matter overlap (“neck”) between projectile and target nuclei, which is observed at elevated collision energies, can be stretched considerably and break at several places simultaneously. These results provide new testing grounds for microscopic theory of the cohesion of nuclear matter. This property has remained elusive, even though the elementary nucleon-nucleon forces are well known since some time. Technical R&D has resulted in a detailed characterization of a novel plastic material, which can now be used in the design of sensitive diagnostic systems for various types of radio-activity. Innovative application of powerful laser systems has produced intense, controllable sources of exotic particle radioactivity for nuclear investigations. Several students have received their Ph.D. degree in experimental nuclear science for their work on basic nuclear research or R&D projects.

  4. A Study of Electrocyclic Reactions in a Molecular Junction

    DEFF Research Database (Denmark)

    Olsen, Stine Tetzschner; Nielsen, Mogens Brøndsted; Hansen, Thorsten

    2017-01-01

    Molecular photoswitches incorporated in molecular junctions yield the possibility of light-controlled switching of conductance due to the electronic difference of the photoisomers. Another isomerization mechanism, dark photoswitching, promoted by a voltage stimulus rather than by light, can......) by considering the molecular energies and orbitals of the molecules placed in a junction. For an electrocyclic ring closure reaction to occur for these compounds, we put forward two requirements: a)the closed stereoisomer (cis or trans form) must be of lower energy than the open form, and b)the reaction pathway...

  5. Selenium and sulfur in exchange reactions: a comparative study.

    Science.gov (United States)

    Steinmann, Daniel; Nauser, Thomas; Koppenol, Willem H

    2010-10-01

    Cysteamine reduces selenocystamine to form hemiselenocystamine and then cystamine. The rate constants are k(1) = 1.3 × 10(5) M(-1) s(-1); k(-1) = 2.6 × 10(7) M(-1) s(-1); k(2) = 11 M(-1) s(-1); and k(-2) = 1.4 × 10(3) M(-1) s(-1), respectively. Rate constants for reactions of cysteine/selenocystine are similar. Reaction rates of selenium as a nucleophile and as an electrophile are 2-3 and 4 orders of magnitude higher, respectively, than those of sulfur. Sulfides and selenides are comparable as leaving groups.

  6. Pre-study - Straw ash in a nutrient loop; Foerstudie - Halmaska i ett kretslopp

    Energy Technology Data Exchange (ETDEWEB)

    Ottosson, Peter; Bjurstroem, Henrik; Johansson, Christina; Svensson, Sven-Erik; Mattsson, Jan Erik

    2009-03-15

    A sustainable production of energy crops requires that the loss of mineral nutrients when removing biomass is compensated naturally or by an addition of plant nutrients. Recycling ash is a natural way to satisfy this need arising after combustion of energy crops. In this pre-study, the prerequisites for recycling straw ash have been investigated. The Danish experience with spreading ash to fields and information in literature on the composition of ash have been collected and presented. Analysis of straw samples taken from four different places in Scania yielded information on cadmium and nutrient concentration in straw and in ash. A balance between removal of nutrient and cadmium with wheat straw and restoring them by recycling straw ash has been computed. Straw ash is a potassium fertiliser with some phosphorus and some liming effect. It is technically difficult to spread the small quantities of ash in solid form, ca 250 kg per hectare and year in average, which a pure recycling would require. It is easier to spread larger quantities, e.g. ca 1 ton per hectare every fourth year, which corresponds to spreading once in a four year crop rotation, but then one provides too much potassium if one considers the actual needs of the coming crops at that occasion, which could lead to potassium being leached out on light soils. Alternatively, one could spread only bottom ash, but this would lead to half of the potassium content not being recycled to agricultural soil and lost with the fly ash that is disposed of. If one spreads about 500 kg bottom ash per hectare every other year, which could be a suitable strategy to avoid overloading soils with potassium, the dose brought to 1 ha may be computed as: 4 - 10 kg phosphorus, 50 - 100 kg potassium, 5 - 15 kg sulphur, 4 - 8 kg magnesium, 0.1 - 0.3 kg manganese and 20 - 40 kg CaO. These basis of these calculations is the results from the analyses performed in this study. The cadmium concentration was significantly higher in wheat

  7. The finite Bruck Loops

    CERN Document Server

    Baumeister, Barbara

    2009-01-01

    We continue the work by Aschbacher, Kinyon and Phillips [AKP] as well as of Glauberman [Glaub1,2] by describing the structure of the finite Bruck loops. We show essentially that a finite Bruck loop $X$ is the direct product of a Bruck loop of odd order with either a soluble Bruck loop of 2-power order or a product of loops related to the groups $PSL_2(q)$, $q= 9$ or $q \\geq 5$ a Fermat prime. The latter possibillity does occur as is shown in [Nag1, BS]. As corollaries we obtain versions of Sylow's, Lagrange's and Hall's Theorems for loops.

  8. First studies of the (8)B(alpha,p)(11)C reaction

    NARCIS (Netherlands)

    Rehm, KE; Jiang, CL; Greene, JP; Henderson, D; Janssens, RVF; Moore, EF; Mukherjee, G; Pardo, RC; Pennington, T; Schiffer, JP; Sinha, S; Tang, XD; Siemssen, RH; Jisonna, L; Segel, RE; Wuosmaa, AH

    2004-01-01

    The (8)B(alpha,p)(11)C reaction is part of the network that can bypass the triple a process leading to the production of (12)C. We have measured the astrophysical reaction rate for this reaction by studying the inverse (11)C(p,alpha)(8)B process. The radioactive (11)C beam was produced via the p((11

  9. An experimental study on an oscillating loop heat pipe consisting of three interconnected columns

    Science.gov (United States)

    Özdemir, Mustafa

    2007-04-01

    This paper presents some experimental results of an extensive research on a novel oscillating heat pipe. The heat pipe is formed of three interconnected columns as different from the pulsating heat pipe designs. The dimensions of the heat pipe considered in this study are large enough to neglect the effect of capillary forces. Thus, the self-oscillation of the system is driven by the gravitational force and the phase lag between the evaporation and condensation processes. The overall heat transfer coefficient is found to be approximately constant irrespective of heat load for the experimental cases considered. The results are also compared with the previously published data by other investigators for water as the working fluid and for the same heat input range. The experimental data for the time variation of the liquid column heights and the vapor pressure are correlated algebraically, convenient for practical uses.

  10. Arrangement for carrying out and studying chemical reactions

    NARCIS (Netherlands)

    Langeveld, A.D.; Makkee, M.; Moulijn, J.A.

    1993-01-01

    Abstract of NL 9102029 (A) Described is an arrangement for carrying out TAP experiments. Such an arrangement comprises a reaction chamber in which a very short-lived beam of molecules is directed at a target to produce a short-lived beam of intermediate-product molecules, and a vacuum chamber wher

  11. Theoretical Studies of Chemical Reactions following Electronic Excitation

    Science.gov (United States)

    Chaban, Galina M.

    2003-01-01

    The use of multi-configurational wave functions is demonstrated for several processes: tautomerization reactions in the ground and excited states of the DNA base adenine, dissociation of glycine molecule after electronic excitation, and decomposition/deformation of novel rare gas molecules HRgF. These processes involve bond brealung/formation and require multi-configurational approaches that include dynamic correlation.

  12. Surface Reactions Studied by Synchrotron Based Photoelectron Spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Hrbek, J.

    1998-11-03

    The goal of this article is to illustrate the use of synchrotron radiation for investigating surface chemical reactions by photoelectron spectroscopy. A brief introduction and background information is followed by examples of layer resolved spectroscopy, oxidation and sulfidation of metallic, semiconducting and oxide surfaces.

  13. Surface magnetic contribution in zinc ferrite thin films studied by element- and site-specific XMCD hysteresis-loops

    Energy Technology Data Exchange (ETDEWEB)

    Mendoza Zélis, P.; Pasquevich, G.A. [IFLP-CCT-La Plata-CONICET and Departamento de Física, Facultad de Ciencias Exactas, C. C. 67, Universidad Nacional de La Plata, 1900 La Plata (Argentina); Departamento de Ciencias Básicas, Facultad de Ingeniería, Universidad Nacional de La Plata, 1900 La Plata (Argentina); Salcedo Rodríguez, K.L.; Sánchez, F.H. [IFLP-CCT-La Plata-CONICET and Departamento de Física, Facultad de Ciencias Exactas, C. C. 67, Universidad Nacional de La Plata, 1900 La Plata (Argentina); Rodríguez Torres, C.E., E-mail: torres@fisica.unlp.edu.ar [IFLP-CCT-La Plata-CONICET and Departamento de Física, Facultad de Ciencias Exactas, C. C. 67, Universidad Nacional de La Plata, 1900 La Plata (Argentina)

    2016-12-01

    Element- and site-specific magnetic hysteresis-loops measurements on a zinc ferrite (ZnFe{sub 2}O{sub 4}) thin film were performed by X-ray magnetic circular dichroism. Results show that iron in octahedral and tetrahedral sites of spinel structure are coupled antiferromagnetically between them, and when magnetic field is applied the magnetic moment of the ion located at octahedral sites aligns along the field direction. The magnetic measurements reveal a distinctive response of the surface with in-plane anisotropy and an effective anisotropy constant value of 12.6 kJ/m{sup 3}. This effective anisotropy is due to the combining effects of demagnetizing field and, volume and surface magnetic anisotropies K{sub V} =3.1 kJ/m{sup 3} and K{sub S} =16 μJ/m{sup 2}. - Highlights: • Surface magnetic response in ZnFe{sub 2}O{sub 4} film (thickness t ∼57 nm) by XMCD is studied. • Measurements of magnetic moment vs. applied field cycles via XMCD are presented. • Fe{sup 3+} at A- and B-sites are coupled antiferromagnetically between them. • A distinctive response of the surface with in-plane magnetic anisotropy is determined. • Volume and surface magnetic anisotropy are determined: 3.1 kJ/m{sup 3} and 16 μJ/m{sup 2}.

  14. Study on design of strip casting loops%薄带连铸活套设计研究

    Institute of Scientific and Technical Information of China (English)

    叶长宏; 方园; 顾龙发; 梁高飞; 吴建春

    2009-01-01

    This paper proposes two kinds of methods to design loops of strip casting based on four essential re-quirements. The first method uses the catenary equation to obtain the equation of loops. It is of high precision and accuracy, and is applicable to design any free loops. But the obtained catenary curve equation is transcen-dental equation, and it is very difficult for actual use. When the sag ratio famx/l < 1/10, it is feasible to use parabola equation instead of catenary equation to calculate the simplified equation of loops, This simplified e-quation of loops is also of high precision and can meet the practical requirements.%基于四个基本条件,提出了两种薄带连铸活套的设计方法.采用悬链线理论设计活套,活套的形状比较准确,适用于任何形式的自由活套设计,但是得到的悬链线曲线方程为超越方程,实际应用进候比较复杂;当垂跨比famx/l<1/10时,用抛物线理论代替悬链线也有较高的精度,可以满足工程的要求.

  15. Single-collision studies of energy transfer and chemical reaction

    Energy Technology Data Exchange (ETDEWEB)

    Valentini, J.J. [Columbia Univ., New York, NY (United States)

    1993-12-01

    The research focus in this group is state-to-state dynamics of reaction and energy transfer in collisions of free radicals such as H, OH, and CH{sub 3} with H{sub 2}, alkanes, alcohols and other hydrogen-containing molecules. The motivation for the work is the desire to provide a detailed understanding of the chemical dynamics of prototype reactions that are important in the production and utilization of energy sources, most importantly in combustion. The work is primarily experimental, but with an important and growing theoretical/computational component. The focus of this research program is now on reactions in which at least one of the reactants and one of the products is polyatomic. The objective is to determine how the high dimensionality of the reactants and products differentiates such reactions from atom + diatom reactions of the same kinematics and energetics. The experiments use highly time-resolved laser spectroscopic methods to prepare reactant states and analyze the states of the products on a single-collision time scale. The primary spectroscopic tool for product state analysis is coherent anti-Stokes Raman scattering (CARS) spectroscopy. CARS is used because of its generality and because the extraction of quantum state populations from CARS spectra is straightforward. The combination of the generality and easy analysis of CARS makes possible absolute cross section measurements (both state-to-state and total), a particularly valuable capability for characterizing reactive and inelastic collisions. Reactant free radicals are produced by laser photolysis of appropriate precursors. For reactant vibrational excitation stimulated Raman techniques are being developed and implemented.

  16. A kinetic study on non-catalytic reactions in hydroprocessing Boscan crude oil

    Energy Technology Data Exchange (ETDEWEB)

    A. Marafi; E. Kam; A. Stanislaus [Kuwait Institute for Scientific Research, Safat (Kuwait). Petroleum Refining Department, Petroleum Research and Studies Center

    2008-08-15

    Non-catalytic hydrothermal cracking reactions are known to associate with catalytic hydrocracking reactions. In a recent study on hydroprocessing of Boscan crude over a specific catalyst system containing three distinct catalysts, it was found that hydrodesulfurization (HDS) and hydrodemetallation (HDM) reactions continued even when the catalyst is severely deactivated. Since the reactor was packed with considerable amount of inert material besides the three catalysts, it will be advantage to determine if the inert materials can also facilitate hydroprocessing reactions. A series of kinetic experiments for the inert particles was undertaken under different space velocity and temperature conditions. The extent of catalytic and non-catalytic hydroprocessing reactions was assessed. Through statistical analysis, the initial reaction rate constant, reaction order and activation energy for various hydroprocessing reactions were then determined. The absolute average deviations (AAD) of the kinetics values obtained for inert materials are less than 10%. 25 refs., 7 figs., 4 tabs.

  17. Study on the Robust Problem of the Excitation Power Supply With Closed Loop Control%闭环激磁电源鲁棒问题的研究

    Institute of Scientific and Technical Information of China (English)

    曾鸣; 王毅; 克晶; 苏宝库

    2001-01-01

    针对闭环激磁电源性能指标的实际需要,研究了该电源幅值回路系统的鲁棒性问题.依据鲁棒控制理论的回路成形原理,讨论了闭环激磁电源幅值回路鲁棒性能控制器的图形设计方法.仿真结果表明了设计的有效性,对实际系统有指导意义.%Aimed at the practice requirements of the performance index in the excitation power supply with dosed loop control, the robust problem of magnitude loop in this system is studied. Based on the principle of loop shaping of robust control theory, it is discussed the graphics design method of robust performance controller for magnitude loop of the system. The validity of the design is indicated in the emulation results, having significance to practice system.

  18. Study of quinones reactions with wine nucleophiles by cyclic voltammetry.

    Science.gov (United States)

    Oliveira, Carla M; Barros, António S; Ferreira, António C S; Silva, Artur M S

    2016-11-15

    Quinones are electrophilic species which can react with various nucleophiles, like wine antioxidants, such as sulfur dioxide or ascorbic acid, thiols, amino acids, and numerous polyphenols. These reactions are very important in wine aging because they mediate oxygen reactions during both production and bottle aging phases. In this work, the major challenge was to determine the interaction between ortho-quinones and wine nucleophiles (amino acids, thiols, and the antioxidants SO2 and ascorbic acid), by cyclic voltammetry. Wine-model solutions with gallic acid, caffeic acid, or (+)-catechin and nucleophilic compounds were used. To understand the effect of nucleophilic addition in wine, a white wine with the same added nucleophiles was also analysed. Cyclic voltammograms were taken with glassy carbon electrode or screen-printed carbon electrodes, respectively, for wine-model and white wines solutions, in the absence and in the presence of nucleophiles. A nucleophilic order profile related to the cathodic current intensity decrease was observed.

  19. Studies of Negative Ion Reactions: Solvated Ions and Strong Acids,

    Science.gov (United States)

    1986-03-07

    both simple and solvated negative tons, Including association of HS04 "(H2 504 )m(HNO3)n with HCI and of NO3- with HNO3 , together with several reactions...of its high vapor pressure. We have measured rate coefficients [91 for the association of HC with HS04 (H2SO4)m(lN03)n for m-0 to 3 and n-O, 1. At the

  20. Study of reactions induced by 6He on 9Be

    Directory of Open Access Journals (Sweden)

    Pires K.C.C.

    2014-03-01

    Full Text Available We present the results of experiments using a 6He beam on a 9Be target at energies 7 − 9 times the Coulomb barrier. Angular distributions of the elastic, inelastic scattering (target breakup and the a-particle production in the 6He+9Be collision have been analysed. Total reaction cross sections were obtained from the elastic scatteringanalyses and a considerable enhancement has been observed by comparing to stable systems.

  1. A study of paint sludge deactivation by pyrolysis reactions

    Directory of Open Access Journals (Sweden)

    Muniz L.A.R.

    2003-01-01

    Full Text Available The production of large quantities of paint sludge is a serious environmental problem. This work evaluates the use of pyrolysis reaction as a process for deactivating paint sludge that generates a combustible gas phase, a solvent liquid phase and an inert solid phase. These wastes were classified into three types: water-based solvent (latex resin and solvents based on their resins (alkyd and polyurethane. An electrically heated stainless steel batch reactor with a capacity of 579 mL and a maximum pressure of 30 atm was used. Following the reactor, a flash separator, which was operated at atmospheric pressure, partially condensed and separated liquid and gas products. Pressure and temperature were monitored on-line by a control and data acquisition system, which adjusted the heating power supplied to the pyrolysis reactor. Reactions followed an experimental design with two factors (reaction time and temperature and three levels (10, 50 and 90 minutes; 450, 550 and 650degreesC. The response variables were liquid and solid masses and net heat of combustion. The optimal operational range for the pyrolysis process was obtained for each response variable. A significant reduction in total mass of solid waste was obtained.

  2. Pseudonoise code tracking loop

    Science.gov (United States)

    Laflame, D. T. (Inventor)

    1980-01-01

    A delay-locked loop is presented for tracking a pseudonoise (PN) reference code in an incoming communication signal. The loop is less sensitive to gain imbalances, which can otherwise introduce timing errors in the PN reference code formed by the loop.

  3. FURTHER STUDIES ON THE OPHTHALMO-TUBERCULIN REACTION IN CATTLE.

    Science.gov (United States)

    McCampbell, E F

    1908-09-05

    Our conclusions differ in a few points from those of our first work on this subject. We are able to sum up our observations in this series of experiments as follows: 1. The ophthalmo-tuberculin test is of limited value in the diagnosis of tuberculosis in cattle. In some cases the reaction is very slight (hyperaemia). In others more pronounced congestion with profuse exudates are noted. Accuracy of observation is important. We are inclined to rely primarily on the results of the first instillation of tuberculin. Second instillations in a few instances elicit reaction in non-tubercular animals. 2. In the majority of animals tested the reaction increased in its intensity with each subsequent instillation of tuberculin. This fact indicates the development of a local hypersusceptibility or anaphylaxis associated with a partial immunity; von Pirquet calls this condition "allergie" (9). 3. It is possible in some cases to create a condition of "allergie" in healthy cattle, when spaced instillations of tuberculin are made. It is evident, therefore, that the result of the first instillation of tuberculin should be made the only basis of diagnosis. Rosenau and Anderson (II) have recently called attention to this point in regard to the human subject. 4. When repeated instillations of tuberculin are made on the conjunctiva at short intervals (twenty-four hours, etc.) a local immunity results (No. 3D et al.). If the instillations are separated two weeks or more anaphylaxis results. 5. We, therefore, hold that if tuberculin (0.1 cubic centimeter) is carefully instilled into the conjunctival sac and if careful comparison of the instilled eye with the opposite eye shows that a reaction of varying intensity results in from ten to twelve hours after the first instillation, a tubercular lesion is present. 6. In our first report (7) we were inclined to believe that subcutaneous tubercular injection given previous to the ocular test would slightly inhibit it. We have since become

  4. Topological studies on IRC paths of the isomerization reaction of silicon methyl- nitrene

    Institute of Scientific and Technical Information of China (English)

    石彦波; 郑世钧; 孟令鹏

    1999-01-01

    On the basis of kinetic study of isomerization reaction of H3Si-N, ab initio (RHF, UHF/6-31G) calculations on some points of the singlet and triplet reaction paths were carried out. The breakage and formation of chemical bond in the reaction are discussed. The calculated results show that there is a transitional structure of three-membered ring on each of reaction paths. A ’structural transition region’ and a ’structural transition state’ in both of studied reaction are found. Our previous conclusion that the structure transition state (STS) always appears before the energy transition state (ETS) in endothermic reaction and after ETS in exothermic reaction is further confirmed. The relationship between the change of spin density distribution and the structural transition state are investigated.

  5. Study of n-Butyl Acrylate Self-Initiation Reaction Experimentally and via Macroscopic Mechanistic Modeling

    Directory of Open Access Journals (Sweden)

    Ahmad Arabi Shamsabadi

    2016-04-01

    Full Text Available This paper presents an experimental study of the self-initiation reaction of n-butyl acrylate (n-BA in free-radical polymerization. For the first time, the frequency factor and activation energy of the monomer self-initiation reaction are estimated from measurements of n-BA conversion in free-radical homo-polymerization initiated only by the monomer. The estimation was carried out using a macroscopic mechanistic mathematical model of the reactor. In addition to already-known reactions that contribute to the polymerization, the model considers a n-BA self-initiation reaction mechanism that is based on our previous electronic-level first-principles theoretical study of the self-initiation reaction. Reaction rate equations are derived using the method of moments. The reaction-rate parameter estimates obtained from conversion measurements agree well with estimates obtained via our purely-theoretical quantum chemical calculations.

  6. Theoretical study on the reaction mechanism of CN radical with ketene

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    The bimolecular single collision reaction potential energy surface of CN radical with ketene (CH2CO) was investigated by means of B3LYP and QCISD(T) methods. The calculated results indicate that there are three possible channels in the reaction. The first is an attack reaction by the carbon atom of CN at the carbon atom of the methylene of CH2CO to form the intermediate NCCH2CO followed by a rupture reaction of the C-C bond combined with -CO group to the products CH2CN+CO. The second is a direct addition reaction between CN and CH2CO to form the intermediate CH2C(O)CN followed by its isomerization into NCCH2CO via a CN-shift reaction, and subsequently, NCCH2CO dissociates into CH2CN+CO through a CO-loss reaction. The last is a direct hydrogen abstraction reaction of CH2CO by CN radical. Because of the existence of a 15.44 kJ/mol reaction barrier and higher energy of reaction products, the path can be ruled out as an important channel in the reaction kinetics. The present theoretical computation results, which give an available suggestion on the reaction mechanism, are in good agreement with previous experimental studies.

  7. Spectroscopic Studies of Solar Corona VI: Trend in Line-width Variation of Coronal Emission Lines with Height Independent of the Structure of Coronal Loops

    Indian Academy of Sciences (India)

    Jagdev Singh; Takashi Sakurai; Kiyoshi Ichimoto; S. Muneer

    2006-06-01

    We have obtained spectroscopic observations in coronal emission lines by choosing two lines simultaneously, one [Fe X] 6374 Å and the other [Fe XI] 7892 Å or [Fe XIII] 10747 Å or [Fe XIV] 5303 Å. We found that in 95 per cent of the coronal loops observed in 6374 Å, the FWHM of the emission line increases with height above the limb irrespective of the size, shape and orientation of the loop and that in case of 5303 Å line decreases with height in about 89 per cent of the coronal loops. The FWHM of 7892 Å and 10747 Å emission lines show intermediate behavior. The increase in the FWHM of 6374 Å line with height is the steepest among these four lines.We have also studied the intensity ratio and ratio of FWHM of these lines with respect to those of 6374 Å as a function height above the limb. We found that the intensity ratio of 7892 Å and 10747 Å lines with respect to 6374 Å line increases with height and that of 5303 Å to 6374 Å decreases with height above the limb. This implies that temperature in coronal loops will appear to increase with height in the intensity ratio plots of 7892 Å and 6374 Å; and 10747 Å and 6374 Å whereas it will appear to decrease with height in intensity ratio of 5303 Å to 6374 Å line versus height plot. These findings are up to a height of about 200 arcsec above the limb. The varying ratios with height indicate that relatively hotter and colder plasma in coronal loops interact with each other. Therefore, the observed increase in FWHM with height above the limb of coronal emission lines associated with plasma at about 1 MK may not be due to increase in non-thermal motions caused by coronal waves but due to interaction with the relatively hotter plasma. These findings also do not support the existing coronal loop models, which predict an increase in temperature of the loop with height above the limb.

  8. A reverse transcription loop-mediated isothermal amplification (LAMP) assay for the detection of feline Coronavirus

    National Research Council Canada - National Science Library

    Angelica Stranieri; Stefania Lauzi; Alessia Giordano; Saverio Paltrinieri

    2016-01-01

    ...). The addition of two loop primers allows the reaction time to be of one hour only (Nagamine et al., 2002). The aim of this study was to develop a reverse transcription LAMP assay for an easy and inexpensive detection of feline Coronavirus...

  9. Laser studies of chemical reaction and collision processes

    Energy Technology Data Exchange (ETDEWEB)

    Flynn, G. [Columbia Univ., New York, NY (United States)

    1993-12-01

    This work has concentrated on several interrelated projects in the area of laser photochemistry and photophysics which impinge on a variety of questions in combustion chemistry and general chemical kinetics. Infrared diode laser probes of the quenching of molecules with {open_quotes}chemically significant{close_quotes} amounts of energy in which the energy transferred to the quencher has, for the first time, been separated into its vibrational, rotational, and translational components. Probes of quantum state distributions and velocity profiles for atomic fragments produced in photodissociation reactions have been explored for iodine chloride.

  10. Neutron halo in 14B studied via reaction cross sections

    Directory of Open Access Journals (Sweden)

    Fukuda M.

    2014-03-01

    Full Text Available Reaction cross sections (σR for the neutron-rich nucleus 14B on Be, C, and Al targets have been measured at several energies in the intermediate energy range of 45–120 MeV/nucleon. The present experimental σR show a significant enhancement relative to the systematics of stable nuclei. The nucleon density distribution was deduced through the fitting procedure with the modified Glauber calculation. The necessity of a long tail in the density distribution was found, which is consistent with the valence neutron in 2s1/2 orbital with the small empirical one-neutron separation energy in 14B.

  11. DFT study on mechanism of the classical Biginelli reaction

    Institute of Scientific and Technical Information of China (English)

    Jin Guang Ma; Ji Ming Zhang; Hai Hui Jiang; Wan Yong Ma; Jian Hua Zhou

    2008-01-01

    The condensation of benzaldehyde, urea, and ethyl acetoacetate according to the procedure described by Biginelli was investigated at the B3LYP/6-31G(d), B3LYP/6-31+G(d,p), and B3LYP/6-311+G(3df,2p)//B3LYP/6-31+G(d,p) levels to explore the reaction mechanism. According to the mechanism proposed by Kappe, structures of five intermediates were optimized and four transition states were found. The calculation results proved that the mechanism proposed by Kappe is right.

  12. THE MECHANISM OF THE ABDERHALDEN REACTION : STUDIES ON IMMUNITY. I.

    Science.gov (United States)

    Bronfenbrenner, J

    1915-03-01

    1. The Abderhalden reaction is specific. 2. The properties of serum on which it depends develop in experimental animals simultaneously with antibodies during the process of immunization. 3. It is impossible to observe by direct methods the presence of digesting ferments in the blood of immune animals. 4. The Abderhalden test may be resolved into two phases. A dialyzable substance appears in the second phase and is the result of the autodigestion of serum. 5. The autodigestion of serum in the Abderhalden test is due to the removal of antitrypsin from the serum by the sensitized substratum.

  13. Gravitational smoothing of kinks on cosmic string loops

    CERN Document Server

    Wachter, Jeremy M

    2016-01-01

    We analyze the effect of gravitational back reaction on cosmic string loops with kinks, which is an important determinant of the shape, and thus the potential observability, of string loops which may exist in the universe today. Kinks are not rounded off, but may be straightened out. In some loops, symmetries prevent even this process, so that the loop evaporates in a self-similar fashion and the kinks are unchanged. As an example, we give results for the rectangular Garfinkle-Vachaspati loop.

  14. Experimental Study on Hydrate Induction Time of Gas-Saturated Water-in-Oil Emulsion using a High-Pressure Flow Loop

    Directory of Open Access Journals (Sweden)

    Lv X.F.

    2015-11-01

    Full Text Available Hydrate is one of the critical precipitates which have to be controlled for subsea flow assurance. The induction time of hydrate is therefore a significant parameter. However, there have been few studies on the induction time of the natural gas hydrate formation in a flow loop system. Consequently, a series of experiments were firstly performed, including water, natural gas and Diesel oil, on the hydrate induction time under various conditions such as the supercooling and supersaturation degree, water cut, anti-agglomerant dosage, etc. The experiments were conducted in a high-pressure hydrate flow loop newly constructed in the China University of Petroleum (Beijing, and dedicated to flow assurance studies. Then, based on previous research, this study puts forward a method for induction time, which is characterized by clear definition, convenient measurement and good generality. Furthermore, we investigated the influences of the experimental parameters and analyzed the experimental phenomena for the hydrate induction time in a flowing system.

  15. Finding the positive feedback loops underlying multi-stationarity

    DEFF Research Database (Denmark)

    Feliu, Elisenda; Wiuf, Carsten

    2015-01-01

    BACKGROUND: Bistability is ubiquitous in biological systems. For example, bistability is found in many reaction networks that involve the control and execution of important biological functions, such as signaling processes. Positive feedback loops, composed of species and reactions, are necessary...... for bistability, and generally for multi-stationarity, to occur. These loops are therefore often used to illustrate and pinpoint the parts of a multi-stationary network that are relevant ('responsible') for the observed multi-stationarity. However positive feedback loops are generally abundant in reaction...... networks but not all of them are important for understanding the network's dynamics. RESULTS: We present an automated procedure to determine the relevant positive feedback loops of a multi-stationary reaction network. The procedure only reports the loops that are relevant for multi-stationarity (that is...

  16. Finding the positive feedback loops underlying multi-stationarity

    DEFF Research Database (Denmark)

    Feliu, Elisenda; Wiuf, Carsten

    2015-01-01

    BACKGROUND: Bistability is ubiquitous in biological systems. For example, bistability is found in many reaction networks that involve the control and execution of important biological functions, such as signaling processes. Positive feedback loops, composed of species and reactions, are necessary...... for bistability, and generally for multi-stationarity, to occur. These loops are therefore often used to illustrate and pinpoint the parts of a multi-stationary network that are relevant ('responsible') for the observed multi-stationarity. However positive feedback loops are generally abundant in reaction...... networks but not all of them are important for understanding the network's dynamics. RESULTS: We present an automated procedure to determine the relevant positive feedback loops of a multi-stationary reaction network. The procedure only reports the loops that are relevant for multi-stationarity (that is...

  17. Kinetics of the benzyl + O(3P) reaction: a quantum chemical/statistical reaction rate theory study.

    Science.gov (United States)

    da Silva, Gabriel; Bozzelli, Joseph W

    2012-12-14

    The resonance stabilized benzyl radical is an important intermediate in the combustion of aromatic hydrocarbons and in polycyclic aromatic hydrocarbon (PAH) formation in flames. Despite being a free radical, benzyl is relatively stable in thermal, oxidizing environments, and is predominantly removed through bimolecular reactions with open-shell species other than O(2). In this study the reaction of benzyl with ground-state atomic oxygen, O((3)P), is examined using quantum chemistry and statistical reaction rate theory. C(7)H(7)O energy surfaces are generated at the G3SX level, and include several novel pathways. Transition state theory is used to describe elementary reaction kinetics, with canonical variational transition state theory applied for barrierless O atom association with benzyl. Apparent rate constants and branching ratios to different product sets are obtained as a function of temperature and pressure from solving the time-dependent master equation, with RRKM theory for microcanonical k(E). These simulations indicate that the benzyl + O reaction predominantly forms the phenyl radical (C(6)H(5)) plus formaldehyde (HCHO), with lesser quantities of the C(7)H(6)O products benzaldehyde, ortho-quinone methide, and para-quinone methide (+H), along with minor amounts of the formyl radical (HCO) + benzene. Addition of O((3)P) to the methylene site in benzyl produces a highly vibrationally excited C(7)H(7)O* adduct, the benzoxyl radical, which can β-scission to benzaldehyde + H and phenyl + HCHO. In order to account for the experimental observation of benzene as the major reaction product, a roaming radical mechanism is proposed that converts the nascent products phenyl and HCHO to benzene + HCO. Oxygen atom addition at the ortho and para ring sites in benzyl, which has not been previously considered, is shown to lead to the quinone methides + H; these species are less-stable isomers of benzaldehyde that are proposed as important combustion intermediates, but

  18. Theoretical study on primary reaction of photosynthetic bacteria

    Institute of Scientific and Technical Information of China (English)

    张纯喜; 樊红军; 李良璧; 匡廷云

    1999-01-01

    Theoretical calculation was carried out on the primary electron donor P870 of photosynthetic bacteria. The results show that: (ⅰ) the bimolecular structure of the primary electron donor is more advantageous in energy than monomolecular structure; (ⅱ) the initial configuration of primary electron donor is no longer stable and changes to the configuration with lower energy and chemical reactivity after the charge separation. In the P870, such structural change is completed through the rotation of C3 acetyl, so the oxygen atom of acetyl interacts with the magnesium atom of another bacterio-chlorophyll molecule, and the total energy and chemical reactivity are reduced evidently. It is suggested that the structural change of the primary electron donor is important in preventing the occurrence of charge recombination during the primary reaction and maintaining the high efficiency of the conversion of sun-light to chemical energy. A new mechanism of primary reaction has been proposed, which can give r

  19. Molecular Beam Studies of Hot Atom Chemical Reactions: Reactive Scattering of Energetic Deuterium Atoms

    Science.gov (United States)

    Continetti, R. E.; Balko, B. A.; Lee, Y. T.

    1989-02-01

    A brief review of the application of the crossed molecular beams technique to the study of hot atom chemical reactions in the last twenty years is given. Specific emphasis is placed on recent advances in the use of photolytically produced energetic deuterium atoms in the study of the fundamental elementary reactions D + H{sub 2} -> DH + H and the substitution reaction D + C{sub 2}H{sub 2} -> C{sub 2}HD + H. Recent advances in uv laser and pulsed molecular beam techniques have made the detailed study of hydrogen atom reactions under single collision conditions possible.

  20. DFT studies on cobalt-catalyzed cyclotrimerization reactions: the mechanism and origin of reaction improvement under microwave irradiation.

    Science.gov (United States)

    Rodriguez, Antonio M; Cebrián, Cristina; Prieto, Pilar; García, José Ignacio; de la Hoz, Antonio; Díaz-Ortiz, Ángel

    2012-05-14

    A DFT computational mechanistic study of the [2+2+2] cyclotrimerization of a diyne with benzonitrile, catalyzed by a cobalt complex, has been carried out. Three alternative catalytic cycles have been examined together with the precatalytic step (responsible for the induction period). The favored mechanism takes place by means of an intramolecular metal-assisted [4+2] cycloaddition. The beneficial role of microwave activation has been studied. It is concluded that microwave irradiation can decrease the catalytic induction period through thermal effects and can also increase the triplet lifetime and promote the reaction, thus improving the final yield.

  1. Importance of cytochromes in cyclization reactions: quantum chemical study on a model reaction of proguanil to cycloguanil.

    Science.gov (United States)

    Arfeen, Minhajul; Patel, Dhilon S; Abbat, Sheenu; Taxak, Nikhil; Bharatam, Prasad V

    2014-10-30

    Proguanil, an anti-malarial prodrug, undergoes cytochrome P450 catalyzed biotransformation to the pharmacologically active triazine metabolite (cycloguanil), which inhibits plasmodial dihydrofolate reductase. This cyclization is catalyzed by CYP2C19 and many anti-malarial lead compounds are being designed and synthesized to exploit this pathway. Quantum chemical calculations were performed using the model species (Cpd I for active species of cytochrome and N4-isopropyl-N6-methylbiguanide for proguanil) to elucidate the mechanism of the cyclization pathway. The overall reaction involves the loss of a water molecule, and is exothermic by approximately 55 kcal/mol, and involves a barrier of approximately 17 kcal/mol. The plausible reaction pathway involves the initial H-radical abstraction from the isopropyl group by Cpd I, followed by two alternative paths- (i) oxygen rebound to provide hydroxyl derivative and (ii) loss of additional H-radical to yield 1,3,5-triazatriene, which undergoes cyclization. This study helped in understanding the role of the active species of cytochromes in this important cyclization reaction. Copyright © 2014 Wiley Periodicals, Inc.

  2. Empirical potential simulations of interstitial dislocation loops in uranium dioxide

    Science.gov (United States)

    Le Prioux, Arno; Fossati, Paul; Maillard, Serge; Jourdan, Thomas; Maugis, Philippe

    2016-10-01

    Stoichiometric circular shaped interstitial dislocation loop energies are calculated in stoichiometric UO2 by empirical potential simulation. The Burgers vector directions studied are and . The main structural properties of each type of interstitial dislocation loop are determined, including stacking fault energy. Defect energies are compared and a maximum size for stable dislocation loops before transition to dislocation loops is given. A model of dislocation loop energy based on elasticity theory is then fitted on the basis of these simulation results.

  3. Gauge theory loop operators and Liouville theory

    Energy Technology Data Exchange (ETDEWEB)

    Drukker, Nadav [Humboldt Univ. Berlin (Germany). Inst. fuer Physik; Gomis, Jaume; Okuda, Takuda [Perimeter Inst. for Theoretical Physics, Waterloo, ON (Canada); Teschner, Joerg [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)

    2009-10-15

    We propose a correspondence between loop operators in a family of four dimensional N=2 gauge theories on S{sup 4} - including Wilson, 't Hooft and dyonic operators - and Liouville theory loop operators on a Riemann surface. This extends the beautiful relation between the partition function of these N=2 gauge theories and Liouville correlators found by Alday, Gaiotto and Tachikawa. We show that the computation of these Liouville correlators with the insertion of a Liouville loop operator reproduces Pestun's formula capturing the expectation value of a Wilson loop operator in the corresponding gauge theory. We prove that our definition of Liouville loop operators is invariant under modular transformations, which given our correspondence, implies the conjectured action of S-duality on the gauge theory loop operators. Our computations in Liouville theory make an explicit prediction for the exact expectation value of 't Hooft and dyonic loop operators in these N=2 gauge theories. The Liouville loop operators are also found to admit a simple geometric interpretation within quantum Teichmueller theory as the quantum operators representing the length of geodesics. We study the algebra of Liouville loop operators and show that it gives evidence for our proposal as well as providing definite predictions for the operator product expansion of loop operators in gauge theory. (orig.)

  4. Closed-loop operation of a solar chemical heat pipe at the Weizmann Institute solar furnace

    Energy Technology Data Exchange (ETDEWEB)

    Levitan, R.; Levy, M.; Rosin, H.; Rubin, R. (Materials Research Dept., Weizmann Inst. of Science, Rehovot (Israel))

    1991-12-01

    The performance of a solar chemical heat pipe was studied using CO{sub 2} reforming of methane as the vehicle for storage and transport of solar energy. The endothermic reforming reaction was carried out in an Inconel reactor, packed with a rhodium catalyst. The reactor was suspended in an insulated box receiver which was placed in the focal plane of the Schaeffer Solar Furnace of the Weizmann Institute of Science. The exothermic methanation reaction was run in a tubular reactor filled with the same Rh catalyst and fed with the products from the reformer. Conversions of over 80% were achieved for both reactions. In the closed-loop mode the products from the reformer and from the methanator were compressed into separate storage tanks. The two reactions were run consecutively and the whole process was repeated for nine cycles. The overall performance of the closed loop was according to expectations. (orig.).

  5. Study on the Vesiculation during Mouse Sperm Acrosome Reaction

    Institute of Scientific and Technical Information of China (English)

    林家豪; 周作民; 胡志刚; 王黎熔; 林敏; 张适

    1994-01-01

    The location of the mono-membrane and the bi-membrane vesicles of mouse sperm was identified using Con A in conjugation with the colloidal gold. The observation showed that both mono-membrane vesicfes and outer layer of the hi-membrane vesicles come from the outer acrosome membrane. The inner membrane layer of the bi-member vesicles and residual membrane distributed among the vesicles are really the ptasmatemma. It is suggested that the outer acrosome membrane did not fuse with the pfasmafemma during mouse sperm acrosome reaction and that both the mono-membrane and the bi-membrane vesicles of mouse sperm were formed due to winding of the outer acrosome membrane.

  6. In situ reaction furnace for real-time XRD studies.

    Science.gov (United States)

    Riello, Pietro; Lausi, Andrea; Macleod, Jennifer; Plaisier, Jasper Rikkert; Zerauschek, Giulio; Fornasiero, Paolo

    2013-01-01

    The new furnace at the Materials Characterization by X-ray Diffraction beamline at Elettra has been designed for powder diffraction measurements at high temperature (up to 1373 K at the present state). Around the measurement region the geometry of the radiative heating element assures a negligible temperature gradient along the capillary and can accommodate either powder samples in capillary or small flat samples. A double capillary holder allows flow-through of gas in the inner sample capillary while the outer one serves as the reaction chamber. The furnace is coupled to a translating curved imaging-plate detector, allowing the collection of diffraction patterns up to 2θ ≃ 130°.

  7. Kinetic and mechanistic studies of free-radical reactions in combustion

    Energy Technology Data Exchange (ETDEWEB)

    Tully, F.P. [Sandia National Laboratories, Livermore, CA (United States)

    1993-12-01

    Combustion is driven by energy-releasing chemical reactions. Free radicals that participate in chain reactions carry the combustion process from reactants to products. Research in chemical kinetics enables us to understand the microscopic mechanisms involved in individual chemical reactions as well as to determine the rates at which they proceed. Both types of information are required for an understanding of how flames burn, why engines knock, how to minimize the production of pollutants, and many other important questions in combustion. In this program the authors emphasize accurate measurements over wide temperature ranges of the rates at which ubiquitous free radicals react with stable molecules. The authors investigate a variety of OH, CN, and CH + stable molecule reactions important to fuel conversion, emphasizing application of the extraordinarily precise technique of laser photolysis/continuous-wave laser-induced fluorescence (LP/cwLIF). This precision enables kinetic measurements to serve as mechanistic probes. Since considerable effort is required to study each individual reaction, prudent selection is critical. Two factors encourage selection of a specific reaction: (1) the rates and mechanisms of the subject reaction are required input to a combustion model; and (2) the reaction is a chemical prototype which, upon characterization, will provide fundamental insight into chemical reactivity, facilitate estimation of kinetic parameters for similar reactions, and constrain and test the computational limits of reaction-rate theory. Most studies performed in this project satisfy both conditions.

  8. Thermodynamic Study of Hydrolysis Reactions in Aqueous Solution from Ab Initio Potential and Molecular Dynamics Simulations

    Directory of Open Access Journals (Sweden)

    S. Tolosa

    2013-01-01

    Full Text Available A procedure for the theoretical study of chemical reactions in solution by means of molecular dynamics simulations of aqueous solution at infinite dilution is described using ab initio solute-solvent potentials and TIP3P water model to describe the interactions. The procedure is applied to the study of neutral hydrolysis of various molecules (HCONH2, HNCO, HCNHNH2, and HCOOCH3 via concerted and water-assisted mechanisms. We used the solvent as a reaction coordinate and the free energy curves for the calculation of the properties related with the reaction mechanism, namely, reaction and activation energies.

  9. Study of the Kinetics of an S[subscript N]1 Reaction by Conductivity Measurement

    Science.gov (United States)

    Marzluff, Elaine M.; Crawford, Mary A.; Reynolds, Helen

    2011-01-01

    Substitution reactions, a central part of organic chemistry, provide a model system in physical chemistry to study reaction rates and mechanisms. Here, the use of inexpensive and readily available commercial conductivity probes coupled with computer data acquisition for the study of the temperature and solvent dependence of the solvolysis of…

  10. Reactions of lactose during heat treatment of milk: a quantitative study.

    NARCIS (Netherlands)

    Berg, H.E.

    1993-01-01

    The kinetics of the chemical reactions of lactose during heat treatment of milk were studied. Skim milk and model solutions resembling milk were heated. Reaction products were determined and the influence of varying lactose, casein and fat concentration on the formation of these products was studied

  11. Crossed molecular beam studies of unimolecular reaction dynamics. [Angular and velocity distributions

    Energy Technology Data Exchange (ETDEWEB)

    Buss, R.J.

    1979-04-01

    The study of seven radical-molecule reactions using the crossed molecular beam technique with supersonic nozzle beams is reported. Product angular and velocity distributions were obtained and compared with statistical calculations in order to identify dynamical features of the reactions. In the reaction of chlorine and fluorine atoms with vinyl bromide, the product energy distributions are found to deviate from predictions of the statistical model. A similar effect is observed in the reaction of chlorine atoms with 1, 2 and 3-bromopropene. The reaction of oxygen atoms with ICl and CF/sub 3/I has been used to obtain an improved value of the IO bond energy, 55.0 +- 2.0 kcal mol/sup -1/. In all reactions studied, the product energy and angular distributions are found to be coupled, and this is attributed to a kinematic effect of the conservation of angular momentum.

  12. A Comparative Study on Visual Choice Reaction Time for Different Colors in Females

    Directory of Open Access Journals (Sweden)

    Grrishma Balakrishnan

    2014-01-01

    Full Text Available Reaction time is one of the important methods to study a person’s central information processing speed and coordinated peripheral movement response. Visual choice reaction time is a type of reaction time and is very important for drivers, pilots, security guards, and so forth. Previous studies were mainly on simple reaction time and there are very few studies on visual choice reaction time. The aim of our study was to compare the visual choice reaction time for red, green, and yellow colors of 60 healthy undergraduate female volunteers. After giving adequate practice, visual choice reaction time was recorded for red, green, and yellow colors using reaction time machine (RTM 608, Medicaid, Chandigarh. Repeated measures of ANOVA and Bonferroni multiple comparison were used for analysis and P<0.05 was considered statistically significant. The results showed that both red and green had significantly less choice visual choice reaction (P values <0.0001 and 0.0002 when compared with yellow. This could be because individual color mental processing time for yellow color is more than red and green.

  13. Insights into the O-Acetylation Reaction of Hydroxylated Heterocyclic Amines by Human Arylamine N-Acetyltransferases: A Computational Study

    Energy Technology Data Exchange (ETDEWEB)

    Lau, E Y; Felton, J S; Lightstone, F C

    2006-06-06

    A computational study was performed to better understand the differences between human arylamine N-acetyltransferase (NAT) 1 and 2. Homology models were constructed from available crystal structures and comparisons of the active site residues 125, 127, and 129 for these two enzymes provide insight into observed substrate differences. The NAT2 model provided a basis for understanding how some of the common mutations may affect the structure of the protein. Molecular dynamics simulations of the human NAT models and the template structure (NAT from Mycobacterium smegmatis) were performed and showed the models to be stable and reasonable. Docking studies of hydroxylated heterocyclic amines in the models of NAT1 and NAT2 probed the differences exhibited by these two proteins with mutagenic agents. The hydroxylated heterocyclic amines were only able to fit into the NAT2 active site, and an alternative binding site by the P-loop was found using our models and will be discussed. Additionally, quantum mechanical calculations were performed to study the O-acetylation reaction of the hydroxylated heterocyclic amines N-OH MeIQx and N-OH PhIP. This study has given us insight into why there are substrate differences among isoenzymes and explains some of the polymorphic activity differences.

  14. Understanding the domino reaction between 3-chloroindoles and methyl coumalate yielding carbazoles. A DFT study.

    Science.gov (United States)

    Domingo, Luis R; Sáez, José A; Emamian, Saeed R

    2015-02-21

    The molecular mechanism of the reaction between N-methyl-3-chloroindole and methyl coumalate yielding carbazole has been studied using DFT methods at the MPWB1K/6-311G(d,p) level in toluene. This reaction is a domino process that comprises three consecutive reactions: (i) a polar Diels-Alder (P-DA) reaction between indole and methyl coumalate yielding two stereoisomeric [2 + 4] cycloadducts (CAs); (ii) the elimination of HCl from these CAs affording two stereoisomeric intermediates; and (iii) the extrusion of CO2 in these intermediates, finally yielding the carbazole. This P-DA reaction proceeds in a completely regioselective and slightly exo selective fashion. In spite of the highly polar character of this P-DA reaction, it presents a high activation enthalpy of 21.8 kcal mol(-1) due to the loss of the aromatic character of the indole during the C-C bond formation. Thermodynamic calculations suggest that the P-DA reaction is the rate-determining step of this domino reaction; in addition, the initial HCl elimination in the formal [2 + 4] CAs is kinetically favoured over the extrusion of CO2. Although the P-DA reaction is kinetically and thermodynamically very unfavourable, the easier HCl and CO2 elimination from the [2 + 4] CAs together with the strong exergonic character of the CO2 extrusion makes the P-DA reaction irreversible. An ELF topological analysis of the bonding changes along the P-DA reaction supports a two-stage one-step mechanism. An analysis of the global DFT reactivity indices at the ground state of the reagents confirms the highly polar character of this P-DA reaction. Finally, the complete regioselectivity of the studied reactions can be explained using the Parr functions.

  15. Hand-suture versus stapling for closure of loop ileostomy: HASTA-Trial: a study rationale and design for a randomized controlled trial

    Directory of Open Access Journals (Sweden)

    Krüger Matthias

    2011-02-01

    Full Text Available Abstract Background Colorectal cancer is the second most common tumor in developed countries, with a lifetime prevalence of 5%. About one third of these tumors are located in the rectum. Surgery in terms of low anterior resection with mesorectal excision is the central element in the treatment of rectal cancer being the only option for definite cure. Creating a protective diverting stoma prevents complications like anastomotic failure and meanwhile is the standard procedure. Bowel obstruction is one of the main and the clinically and economically most relevant complication following closure of loop ileostomy. The best surgical technique for closure of loop ileostomy has not been defined yet. Methods/Design A study protocol was developed on the basis of the only randomized controlled mono-center trial to solve clinical equipoise concerning the optimal surgical technique for closure of loop ileostomy after low anterior resection due to rectal cancer. The HASTA trial is a multi-center pragmatic randomized controlled surgical trial with two parallel groups to compare hand-suture versus stapling for closure of loop ileostomy. It will include 334 randomized patients undergoing closure of loop ileostomy after low anterior resection with protective ileostomy due to rectal cancer in approximately 20 centers consisting of German hospitals of all level of health care. The primary endpoint is the rate of bowel obstruction within 30 days after ileostomy closure. In addition, a set of surgical and general variables including quality of life will be analyzed with a follow-up of 12 months. An investigators meeting with a practical session will help to minimize performance bias and enforce protocol adherence. Centers are monitored centrally as well as on-site before and during recruitment phase to assure inclusion, treatment and follow up according to the protocol. Discussion Aim of the HASTA trial is to evaluate the efficacy of hand-suture versus stapling for

  16. Mantra, music and reaction times: a study of its applied aspects

    Directory of Open Access Journals (Sweden)

    Varun Malhotra, Rinku Garg, Usha Dhar, Neera Goel, Yogesh Tripathy, Iram Jaan, Sachit Goyal, Sumit Arora

    2014-11-01

    Full Text Available Aims &Objectives: The mechanism of the effects of music is still under scientific study and needs to be understood in a better way. We designed this study to see how music affects reaction time and concentration. The aim of our study was to study the effect of Gayatri mantra on reaction time. Material and Methods: 30 healthy subjects were selected for the study. Baseline record of Visual online Reaction time test was taken. Online visual reaction time was measured during listening to Gayatri Mantra was taken. Results:The reaction times decreased significantly p<0.001. Conclusion: Listening to music at work area reduces distractions, helps increase concentration and delays fatigue. It can be used to heal tinnitus, as an educational tool to develop children with special needs, Alzheimers disease, to improve motor skills in Parkinsonism and help alleviate pain after surgery.

  17. Hydraulic study of parallel channels coupled to recirculation loops; Estudio hidraulico de canales paralelos acoplados a lazos de recirculacion

    Energy Technology Data Exchange (ETDEWEB)

    Campos G, R. M.; Cecenas F, M. [Instituto de Investigaciones Electricas, Av. Reforma 113, Col. Palmira, 62490 Cuernavaca, Morelos (Mexico)], e-mail: rmcampos@iie.org.mx

    2009-10-15

    In this work is integrated a model of recirculation loops that allows to characterize each loop for separate and with which is possible to analyze events as shot of recirculation bombs or its transfer of high to low speed. The recirculation pattern is integrated to a model of 36 channels in parallel that represents the core of a BWR. Because the core reactor is conformed by fuel assemblies physically prepared in a parallel arrangement, it is natural to obtain a parallel application of complete pattern, where are have 36 channels tasks more other two tasks that calculates recirculation and punctual kinetics, respectively. As initial test of system, which even it is found in development, was analyzed a discharge of both recirculation pumps. In this test transitory it is only verified the hydraulic behavior, the power is imposed artificially as frontier condition that is function of flow in the calculated core by the recirculation pattern. The pattern of thermal hydraulics channel and the recirculation loops are programmed in language C, the neutronic pattern is programmed in Fortran 77. For the simulations was used a work station Alpha Station DS20E with operative system Unix and the communication system Parallel Virtual Machine, that allows to a heterogeneous collection of computers in net to work like a virtual computer in parallel. (Author)

  18. Theoretical studies on the reaction pathways of electronically excited DAAF

    Energy Technology Data Exchange (ETDEWEB)

    Quenneville, Jason M [Los Alamos National Laboratory; Moore, David S [Los Alamos National Laboratory

    2009-01-01

    The use of temporally and spectrally shaped ultrafast laser pulses to initiate, as well as detect, high explosives is being explored at Los Alamos. High level ab initio calculations, presented here, are employed to help guide and interpret the experiments. The ground and first excited electronic states of 3,3{prime}-diamino-4,4{prime}-azoxyfurazan (DAAF) are investigated using complete active space self-consistent field (CASSCF) and time-dependent density functional theory (TD-DFT). The geometrical and energetic character of the excited state minima, conical intersections and reaction pathways of DAAF are described. Two radiative and two non-radiative excited state population quenching mechanisms are outlined, and possible pathways for photochemical and spectroscopic control are discussed. The use of laser light to control chemical reactions has many applications. The initiation and the detection of explosives are two such applications currently under development at Los Alamos. Though inherently experimental, the project can be aided by theory through both prediction and interpretation. When the laser light is in the UV/visible region of the electromagnetic spectrum, the absorbing molecule is excited electronically and excitation decay may occur either radiatively (fluorescence or phosphorescence) or non-radiatively (through internal conversion). In many cases decay of the excitation occurs through a mixture of processes, and maximizing the desired result requires sophisticated laser pulses whose amplitude has been optimally modulated in time and/or frequency space. Control of cis-stilbene photochemistry was recently demonstrated in our group, and we aim to extend this work to high explosive compounds. Maximizing radiative decay leads to increased fluorescence quantum yields and enhances the possibility of spectral detection of the absorbing molecule. Maximizing non-radiative decay can lead to chemistry, heating of the sample and possibly detonation initiation in

  19. A study on the ester interchange reaction of dimethyl naphthalate with ethylene glycol

    Energy Technology Data Exchange (ETDEWEB)

    Sho, S.Y.; Cheong, S.I [Hannam University, Taejeon (Korea)

    2001-01-01

    The kinetics of ester interchange reaction of dimethyl naphthalate (DMN) with ethylene glycol (EG) has been studied in the range of 180-200 deg. C using zinc and manganese catalysts. The reaction was performed in a semibatch reactor under nonisothermal condition and the degree of reaction was calculated from experimental data of methanol removal rate and reaction temperature. As a reaction model, both the functional group model and the molecular species model were applied and analysed. In case of zinc catalysts, the ratio of reaction rate of methyl hydroxyethyl naphthalate (MHEN) with EG on that of DMN with EG is about 1.4, whereas in case of manganese catalyst the ration is about 4.3, which implies that the reaction rate is quite dependent on the type of catalyst. In case of zinc catalyst, the reaction order of catalyst concentration on either DMN or MHEN and EG is less than 1, whereas in case of manganese catalyst, the reaction order is larger than 1. The activation energy for zinc and manganese catalyst, irrespective of the type of molecular species, e. g., DMN and MHEN, were found to be 25000 and 28750 cal/mol, respectively. As a result of comparing two reaction model, the molecular species model fits well for the experimental dat. (author). 12 refs., 1 tab., 8 figs.

  20. Higher Loop Nonplanar Anomalous Dimensions from Symmetry

    CERN Document Server

    Koch, Robert de Mello; Messamah, Ilies

    2013-01-01

    In this article we study the action of the one loop dilatation operator on operators with a classical dimension of order N. These operators belong to the su(2) sector and are constructed using two complex fields Y and Z. For these operators non-planar diagrams contribute already at the leading order in N and the planar and large N limits are distinct. The action of the one loop and the two loop dilatation operator reduces to a set of decoupled oscillators and factorizes into an action on the Z fields and an action on the Y fields. Direct computation has shown that the action on the Y fields is the same at one and two loops. In this article, using the su(2) symmetry algebra as well as structural features of field theory, we give compelling evidence that the factor in the dilatation operator that acts on the Ys is given by the one loop expression, at any loop order.

  1. Experimental study of $\\eta$ meson photoproduction reaction at MAMI

    CERN Document Server

    Kashevarov, V L

    2015-01-01

    New data for the differential cross sections, polarization observables $T$, $F$, and $E$ in the reaction of $\\eta$ photoproduction on proton from the threshold up to a center-of-mass energy of W=1.9 GeV are presented. The data were obtained with the Crystal-Ball/TAPS detector setup at the Glasgow tagged photon facility of the Mainz Microtron MAMI. The polarization measurements were made using a frozen-spin butanol target and circularly polarized photon beam. The results are compared to existing experimental data and different PWA predictions. The data solve a long-standing problem related the angular dependence of older $T$ data close to threshold. The unexpected relative phase motion between $s$- and $d$-wave amplitudes required by the old data is not confirmed. At higher energies, all model predictions fail to reproduce the new polarization data indicating a significant impact on our understanding of the underlying dynamics of $\\eta$ meson photoproduction. Furthermore, we present a fit of the new data and e...

  2. Merged-beams Reaction Studies of O + H_3^+

    CERN Document Server

    de Ruette, N; O'Connor, A P; Urbain, X; Buzard, C F; Vissapragada, S; Savin, D W

    2015-01-01

    We have measured the reaction of O + H3+ forming OH+ and H2O+. This is one of the key gas-phase astrochemical processes initiating the formation of water molecules in dense molecular clouds. For this work, we have used a novel merged fast-beams apparatus which overlaps a beam of H3+ onto a beam of ground-term neutral O. Here, we present cross section data for forming OH+ and H2O+ at relative energies from \\approx 3.5 meV to \\approx 15.5 and 0.13 eV, respectively. Measurements were performed for statistically populated O(3PJ) in the ground term reacting with hot H3+ (with an internal temperature of \\approx 2500-3000 K). From these data, we have derived rate coefficients for translational temperatures from \\approx 25 K to \\approx 10^5 and 10^3 K, respectively. Using state-of-the-art theoretical methods as a guide, we have converted these results to a thermal rate coefficient for forming either OH+ or H2O+, thereby accounting for the temperature dependence of the O fine-structure levels. Our results are in good ...

  3. Experimental study of η meson photoproduction reaction at MAMI

    Directory of Open Access Journals (Sweden)

    Kashevarov V. L.

    2015-01-01

    Full Text Available New data for the differential cross sections, polarization observables T, F, and E in the reaction of η photoproduction on proton from the threshold up to a center-of-mass energy of W=1.9 GeV are presented. The data were obtained with the Crystal-Ball/TAPS detector setup at the Glasgow tagged photon facility of the Mainz Microtron MAMI. The polarization measurements were made using a frozen-spin butanol target and circularly polarized photon beam. The results are compared to existing experimental data and different PWA predictions. The data solve a long-standing problem related the angular dependence of older T data close to threshold. The unexpected relative phase motion between s- and d-wave amplitudes required by the old data is not confirmed. At higher energies, all model predictions fail to reproduce the new polarization data indicating a significant impact on our understanding of the underlying dynamics of η meson photoproduction. Furthermore, we present a fit of the new data and existing data from GRAAL for ∑ asymmetry based on an expansion in terms of associated Legendre polynomials. A Legendre decomposition shows the sensitivity to small partialwave contributions. The sensitivity of the Legendre coefficients to the nucleon resonance parameters is shown using the ηMAID isobar model.

  4. Kinetic studies on the reaction between dicyanocobinamide and hypochlorous acid.

    Directory of Open Access Journals (Sweden)

    Dhiman Maitra

    Full Text Available Hypochlorous acid (HOCl is a potent oxidant generated by myeloperoxidase (MPO, which is an abundant enzyme used for defense against microbes. We examined the potential role of HOCl in corrin ring destruction and subsequent formation of cyanogen chloride (CNCl from dicyanocobinamide ((CN2-Cbi. Stopped-flow analysis revealed that the reaction consists of at least three observable steps, including at least two sequential transient intermediates prior to corrin ring destruction. The first two steps were attributed to sequential replacement of the two cyanide ligands with hypochlorite, while the third step was the destruction of the corrin ring. The formation of (OCl(CN-Cbi and its conversion to (OCl2-Cbi was fitted to a first order rate equation with second order rate constants of 0.002 and 0.0002 µM(-1 s(-1, respectively. The significantly lower rate of the second step compared to the first suggests that the replacement of the first cyanide molecule by hypochlorite causes an alteration in the ligand trans effects changing the affinity and/or accessibility of Co toward hypochlorite. Plots of the apparent rate constants as a function of HOCl concentration for all the three steps were linear with Y-intercepts close to zero, indicating that HOCl binds in an irreversible one-step mechanism. Collectively, these results illustrate functional differences in the corrin ring environments toward binding of diatomic ligands.

  5. Tissue reaction around loosened prostheses: a histological, X-ray microanalytic and immunological study.

    Directory of Open Access Journals (Sweden)

    Hayashi,Takashi

    1986-10-01

    Full Text Available Tissue reactions at the cement-bone and artificial implant-bone interface were examined light and electron microscopically in thirty-six patients who underwent revisory operation of hip or knee replacement. The reactions were classified into three types: inert tissue, active tissue with giant cell proliferation, and active tissue with predominant foamy cell proliferation. The third type of reaction was found only in total hip replacement with bone cement. No evidence of allergic reaction to implanted materials was found in any replacement, though active cellular infiltrations were observed around loosened prostheses especially in cemented arthroplasty. The tissue reactions always occurred around instable or loosened prostheses. Thus, the present study shows that mechanical instability is the primary cause of such undesired tissue reactions.

  6. A mechanochemical study of the effects of compression on a Diels-Alder reaction

    Science.gov (United States)

    Jha, Sanjiv K.; Brown, Katie; Todde, Guido; Subramanian, Gopinath

    2016-08-01

    We examine the effects of compressive external forces on the mechanisms of the parent Diels-Alder (DA) reaction between butadiene and ethylene. Reaction pathways and transition states were calculated using the nudged elastic band method within a mechanochemical framework at the CASSCF(6,6)/6-31G**, as well as the B3LYP/6-311++G** levels of theory. Our results suggest that compressive hydrostatic pressure lowers the energy barrier for the parent DA reaction while suppressing the undesirable side reaction, thereby leading to a direct increase in the yield of cyclohexene. Compressive pressure also increases the exothermicity of the parent DA reaction, which would lead to increased temperatures in a reaction vessel and thereby indirectly increase the yield of cyclohexene. Our estimates indicate that the compression used in our study corresponds to a range of 68 MPa-1410 MPa.

  7. Thermodynamic and Kinetic Studies on the SiH + XH3 (X=N, P) Reactions

    Institute of Scientific and Technical Information of China (English)

    Wei Jiang SI; hu Ping ZHUO; Guan Zhi JU

    2004-01-01

    Based on the quantum chemical study of the silylidyne insertion reaction with NH3 or PH3, the general statistical thermodynamics and Eyring transition state theory with Wigner correction are used to compute the changes of thermodynamic functions, equilibrium constants, A factors and rate constants of the two reactions in the temperature range 200-2000K. The results show that both of these reactions are thermodynamically dominant at low temperatures and kinetically favored at higher temperatures. The comparison between these two reactions shows that the SiH reaction with NH3 is more exothermic than SiH with PH3, while the rate constant of SiH reaction with NH3 is lower than that of SiH with PH3 at the same temperature.

  8. Theoretical Studies of the Reaction Mechanisms of CH3S + NO2

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The potential energy surface for the CH3S + NO2 reaction has been studied using the ab initio G3 (MP2) method. A variety of possible complexes and saddle points along the minimum energy reaction paths have been characterized at UMP2 (full)/6-31G(d) level. The calculations reveal dominating reaction mechanisms of the title reaction: CH3S + NO2 firstly produce intermediate CH3SONO, then break up into CH3SO + NO. The results are valuable to understand the atmospheric sulfur compounds oxidation mechanism.

  9. Direct Dynamics Study on CH2O + CH·3 → CHO + CH4 Reaction

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    It is still a formidable challenge to study CH2O + CH·3 → CHO + CH4 reaction in the gas phase by traditional dynamics, because of the large number of freedom degrees for the system.In this paper, direct dynamics, in which trajectories were run directly on the DFT potential energy surface, have been applied to the reaction, which gave a direct look in the reaction processes.Two sets of trajectories at different initial orientations of reactants and temperature have been simulated. And the detailed reaction mechanisms have been described.

  10. Inflammatory reaction in experimental hepatic amebiasis. An ultrastructural study.

    Science.gov (United States)

    Tsutsumi, V.; Martinez-Palomo, A.

    1988-01-01

    One of the hallmarks of tissue necrosis produced by the human protozoan parasite Entamoeba histolytica, the causative agent of human amebiasis, appeared to be the lack of inflammatory reaction to the invading trophozoites. Recent evidence suggests, however, that inflammatory cells do appear during early stages of amebic destructive lesions and that they contribute to the establishment of foci of tissue necrosis in intestinal and liver lesions. The present analysis of the fine-structural changes that take place during early stages of amebic liver abscesses induced in hamsters after the intraportal inoculation of axenic amebas has shown that large numbers of polymorphonuclear leukocytes (PMNs) are recruited around invading amebas. These leukocytes lyse as a consequence of contact-mediated damage induced by the trophozoites. Amebas were also capable of ingesting apparently intact PMNs. Macrophages and eosinophils were also recruited at the foci of inflammation. At all times examined, trophozoites of Entamoeba histolytica survived in spite of being in close contact with PMNs or degranulating eosinophils. The ultrastructural observations have also shown the lack of direct contact between amebas and liver parenchymal cells during the initial stages of the focal liver necrosis induced by the parasite, therefore supporting the view that hepatic damage may be effected indirectly through lysis of inflammatory cells. The results also provide a basis for the understanding of the induction of experimental protective immunity against invasive amebiasis, a process which seems to be mostly dependent on cellular mechanisms. Images Figure 1 Figure 3 Figure 4 Figure 5 Figure 6 Figure 7 Figure 8 Figure 9 Figure 10 Figure 11 Figure 12 PMID:3337207

  11. Design Principles for Closed Loop Supply Chains

    NARCIS (Netherlands)

    H.R. Krikke (Harold); C.P. Pappis (Costas); G.T. Tsoulfas; J.M. Bloemhof-Ruwaard (Jacqueline)

    2001-01-01

    textabstractIn this paper we study design principles for closed loop supply chains. Closed loop supply chains aim at closing material flows thereby limiting emission and residual waste, but also providing customer service at low cost. We study 'traditional' and 'new' design principles known in the l

  12. Design Principles for Closed Loop Supply Chains

    NARCIS (Netherlands)

    H.R. Krikke (Harold); C.P. Pappis (Costas); G.T. Tsoulfas; J.M. Bloemhof-Ruwaard (Jacqueline)

    2001-01-01

    textabstractIn this paper we study design principles for closed loop supply chains. Closed loop supply chains aim at closing material flows thereby limiting emission and residual waste, but also providing customer service at low cost. We study 'traditional' and 'new' design principles known in the

  13. Observational Evidence for Loop-Loop Interaction

    Science.gov (United States)

    Guiping, W.; Guangli, H.; Yuhua, T.; Aoao, X.

    2004-01-01

    Through analysis of the data including the hard x-ray(BASTE) microwave(NoRP) and magnetogram(MDI from SOHO) as well as the images of soft x-ray(YHKOH) and EIT(SOHO) on Apr. 151998 solar flare in the active region 8203(N30W12) we found: (1) there are similar quasi period oscillation in the profile of hard x-ray flux (25-5050-100keV) and microwave flux(1GHz) with duration of 85+/-25s every peak includes two sub-peak structures; (2) in the preheat phase of the flare active magnetic field changes apparently and a s-pole spot emerges ; (3) several EIT and soft x-ray loops exist and turn into bright . All of these may suggest that loop-loop interaction indeed exist. Through reconnection the electrons may be accelerated and the hard x-ray and microwave emission take place.

  14. Fundamental studies of high-temperature corrosion reactions. Fifth annual progress report

    Energy Technology Data Exchange (ETDEWEB)

    Rapp, R.A.

    1980-02-01

    The in-situ study of metal oxidation reactions and the mechanism of the sulfidation of molybdenum by sulfur gases were studied. Equipment including a SEM microscope, heater and power supply which were used is described. (FS)

  15. Differential scanning calorimetry and reaction kinetics studies of {gamma} + {alpha}{sub 2} Ti aluminide

    Energy Technology Data Exchange (ETDEWEB)

    Gupta, R.K., E-mail: rohitkumar_gupta@vssc.gov.in [Vikram Sarabhai Space Centre, ISRO, Trivandrum 695 022 (India); Pant, Bhanu [Vikram Sarabhai Space Centre, ISRO, Trivandrum 695 022 (India); Agarwala, Vijaya [Indian Institute of Technology Roorkee, Roorkee 247 667 (India); Sinha, P.P. [Vikram Sarabhai Space Centre, ISRO, Trivandrum 695 022 (India)

    2012-12-14

    Reaction synthesis method for titanium aluminide processing consists of an exothermic reaction among alloying elements present and primarily between titanium and aluminium particles at specific temperature range. Study of this reaction helps in understanding the process of aluminide formation. Differential scanning calorimetry (DSC) study is the suitable method to study such reactions. In the present work, five different alloy mixtures based on Ti48Al2Cr2Nb0.1B are prepared and DSC study is carried out. Onset temperature, peak temperature and completion temperature of the major exothermic reaction is analyzed at different heating rates. Further, kinetics of the reaction is studied using Johnson-Mehl-Avrami equation. Activation energy and Avrami parameter are calculated and compared with the reported works on binary alloy. It has been observed that exothermic reaction is triggered by melting of aluminium. Boron assists in increasing the enthalpy of reaction by boride formation. Primary reaction product is found to be TiAl{sub 3}. Activation energy as well as Avrami parameter is found to have marginal variation due to small change in alloying elements in different alloys and due to heating rates in the same alloy. -- Highlights: Black-Right-Pointing-Pointer Reaction kinetics studies of Ti-aluminide alloy powder mixtures carried out. Black-Right-Pointing-Pointer Five compositions studied through non-isothermal differential scanning calorimetry. Black-Right-Pointing-Pointer Effect of minor boron addition and role of Ti particle size is noted. Black-Right-Pointing-Pointer Activation energies using JMA equations are between 169.5 and 192.49 kJ mol{sup -1}.

  16. Use of Moessbauer spectroscopy to study reaction products of polyphenols and iron compounds

    Energy Technology Data Exchange (ETDEWEB)

    Gust, J. (Building Research Inst., Warsaw (Poland)); Suwalski, J. (Atomic Energy Inst., Otwock-Swierk (Poland))

    1994-05-01

    Moessbauer spectroscopy was used to study parameters of the reaction products of iron compounds (Fe[sup III]) and polyphenols with hydroxyl (OH) groups in ortho positions. Polyphenols used in the reaction were catechol, pyrogallol, gallic acid, and oak tannin. The Fe-containing compounds were hydrated ferric sulfate (Fe[sub 2][SO[sub 4

  17. Suicide Survivors' Mental Health and Grief Reactions: A Systematic Review of Controlled Studies

    Science.gov (United States)

    Sveen, Carl-Aksel; Walby, Fredrik A.

    2008-01-01

    There has been a debate over several decades whether suicide survivors experience more severe mental health consequences and grief reactions than those who have been bereaved through other causes of death. This is the first systematic review of suicide survivors' reactions compared with survivors after other modes of death. Studies were identified…

  18. Polymerase chain reaction-mediated DNA fingerprinting for epidemiological studies on Campylobacter spp

    NARCIS (Netherlands)

    Giesendorf, B A; Goossens, H; Niesters, H G; Van Belkum, A; Koeken, A; Endtz, H P; Stegeman, H; Quint, W G

    1994-01-01

    The applicability of polymerase chain reaction (PCR)-mediated DNA typing, with primers complementary to dispersed repetitive DNA sequences and arbitrarily chosen DNA motifs, to study the epidemiology of campylobacter infection was evaluated. With a single PCR reaction and simple gel electrophoresis,

  19. Polymerase chain reaction-mediated DNA fingerprinting for epidemiological studies on Campylobacter spp

    NARCIS (Netherlands)

    Giesendorf, B A; Goossens, H; Niesters, H G; Van Belkum, A; Koeken, A; Endtz, H P; Stegeman, H; Quint, W G

    The applicability of polymerase chain reaction (PCR)-mediated DNA typing, with primers complementary to dispersed repetitive DNA sequences and arbitrarily chosen DNA motifs, to study the epidemiology of campylobacter infection was evaluated. With a single PCR reaction and simple gel electrophoresis,

  20. ADVERSE REACTIONS ATTRIBUTED TO SUMATRIPTAN - A POSTMARKETING STUDY IN GENERAL-PRACTICE

    NARCIS (Netherlands)

    OTTERVANGER, JP; VANWITSEN, TB; VALKENBURG, HA; GROBBEE, DE; STRICKER, BHC

    1994-01-01

    There are several reports on cardiac adverse reactions attributed to the antimigraine drug sumatriptan in the recent literature. In order to assess the frequency and the character of adverse reactions to sumatriptan, a postmarketing cohort study was performed one year after registration of the drug

  1. A novel reverse flow reactor coupling endothermic and exothermic reactions: an experimental study

    NARCIS (Netherlands)

    van Sint Annaland, M.; Nijssen, R.C.

    2002-01-01

    A new reactor concept is studied for highly endothermic heterogeneously catalysed gas phase reactions at high temperatures with rapid but reversible catalyst deactivation. The reactor concept aims to achieve an indirect coupling of energy necessary for endothermic reactions and energy released by

  2. Loop quantum cosmology: Recent progress

    Indian Academy of Sciences (India)

    Martin Bojowald

    2004-10-01

    Aspects of the full theory of loop quantum gravity can be studied in a simpler context by reducing to symmetric models like cosmological ones. This leads to several applications where loop effects play a significant role when one is sensitive to the quantum regime. As a consequence, the structure of and the approach to classical singularities are very different from general relativity. The quantum theory is free of singularities, and there are new phenomenological scenarios for the evolution of the very early universe such as inflation. We give an overview of the main effects, focussing on recent results obtained by different groups.

  3. Studies on alpha-induced astrophysical reactions using the low-energy RI beam separator CRIB

    Directory of Open Access Journals (Sweden)

    Yamaguchi H.

    2014-03-01

    Full Text Available Several alpha-induced astrophysical reactions have been studied at CRIB (CNS Radioactive Ion Beam separator, which is a low-energy RI beam separator at Center for Nuclear Study (CNS of the University of Tokyo. Two major methods to study them are the α resonant scattering, and direct measurements of (α,p reactions using an active or inactive helium gas target. Among the recent studies at CRIB, the measurement of 7Be+α resonant scattering is discussed.

  4. All-atomic molecular dynamic studies of human CDK8: insight into the A-loop, point mutations and binding with its partner CycC.

    Science.gov (United States)

    Xu, Wu; Amire-Brahimi, Benjamin; Xie, Xiao-Jun; Huang, Liying; Ji, Jun-Yuan

    2014-08-01

    The Mediator, a conserved multisubunit protein complex in eukaryotic organisms, regulates gene expression by bridging sequence-specific DNA-binding transcription factors to the general RNA polymerase II machinery. In yeast, Mediator complex is organized in three core modules (head, middle and tail) and a separable 'CDK8 submodule' consisting of four subunits including Cyclin-dependent kinase CDK8 (CDK8), Cyclin C (CycC), MED12, and MED13. The 3-D structure of human CDK8-CycC complex has been recently experimentally determined. To take advantage of this structure and the improved theoretical calculation methods, we have performed molecular dynamic simulations to study dynamics of CDK8 and two CDK8 point mutations (D173A and D189N), which have been identified in human cancers, with and without full length of the A-loop, as well as the binding between CDK8 and CycC. We found that CDK8 structure gradually loses two helical structures during the 50-ns molecular dynamic simulation, likely due to the presence of the full-length A-loop. In addition, our studies showed the hydrogen bond occupation of the CDK8 A-loop increases during the first 20-ns MD simulation and stays stable during the later 30-ns MD simulation. Four residues in the A-loop of CDK8 have high hydrogen bond occupation, while the rest residues have low or no hydrogen bond occupation. The hydrogen bond dynamic study of the A-loop residues exhibits three types of changes: increasing, decreasing, and stable. Furthermore, the 3-D structures of CDK8 point mutations D173A, D189N, T196A and T196D have been built by molecular modeling and further investigated by 50-ns molecular dynamic simulations. D173A has the highest average potential energy, while T196D has the lowest average potential energy, indicating that T196D is the most stable structure. Finally, we calculated theoretical binding energy of CDK8 and CycC by MM/PBSA and MM/GBSA methods, and the negative values obtained from both methods demonstrate

  5. A comparative study of simple auditory reaction time in blind (congenitally and sighted subjects

    Directory of Open Access Journals (Sweden)

    Pritesh Hariprasad Gandhi

    2013-01-01

    Full Text Available Background: Reaction time is the time interval between the application of a stimulus and the appearance of appropriate voluntary response by a subject. It involves stimulus processing, decision making, and response programming. Reaction time study has been popular due to their implication in sports physiology. Reaction time has been widely studied as its practical implications may be of great consequence e.g., a slower than normal reaction time while driving can have grave results. Objective: To study simple auditory reaction time in congenitally blind subjects and in age sex matched sighted subjects. To compare the simple auditory reaction time between congenitally blind subjects and healthy control subjects. Materials and Methods: Study had been carried out in two groups: The 1 st of 50 congenitally blind subjects and 2 nd group comprises of 50 healthy controls. It was carried out on Multiple Choice Reaction Time Apparatus, Inco Ambala Ltd. (Accuracy΁0.001 s in a sitting position at Government Medical College and Hospital, Bhavnagar and at a Blind School, PNR campus, Bhavnagar, Gujarat, India. Observations / Results: Simple auditory reaction time response with four different type of sound (horn, bell, ring, and whistle was recorded in both groups. According to our study, there is no significant different in reaction time between congenital blind and normal healthy persons. Conclusion: Blind individuals commonly utilize tactual and auditory cues for information and orientation and they reliance on touch and audition, together with more practice in using these modalities to guide behavior, is often reflected in better performance of blind relative to sighted participants in tactile or auditory discrimination tasks, but there is not any difference in reaction time between congenitally blind and sighted people.

  6. Experimental study of a water thermo-capillary loop; Etude experimentale d`une boucle thermocapillaire a eau

    Energy Technology Data Exchange (ETDEWEB)

    Lefriec, C.; Alexandre, A. [Ecole Nationale Superieure de Mecanique et d`Aerotechnique (ENSMA), 86 - Poitiers (France)

    1996-12-31

    This paper presents a bench scale experiment of a water thermo-capillary loop which allows to improve the understanding of its functioning mechanisms thanks to the internal visualisation of each component using transparent walls. The advantages of water are its non-toxicity, its high chemical compatibility with several materials and its low functioning pressure. The experimental device is presented and the functioning regimes of each component is analyzed: condenser (flow visualization, influence of tilt), evaporator (quality of heat exchange between teeth and porous medium, bubbles, heat exchange coefficient). (J.S.)

  7. A Simplified Semiquantitative Meal Bolus Strategy Combined with Single- and Dual-Hormone Closed-Loop Delivery in Patients with Type 1 Diabetes: A Pilot Study.

    Science.gov (United States)

    Gingras, Véronique; Haidar, Ahmad; Messier, Virginie; Legault, Laurent; Ladouceur, Martin; Rabasa-Lhoret, Rémi

    2016-08-01

    Single- and dual-hormone closed-loop systems can improve glycemic control and have the potential to reduce carbohydrate-counting burden for patients with type 1 diabetes; however, simplification of meal insulin calculation should not compromise glycemic control. We compared in a randomized outpatient pilot trial: (1) a single-hormone closed-loop system accompanied with carbohydrate-content matched boluses versus accompanied with a simplified meal bolus strategy, and (2) a dual-hormone closed-loop system accompanied with carbohydrate-content matched boluses versus accompanied with a simplified meal bolus strategy. Carbohydrate-matched boluses were based on the participant's carbohydrate meal content estimation whereas the simplified strategy involved the selection, by participants, of a semi-quantitative meal carbohydrate-content size: snack, regular, large, or very large meal. Each participant also underwent sensor-augmented pump therapy. Basal insulin delivery was more aggressive with the simplified bolus. The primary outcome was mean sensor glucose level over a 15-h daytime period. Twelve participants were recruited (48.2 ± 16.0 years old; HbA1c 7.4% ± 0.9%) to compare the two bolus strategies during single- and dual-hormone closed-loop delivery. A similar mean sensor glucose level (15 h) was achieved with the carbohydrate-matched boluses and simplified strategy using single-hormone (median [interquartile]: 7.6 [7.2-8.1] vs. 8.0 [7.0-8.6] mmol/L; P = 0.90) and dual-hormone closed-loop systems (7.6 [6.7-9.1] vs. 7.0 [6.4-8.2] mmol/L; P = 0.08). Exploratory analyses showed that, as compared with sensor-augmented pump therapy, there was an increased time spent in hypoglycemia with the simplified strategy but not with the carbohydrate-matched boluses. Though the algorithm employed in this pilot study may lead to an increased risk for hypoglycemia, this strategy has the potential to reduce the carbohydrate-counting burden in patients with type

  8. Spectrophotometric and Thermal Studies of the Reaction of Iodine ...

    African Journals Online (AJOL)

    charge-transfer complex reported in this study is further supported by thermal and mid-infrared measurements. ... been studied by several authors.1–7 However, electron donors like cyclic ... One interesting aspect of the chemistry of metal acetylacetonates ... spectra,16 relative permittivities17 and refractive index measure-.

  9. Study of the structure of unstable nuclei through the reaction experiments

    Institute of Scientific and Technical Information of China (English)

    2011-01-01

    Along with the development of the radioactive nuclear beam facility, the study of the structure of unstable nuclei has progressed rapidly over the last few decades. Due to the weakly binding property, the structure information of the unstable nuclei comes primarily from the scattering or reaction experiments. Therefore it would be very important to understand clearly the reaction mechanism involved in the experiment. We outlined here the major reaction mechanisms which are adequate to the study of unstable nuclei, with the focus on the new phenomena and methods in comparison with those with traditional stable nucleus beam. Especially emphasized are the breakup and knockout reactions, developed as accurate tools for spectroscopy investigation into the nuclear structure with low intensity secondary beam. Couplings of the breakup channel to the elastic scattering and the fusion and transfer reactions are also reviewed.

  10. Fundamental studies of retrograde reactions in direct liquefaction. Final report, September 20, 1988--November 20, 1990

    Energy Technology Data Exchange (ETDEWEB)

    Serio, M.A.; Solomon, P.R.; Kroo, E.; Charpenay, S.; Bassilakis, R.

    1991-12-17

    The overall objective of the program was to improve the understanding of retrograde reactions and their dependencies on coal rank and structure, and/or coal modifications and reaction conditions. Because retrograde reactions are competitive with bond breaking reactions, an understanding of both is required to shift the competition in favor of the latter. Related objectives were to clarify the conflicting observations reported in literature on such major topics as the role of oxygen groups in retrograde reactions and to provide a bridge from very fundamental studies on pure compounds to phenomenological studies on actual coal. This information was integrated into the FG-DVC model, which was improved and extended to the liquefaction context.

  11. Mechanism for the gas-phase reaction between OH and 3-methylfuran: A theoretical study

    Science.gov (United States)

    Zhang, Weichao; Du, Benni; Mu, Lailong; Feng, Changjun

    The mechanism for the OH + 3-methylfuran reaction has been studied via ab initio calculations to investigate various reaction pathways on the doublet potential energy surface. Optimizations of the reactants, products, intermediates, and transition structures are conducted using the MP2 level of theory with the 6-311G(d,p) basis set. The single-point electronic energy of each optimized geometry is refined with G3MP2 and G3MP2B3 calculations. The theoretical study suggests that the OH + 3-methylfuran reaction is dominated by the formation of HC(O)CH dbond C(CH3)CHOH (P7) and CH(OH)CH dbond C(CH3)C(O)H (P9), formed from two low-lying adducts, IM1 and IM2. The direct hydrogen abstraction pathways and the SN2 reaction may play a minor or negligible role in the overall reaction of OH with 3-methylfuran.

  12. Continued Statin Prescriptions After Adverse Reactions and Patient Outcomes: A Cohort Study.

    Science.gov (United States)

    Zhang, Huabing; Plutzky, Jorge; Shubina, Maria; Turchin, Alexander

    2017-08-15

    Many patients discontinue statin treatment, often after having a possible adverse reaction. The risks and benefits of continued statin therapy after an adverse reaction are not known. To examine the relationship between continuation of statin therapy (any prescription within 12 months after an adverse reaction) and clinical outcomes. Retrospective cohort study. Primary care practices affiliated with 2 academic medical centers. Patients with a presumed adverse reaction to a statin between 2000 and 2011. Information on adverse reactions to statins was obtained from structured electronic medical record data or natural-language processing of narrative provider notes. The primary composite outcome was time to a cardiovascular event (myocardial infarction or stroke) or death. Most (81%) of the adverse reactions to statins were identified from the text of electronic provider notes. Among 28 266 study patients, 19 989 (70.7%) continued receiving statin prescriptions after the adverse reaction. Four years after the presumed adverse event, the cumulative incidence of the composite primary outcome was 12.2% for patients with continued statin prescriptions, compared with 13.9% for those without them (difference, 1.7% [95% CI, 0.8% to 2.7%]; P statin was prescribed after the adverse reaction, 2014 (26.5%) had a documented adverse reaction to the second statin, but 1696 (84.2%) of those patients continued receiving statin prescriptions. The risk for recurrent adverse reactions to statins could not be established for the entire sample. It was also not possible to determine whether patients actually took the statins. Continued statin prescriptions after an adverse reaction were associated with a lower incidence of death and cardiovascular events. Chinese National Key Program of Clinical Science, National Natural Science Foundation of China, and Young Scientific Research Fund of Peking Union Medical College Hospital.

  13. What Controls DNA Looping?

    Directory of Open Access Journals (Sweden)

    Pamela J. Perez

    2014-08-01

    Full Text Available The looping of DNA provides a means of communication between sequentially distant genomic sites that operate in tandem to express, copy, and repair the information encoded in the DNA base sequence. The short loops implicated in the expression of bacterial genes suggest that molecular factors other than the naturally stiff double helix are involved in bringing the interacting sites into close spatial proximity. New computational techniques that take direct account of the three-dimensional structures and fluctuations of protein and DNA allow us to examine the likely means of enhancing such communication. Here, we describe the application of these approaches to the looping of a 92 base-pair DNA segment between the headpieces of the tetrameric Escherichia coli Lac repressor protein. The distortions of the double helix induced by a second protein—the nonspecific nucleoid protein HU—increase the computed likelihood of looping by several orders of magnitude over that of DNA alone. Large-scale deformations of the repressor, sequence-dependent features in the DNA loop, and deformability of the DNA operators also enhance looping, although to lesser degrees. The correspondence between the predicted looping propensities and the ease of looping derived from gene-expression and single-molecule measurements lends credence to the derived structural picture.

  14. Studying chemical reactions in biological systems with MBN Explorer

    DEFF Research Database (Denmark)

    Sushko, Gennady B.; Solov'yov, Ilia A.; Verkhovtsev, Alexey V.

    2016-01-01

    The concept of molecular mechanics force field has been widely accepted nowadays for studying various processes in biomolecular systems. In this paper, we suggest a modification for the standard CHARMM force field that permits simulations of systems with dynamically changing molecular topologies....... for studying processes where rupture of chemical bonds plays an essential role, e.g., in irradiation- or collision-induced damage, and also in transformation and fragmentation processes involving biomolecular systems....

  15. Testing loop quantum cosmology

    Science.gov (United States)

    Wilson-Ewing, Edward

    2017-03-01

    Loop quantum cosmology predicts that quantum gravity effects resolve the big-bang singularity and replace it by a cosmic bounce. Furthermore, loop quantum cosmology can also modify the form of primordial cosmological perturbations, for example by reducing power at large scales in inflationary models or by suppressing the tensor-to-scalar ratio in the matter bounce scenario; these two effects are potential observational tests for loop quantum cosmology. In this article, I review these predictions and others, and also briefly discuss three open problems in loop quantum cosmology: its relation to loop quantum gravity, the trans-Planckian problem, and a possible transition from a Lorentzian to a Euclidean space-time around the bounce point.

  16. Geometric Structures on Loop and Path Spaces

    Indian Academy of Sciences (India)

    Vicente Muñoz; Francisco Presas

    2010-09-01

    The loop space associated to a Riemannian manifold admits a quasi-symplectic structure (that is, a closed 2-form which is non-degenerate up to a finite-dimensional kernel). We show how to construct a compatible almost-complex structure. Finally conditions to have contact structures on loop spaces are studied.

  17. Study of {sup 19}C by breakup reactions; Etude du {sup 19}C par reactions de cassure

    Energy Technology Data Exchange (ETDEWEB)

    Liegard, Emmanuel [Lab. de Physique Corpusculaire, Caen Univ., 14 Caen (France)

    1998-01-07

    To date studies of halo nuclei have been principally focussed on the A 11 systems {sup 11}Li and {sup 11}Be. The evolution of the properties of the halo with the mass of the system and the binding energy and angular momentum of the halo nucleons is a question of fundamental importance. It was in this spirit that the present study of {sup 19}C (S{sub n} = 240 {+-} 100 keV) was undertaken. The experiment was performed at GANIL using a secondary {sup 19}C beam ({approx_equal} 15 pps at 36 MeV/nucleon) produced via fragmentation. The experimental setup which included the neutron array DEMON, provided for identification of the core-breakup and dissociation reaction channels. In the first case, a very narrow single neutron angular distribution (FWHM = 64 {+-} 17 MeV/c) was observed for {sup 19}C, in contrast to that found for three `reference` nuclei {sup 21}N, {sup 22}O and {sup 24}F (FWHM {approx_equal} 165 MeV/c). This result could be interpreted within the framework of the core-breakup reaction model of a one-neutron halo nucleus. The results obtained for dissociation, while supporting the existence of the halo, indicated that it is not well developed. In addition, a comparison between the present results, the parallel momentum distributions for the core ({sup 18}C) and theoretical predictions have allowed conclusions to be drawn regarding the configuration of the valence neutron. In particular, a purely 2s{sub 1/2} of 1d{sub 5/2} configuration is excluded and mixing, possible with core excited states, must be considered. A probable ground state spin-parity assignment of 3{sup +}/2 or 5{sup +}/2 is suggested. (author) 150 refs., 278 figs., 28 tabs.

  18. Study of all reaction channels in deuteron-deuteron scattering

    NARCIS (Netherlands)

    Ramazani-Moghaddam-Arani, A.; Amir-Ahmadi, H. R.; Bacher, A. D.; Bailey, C. D.; Biegun, A.; Eslami-Kalantari, M.; Gasparic, I.; Joulaeizadeh, L.; Kalantar-Nayestanaki, N.; Kistryn, St.; Kozela, A.; Mardanpour, H.; Messchendorp, J. G.; Micherdzinska, A. M.; Moeini, H.; Shende, S. V.; Stephan, E.; Stephenson, E. J.; Sworst, R.

    2009-01-01

    Few-nucleon systems can be used as fundamental laboratories for studying details of the nuclear force effect. We performed a series of deuteron-deuteron scattering experiments at intermediate energies. The experiments exploited BINA and BBS experimental setups and polarized deuteron beams with kinet

  19. Electric fields acting as catalysts in chemical reactions. An ab initio study of the walden inversion reaction

    Science.gov (United States)

    Andrés, J. L.; Lledós, A.; Duran, M.; Bertrán, J.

    1988-12-01

    Ab initio SCF calculations have been carried out on the fluoride exchange reaction F -+CH 3F→FCH 3+F -. An external uniform electric field along the FCF axis has been incorporated by proper changes in the one-electron part of the Fock matrix. The reaction profile has been found to be dramatically modified with increase in strength of the applied field. The electric field is found to be essential to describe the potential energy hypersurface so that it intervenes in the reaction coordinate. It is concluded that strong electric fields open a new way to catalyze reactions.

  20. A quantum chemical study on hydrogen radical reactions with methane and silane

    Science.gov (United States)

    Sato, Kota; Kojima, Kuniharu; Kawasaki, Masashi; Matsuzaki, Yoshio; Hirano, Tsuneo; Nakano, Masatake; Koinuma, Hideomi

    1989-03-01

    A quantum chemical study on the reaction of CH4 , CF4 , SiH4 , and SiF4 with a hydrogen radical is performed on the basis of an ab initio molecular orbital calculation to predict the photochemical reactivity of methane, silane, and their analogues. The transition state geometry of the reactions is determined by employing a 3-21G basis set. The total energies of reactant molecules at the initial, transition, and final states are calculated by employing a 6-31G** basis set. The exponential parts of the rate constants of these reactions determined from these energies on the basis of the transition state theory are in good agreement with the experimentally obtained relative rates of the reaction. The present calculation was consistent with the experimental results of photochemical reactions for methane and silane derivatives.

  1. Quantum Dynamics Study on D+OD+ Reaction: Competition between Exchange and Abstraction Channels

    Institute of Scientific and Technical Information of China (English)

    Wen-wu Xu; Pei-yu Zhang; Guo-zhong He

    2013-01-01

    Quantum dynamics for the D+OD+ reaction at the collision energy range of 0.0-1.0 eV was studied on an accurate ab initio potential energy surface.Both of the endothermic abstraction (D+OD+-O++D2) and thermoneutral exchange (D+OD+-D+OD+) channels were investigated from the same set of time-dependent quantum wave packets method under centrifugal sudden approximation.The reaction probability dependence with collision energy,the integral cross sections,and the thermal rate constant of the both channels are calculated.It is found that there is a convex structure in the reaction path of the exchange reaction.The calculated time evolution of the wave packet distribution at J=0 clearly indicates that the convex structure significantly influences the dynamics of the exchange and abstraction channels of title reaction.

  2. Study of angular momentum hindrance in heavy ion fusion reactions

    Directory of Open Access Journals (Sweden)

    Kumar Ajay

    2015-01-01

    Full Text Available The systematic study of the properties of hot nuclei by detecting the emitted charged particles and neutrons in coincidence with residual nuclei provides very critical information about its nuclear level density. These emitted particles capable to explain the behavior of the nucleus at various stages of the de-excitation cascade process. So, we have studied, a set of four compound nuclei, which were populated by mass-symmetric and mass-asymmetric channels, leading to the same compound nuclei, namely 80Sr*, 79Se*, 76Kr* and 58Ni*at same excitation energies, respectively and found that the experimental neutron and charged particle spectra for symmetric channel show deviations at higher energies in comparison to the statistical model calculations.

  3. Time-resolved FTIR emission studies of laser photofragmentation and radical reactions

    Energy Technology Data Exchange (ETDEWEB)

    Leone, S.R. [Univ. of Colorado, Boulder (United States)

    1993-12-01

    Recent studies have focused specifically on collision processes, such as single collision energy transfer, reaction dynamics, and radical reactions. The authors employ novel FTIR techniques in the study of single collision energy transfer processes using translationally fast H atom, as well as radical-radical reactions, e.g. CH{sub 3} + O, CF{sub 3} + H(D), and Cl + C{sub 2}H{sub 5}. The fast atoms permit unique high energy regions of certain transition states of combustion species to be probed for the first time.

  4. A family-based intervention targeting parents of preschool children with overweight and obesity: conceptual framework and study design of LOOPS- Lund overweight and obesity preschool study

    Directory of Open Access Journals (Sweden)

    Önnerfält Jenny

    2012-10-01

    Full Text Available Abstract Background As the rate of overweight among children is rising there is a need for evidence-based research that will clarify what the best interventional strategies to normalize weight development are. The overall aim of the Lund Overweight and Obesity Preschool Study (LOOPS is to evaluate if a family-based intervention, targeting parents of preschool children with overweight and obesity, has a long-term positive effect on weight development of the children. The hypothesis is that preschool children with overweight and obesity, whose parents participate in a one-year intervention, both at completion of the one-year intervention and at long term follow up (2-, 3- and 5-years will have reduced their BMI-for-age z-score. Methods/Design The study is a randomized controlled trial, including overweight (n=160 and obese (n=80 children 4-6-years-old. The intervention is targeting the parents, who get general information about nutrition and exercise recommendations through a website and are invited to participate in a group intervention with the purpose of supporting them to accomplish preferred lifestyle changes, both in the short and long term. To evaluate the effect of various supports, the parents are randomized to different interventions with the main focus of: 1 supporting the parents in limit setting by emphasizing the importance of positive interactions between parents and children and 2 influencing the patterns of daily activities to induce alterations of everyday life that will lead to healthier lifestyle. The primary outcome variable, child BMI-for-age z-score will be measured at referral, inclusion, after 6 months, at the end of intervention and at 2-, 3- and 5-years post intervention. Secondary outcome variables, measured at inclusion and at the end of intervention, are child activity pattern, eating habits and biochemical markers as well as parent BMI, exercise habits, perception of health, experience of parenthood and level of

  5. AIM Study on the Reaction of CH2SH Radical with Fluorine Atom

    Institute of Scientific and Technical Information of China (English)

    Cui-hong Sun; Yan-li Zeng; Ling-peng Meng; Shi-jun Zheng

    2008-01-01

    The reaction of CH2SH radical with fluorine atom was studied at the levels of B3LYP/6-311G(d,p) and MP2(Full)/6-311G(d,p).The computational results show that the reaction has three channels and proceeds by the addition of fluorine atoms on carbon or sulfur sites of CH2SH,forming initial intermediates.The calculated results show that the channel,in which fluorine attaches to the carbon atom to form CH2S and HF,is the most likely reaction pathway.Topological analysis of electron density was carried out for the three channels.The change trends of the chemical bonds on the reaction paths were discussed.The energy transition states and the structure transition regions (states) of the three channels were found.The calculated results show that the structure transition regions axe broad in unobvions exothermic reactions or unobvions endothermic reactions,and are narrow in obvious exothermic reactions or obvious endothermic reactions.

  6. Organometallic Reactions Development, Mechanistic Studies and Synthetic Applications

    DEFF Research Database (Denmark)

    Dam, Johan Hygum

    a mechanistic study of the Barbier allylation of benzaldehydes with six different metals (Zn, In, Sb, Sn, Bi and Mg) in aqueous media. The mechanism of the allylation was investigated by means of Hammett plots and the secondary deuterium kinetic isotope effect. It was found that all metals except magnesium form...... a discrete allylmetal species and the rate-determining step is the polar addition to the carbonyl. For magnesium data indicates that the selectivity-determining step is generation of the radical anion of the benzaldehyde. The second project discusses a concise and enantiopure total synthesis...

  7. Ejection of Coulomb Crystals from a Linear Paul Ion Trap for Ion-Molecule Reaction Studies.

    Science.gov (United States)

    Meyer, K A E; Pollum, L L; Petralia, L S; Tauschinsky, A; Rennick, C J; Softley, T P; Heazlewood, B R

    2015-12-17

    Coulomb crystals are being increasingly employed as a highly localized source of cold ions for the study of ion-molecule chemical reactions. To extend the scope of reactions that can be studied in Coulomb crystals-from simple reactions involving laser-cooled atomic ions, to more complex systems where molecular reactants give rise to multiple product channels-sensitive product detection methodologies are required. The use of a digital ion trap (DIT) and a new damped cosine trap (DCT) are described, which facilitate the ejection of Coulomb-crystallized ions onto an external detector for the recording of time-of-flight (TOF) mass spectra. This enables the examination of reaction dynamics and kinetics between Coulomb-crystallized ions and neutral molecules: ionic products are typically cotrapped, thus ejecting the crystal onto an external detector reveals the masses, identities, and quantities of all ionic species at a selected point in the reaction. Two reaction systems are examined: the reaction of Ca(+) with deuterated isotopologues of water, and the charge exchange between cotrapped Xe(+) with deuterated isotopologues of ammonia. These reactions are examples of two distinct types of experiment, the first involving direct reaction of the laser-cooled ions, and the second involving reaction of sympathetically-cooled heavy ions to form a mixture of light product ions. Extensive simulations are conducted to interpret experimental results and calculate optimal operating parameters, facilitating a comparison between the DIT and DCT approaches. The simulations also demonstrate a correlation between crystal shape and image shape on the detector, suggesting a possible means for determining crystal geometry for nonfluorescing ions.

  8. Anti-snake venom: use and adverse reaction in a snake bite study clinic in Bangladesh

    Directory of Open Access Journals (Sweden)

    MR Amin

    2008-01-01

    Full Text Available Snakebites can present local or systemic envenomation, while neurotoxicity and respiratory paralysis are the main cause of death. The mainstay of management is anti-snake venom (ASV, which is highly effective, but liable to cause severe adverse reactions including anaphylaxis. The types of adverse reaction to polyvalent anti-snake venom have not been previously studied in Bangladesh. In this prospective observational study carried out between 1999 and 2001, in the Snake Bite Study Clinic of Chittagong Medical College Hospital, 35 neurotoxic-snake-bite patients who had received polyvalent anti-snake venom were included while the ones sensitized to different antitoxins and suffering from atopy were excluded. The common neurotoxic features were ptosis (100%, external ophthalmoplegia (94.2%, dysphagia (77.1%, dysphonia (68.5% and broken neck sign (80%. The percentage of anti-snake venom reaction cases was 88.57%; pyrogenic reaction was 80.64%; and anaphylaxis was 64.51%. The common features of anaphylaxis were urticaria (80%; vomiting and wheezing (40%; and angioedema (10%. The anti-snake venom reaction was treated mainly with adrenaline for anaphylaxis and paracetamol suppository in pyrogenic reactions. The average recovery time was 4.5 hours. Due to the danger of reactions the anti-snake venom should not be withheld from a snakebite victim when indicated and appropriate guidelines should be followed for its administration.

  9. Characterization study and five-cycle tests in a fixed-bed reactor of titania-supported nickel oxide as oxygen carriers for the chemical-looping combustion of methane.

    Science.gov (United States)

    Corbella, Beatriz M; de Diego, Luis F; García-Labiano, Francisco; Adánez, Juan; Palaciost, José M

    2005-08-01

    Recent investigations have shown that in the combustion of carbonaceous compounds CO2 and NOx emissions to the atmosphere can be substantially reduced by using a two stage chemical-looping process. In this process, the reduction stage is undertaken in a first reactor in which the framework oxygen of a reducible inorganic oxide is used, instead of the usual atmospheric oxygen, for the combustion of a carbonaceous compound, for instance, methane. The outlet gas from this reactor is mostly composed of CO2 and steam as reaction products and further separation of these two components can be carried out easily by simple condensation of steam. Then, the oxygen carrier found in a reduced state is transported to a second reactor in which carrier regeneration with air takes place at relatively low temperatures, consequently preventing the formation of thermal NOx. Afterward, the regenerated carrier is carried to the first reactor to reinitiate a new cycle and so on for a number of repetitive cycles, while the carrier is able to withstand the severe chemical and thermal stresses involved in every cycle. In this paper, the performance of titania-supported nickel oxides has been investigated in a fixed-bed reactor as oxygen carriers for chemical-looping combustion of methane. Samples with different nickel oxide contents were prepared by successive incipient wet impregnations, and their performance as oxygen carriers was investigated at 900 degrees C and atmospheric pressure in five-cycle fixed-bed reactor tests using pure methane and pure air for the respective reduction and regeneration stages. The evolution of the outlet gas composition in each stage was followed by gas chromatography, and the involved chemical, structural, and textural changes of the carrier in the reactor bed were studied by using different characterization techniques. From the study, it is deduced that the reactivity of these nickel-based oxygen carriers is in the two involved stages and almost independent

  10. A theoretical study of Favorskii reaction stereochemistry. Lessons in torquoselectivity.

    Science.gov (United States)

    Hamblin, Graham D; Jimenez, Raphael P; Sorensen, Ted S

    2007-10-12

    The mechanisms of the chloroenolate-->cyclopropanone step of the "normal" Favorskii rearrangement have been investigated in detail using high-level ab initio calculations. A series of simple alpha-chloroenolates, based on chloroacetone (6), all monomethyl derivatives (7-9), a dimethyl analogue (10), and 1-acetyl-1-chlorocyclohexane (11) was first used to explore and define the basic features of the mechanism, which include the finding of both an "inversion" and a "retention" transition state and that in most cases these arise from separate ground-state conformations of the chloroenolate. These theoretical studies were then extended to an isomeric pair of chloroenolates 1 and 2, the cis- and trans-2-methyl derivatives of 11, which are the reactive intermediates involved in a well-known experimental study carried out by Stork and Borowitz (S-B). Finally, three alpha-chlorocyclohexanone enolate systems 12-14 were studied, since these intermediates have a more restricted enolate geometry. The "inversion" mechanism has been described as an SN2 process but the present results, while supporting a concerted process, is better described as an oxyallyl structure undergoing concerted ring closure. The "retention" mechanism has been described as SN1-like, but the calculations show that this process is also concerted, although much less so, and again involves oxyallyl-like transition-states. The model systems 6-8, 10, and 11 with a potential plane of symmetry have two enantiomeric transition states for inversion and another two for retention of configuration (at the C-Cl center). With 9 and the S-B models 1 and 2, with no symmetry plane, there are a calculated total of four diastereomeric transition states for cyclopropanone ring closure in each case, two for inversion and two for retention. While the transition-state energies calculated for simple chloroenolates favor the inversion process, the S-B models 1 and 2 have almost equal inversion-retention transition-state energies

  11. Study on Reaction of Tolylene Diisocyanate with Polyolefine Polyols

    Institute of Scientific and Technical Information of China (English)

    Zhang; Fa-Ai

    2001-01-01

    Polyurethane(PU) has been used widely. It is produced by polyisocyanate with polyol. There are many polyisocyanates and polyols. For polyols it is mainly concentrated on polyester and polyether, there is any study on polyolefine polyol. The paper mainly discuss it.By using tolylene diisocyanate(TDI,C6H4CH3(NCO)2) to react with hydroxyterminated polybutadiene(HTPB,HO-[-CH2-CH=CH-CH2-]n-OH,Mn=3805,) and hydroxy-terminated poly(butadiene-co-acrylonitrile)(HTBN, HO-[(-CH2-CH=CHCH2-)x-(-CHCN-CH2)y-]n-OH,Mn=2267), various NCO/OH equivalent ratio NCOterminated polyurethane(PU) prepolymers are synthesized.  ……

  12. Study on Reaction of Tolylene Diisocyanate with Polyolefine Polyols

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    @@ Polyurethane(PU) has been used widely. It is produced by polyisocyanate with polyol. There are many polyisocyanates and polyols. For polyols it is mainly concentrated on polyester and polyether, there is any study on polyolefine polyol. The paper mainly discuss it.By using tolylene diisocyanate(TDI,C6H4CH3(NCO)2) to react with hydroxyterminated polybutadiene(HTPB,HO-[-CH2-CH=CH-CH2-]n-OH,Mn=3805,) and hydroxy-terminated poly(butadiene-co-acrylonitrile)(HTBN, HO-[(-CH2-CH=CHCH2-)x-(-CHCN-CH2)y-]n-OH,Mn=2267), various NCO/OH equivalent ratio NCOterminated polyurethane(PU) prepolymers are synthesized.

  13. Studies on Reaction Mechanism Between Sparfloxacin and Bovine Serum Albumin

    Institute of Scientific and Technical Information of China (English)

    GUO Ming; ZOU Jian-wei; YI Ping-gui; SHANG Zhi-cai; HU Gui-xiang; YU Qing-sen

    2004-01-01

    The binding of sparfloxacin and bovine serum albumin(BSA) in aqueous solution was studied by means of fluorescence and absorbance spectra, and the interactions influenced by Fe3+ and Cu2+ were explored. Based on the Scatchard′s site binding model and fluorescence quenching, practical formulas for a small molecule ligand attaching to a bio-macromolecule are proposed. The binding parameters were measured according to the suggested models, and the binding distance, the transfer efficiency of energy between sparfloxacin and BSA were obtained in view of the Frster theory of non-radiation energy transfer. The effect of sparfloxacin on the conformation of BSA was analyzed by means of synchronous fluorescence spectroscopy.

  14. Reaction mechanism studies of unsaturated molecules using photofragment translational spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Longfellow, C.A. [Univ. of California, Berkeley, CA (United States). Dept. of Chemistry]|[Lawrence Berkeley National Lab., CA (United States). Chemical Sciences Div.

    1996-05-01

    A number of molecules have been studied using the technique of photofragment translational spectroscopy. In Chapter One a brief introduction to the experimental technique is given. In Chapter Two the infrared multiphoton dissociation (IRMPD) of acetic acid is discussed. Carbon dioxide and methane were observed for the first time as products from dissociation under collisionless conditions. Chapter Three relates an IRMPD experiment of hexafluoropropene. The predominant channel produces CFCF{sub 3} or C{sub 2}F{sub 4} and CF{sub 2}, with the heavier species undergoing further dissociation to two CF{sub 2} fragments. In Chapter Four the ultraviolet (UV) dissociation of hexafluoropropene is investigated. Chapter Five explores the IRMPD of octafluoro-1-butene and octafluoro-2-butene.

  15. Experimental studies and computational benchmark on heavy liquid metal natural circulation in a full height-scale test loop for small modular reactors

    Energy Technology Data Exchange (ETDEWEB)

    Shin, Yong-Hoon, E-mail: chaotics@snu.ac.kr [Department of Energy Systems Engineering, Seoul National University, 1 Gwanak-ro, Gwanak-gu, Seoul 08826 (Korea, Republic of); Cho, Jaehyun [Korea Atomic Energy Research Institute, 111 Daedeok-daero, 989 Beon-gil, Yuseong-gu, Daejeon 34057 (Korea, Republic of); Lee, Jueun; Ju, Heejae; Sohn, Sungjune; Kim, Yeji; Noh, Hyunyub; Hwang, Il Soon [Department of Energy Systems Engineering, Seoul National University, 1 Gwanak-ro, Gwanak-gu, Seoul 08826 (Korea, Republic of)

    2017-05-15

    Highlights: • Experimental studies on natural circulation for lead-bismuth eutectic were conducted. • Adiabatic wall boundaries conditions were established by compensating heat loss. • Computational benchmark with a system thermal-hydraulics code was performed. • Numerical simulation and experiment showed good agreement in mass flow rate. • An empirical relation was formulated for mass flow rate with experimental data. - Abstract: In order to test the enhanced safety of small lead-cooled fast reactors, lead-bismuth eutectic (LBE) natural circulation characteristics have been studied. We present results of experiments with LBE non-isothermal natural circulation in a full-height scale test loop, HELIOS (heavy eutectic liquid metal loop for integral test of operability and safety of PEACER), and the validation of a system thermal-hydraulics code. The experimental studies on LBE were conducted under steady state as a function of core power conditions from 9.8 kW to 33.6 kW. Local surface heaters on the main loop were activated and finely tuned by trial-and-error approach to make adiabatic wall boundary conditions. A thermal-hydraulic system code MARS-LBE was validated by using the well-defined benchmark data. It was found that the predictions were mostly in good agreement with the experimental data in terms of mass flow rate and temperature difference that were both within 7%, respectively. With experiment results, an empirical relation predicting mass flow rate at a non-isothermal, adiabatic condition in HELIOS was derived.

  16. Study of resonant reactions with radioactive ion beams

    CERN Document Server

    Galindo-Uribarri, A; Chavez, E; Gomez-Del Campo, J; Gross, C J; Huerta, A; Liang, J F; Ortiz, M E; Padilla, E; Pascual, S; Paul, S D; Shapira, D; Stracener, D W; Varner, R L

    2000-01-01

    A fast and efficient method to study (p,p) and (p,alpha) resonances with radioactive beams in inverse kinematics is described. It is based on the use of thick targets and large area double-sided silicon strip detectors (DSSDs) to detect the recoiling light-charged particles and to determine precisely their scattering angle. The first nuclear physics experiments with the technique have been performed recently at the Holifield Radioactive Ion Beam Facility (HRIBF) at Oak Ridge with stable beams of sup 1 sup 7 O and radioactive beams of sup 1 sup 7 F. The high-quality resonance measurements obtained demonstrate the capabilities of the technique. Pure sup 1 sup 7 F beams from HRIBF were produced by fully stripping the ions and separating the interfering and more abundant sup 1 sup 7 O ions by the beam transport system. The removal of interfering isobars is one of the various common challenges to both accelerator mass spectrometry (AMS) and radioactive ion beam (RIB) production. Experiments done with RIBs will ben...

  17. Systematic study of the pp -> pp omega reaction

    CERN Document Server

    Abdel-Bary, M; Brinkmann, K -Th; Clement, H; Dietrich, J; Doroshkevich, E; Dshemuchadse, S; Ehrhardt, K; Erhardt, A; Eyrich, W; Filippi, A; Freiesleben, H; Fritsch, M; Gast, W; Gillitzer, A; Gottwald, J; Jäger, H; Jakob, B; Jäkel, R; Karsch, L; Kilian, K; Koch, H; Krapp, M; Kreß, J; Kuhlmann, E; Lehmann, A; Marcello, S; Mauro, S; Michel, P; Möller, K; Morsch, H P; Naumann, L; Paul, N; Pizzolotto, C; Plettner, Ch; Reimann, S; Richter, M; Ritman, J; Roderburg, E; Schamlott, A; Schönmeier, P; Schroeder, W; Schulte-Wissermann, M; Sefzick, T; Steinke, M; Sun, G Y; Teufel, A; Ullrich, W; Wagner, G J; Wagner, M; Wenzel, R; Wilms, A; Wintz, P; Wüstner, P; Zupranski, P

    2010-01-01

    A systematic study of the production of omega-mesons in proton-proton-collisions was carried out in a kinematically complete experiment at three excess energies(epsilon= 92, 128, 173MeV). Both protons were detected using the large-acceptance COSY-TOF spectrometer at an external beam line at the Cooler Synchrotron COSY at Forschungszentrum J\\"ulich. The total cross section, angular distributions of both omega-mesons and protons were measured and presented in various reference frames such as the overall CMS, helicity and Jackson frame. In addition, the orientation of the omega-spin and invariant mass spectra were determined. We observe omega-production to take place dominantly in Ss and Sp final states at epsilon = 92, 128 MeV and, additionally, in Sd at epsilon= 173 MeV. No obvious indication of resonant omega-production via N^*-resonances was found, as proton angular distributions are almost isotropic and invariant mass spectra are compatible with phase space distributions. A dominant role of ^3P_1 and ^1S_0 ...

  18. Degradation of polyethylene glycol by Fenton reaction: a comparative study.

    Science.gov (United States)

    Haseneder, R; Fdez-Navamuel, B; Härtel, G

    2007-01-01

    Photochemical advanced oxidation processes (AOPs) utilising different Fenton systems were investigated in laboratory-scale experiments for the degradation of polyethylene glycol (PEG). The results of the study showed that the degradation rate of PEG was strongly accelerated by the homogeneous system, and this proved to be advantageous in comparison to the heterogeneous system. Between Fenton and photo-Fenton heterogeneous systems, the photo-Fenton process reached the highest removal rate of the organic compound, due to the enhanced reduction efficiency of Fe(III) to Fe(II) under UV-irradiation. The oxidation rate in the heterogeneous system was investigated using varying different parameters, such as the pH value, the concentration of hydrogen peroxide and the amount of Fe(OH)3 as the catalyst. For the homogeneous Fenton system the rate of degradation is significantly higher. At the same time of operation the elimination rates can be found to be 30% over the rates of the heterogeneous system. Optimising the typical influence parameters mentioned before, a degradation of about 93% of PEG can be achieved by using the homogeneous Fenton system.

  19. A usability study of patients setting up a cardiac event loop recorder and BlackBerry gateway for remote monitoring at home.

    Science.gov (United States)

    Sparkes, Jane; Valaitis, Ruta; McKibbon, Ann

    2012-01-01

    This article reports on a usability study of remote noninvasive cardiac testing in homes. We studied the Vitaphone 3100BT (Bluetooth®) event loop recorder (Vitaphone GmbH, Mannheim, Germany) and paired BlackBerry® Curve™ 8520 smartphone (Research In Motion, Ltd., Waterloo, ON, Canada). This application requires independent device set-up by patients in their own homes following receipt by mail out of the kit (instructions plus the event loop recorder and smartphone). The case studies of five participants, each with varying experience with technology, were documented as they interacted with the devices. Participants were videotaped following written instructions as they performed a "think aloud" procedure while completing 20 device set-up tasks. Interviews provided insight into how the independent device set-up and processes could be improved. This study concluded that gender, age, and familiarity with technology seemed to influence the participants' abilities to successfully set up these devices and that sending the kit by mail appeared to be an acceptable strategy to provide remote noninvasive cardiac diagnostic services. This study provides a foundation for future research assessing usability of mobile healthcare technology.

  20. The reaction between iodine and organic coatings under severe PWR accident conditions. An experimental parameter study

    Energy Technology Data Exchange (ETDEWEB)

    Hellmann, S.; Funke, F.; Greger, G.U.; Bleier, A.; Morell, W. [Siemens AG, Power Generation Group, Erlangen (Germany)

    1996-12-01

    An extensive experimental parameter study was performed on the deposition and on the resuspension kinetics in the reaction system iodine/organically coated surfaces. Both reactions in the gas phase and in the liquid phase were investigated and kinetic rate constants suitable for modelling were derived. Previous experimental studies on the reaction of iodine with organic coated surfaces were mostly limited to temperatures below 100{sup o}C. Thus, this parameter study aims at filling a gap and providing kinetic data on heterogeneous reactions with organic surfaces in the accident-relevant temperature range of 100-160{sup o}C. Two types of laboratory experiments carried out at Siemens/KWU using coatings representative for German power plants (epoxy-tape paint), namely gas phase tests and liquid phase tests. (author) 6 figs., 6 tabs., 5 refs.

  1. Numerical Study of Plasma-Fluid Behavior and Generation Characteristics of the Closed Loop MHD Electrical Power Generator

    Science.gov (United States)

    Ohno, Jun; Liberati, Alessandro; Murakami, Tomoyuki; Okuno, Yoshihiro

    Time dependent r-z two-dimensional numerical simulations with LES technique have been carried out in order to clarify the plasma fluid behavior and power generation characteristics of the disk MHD generator under the rated operation conditions demonstrated in the closed loop experimental facility at Tokyo Tech. The generator currently installed could suffer from the non-uniform and low electrical conductivity, and the boundary layer separation even under the rated operation conditions. The large amount of generated electric power is consumed in the boundary layer separation region, which reduces a net output power. Reducing the back pressure and improving the inlet plasma conditions surely provide the higher generator performance. The influence of 90 degree bend downstream duct on the generator performance is found to be not marked.

  2. Surface magnetic contribution in zinc ferrite thin films studied by element- and site-specific XMCD hysteresis-loops

    Science.gov (United States)

    Mendoza Zélis, P.; Pasquevich, G. A.; Salcedo Rodríguez, K. L.; Sánchez, F. H.; Rodríguez Torres, C. E.

    2016-12-01

    Element- and site-specific magnetic hysteresis-loops measurements on a zinc ferrite (ZnFe2O4) thin film were performed by X-ray magnetic circular dichroism. Results show that iron in octahedral and tetrahedral sites of spinel structure are coupled antiferromagnetically between them, and when magnetic field is applied the magnetic moment of the ion located at octahedral sites aligns along the field direction. The magnetic measurements reveal a distinctive response of the surface with in-plane anisotropy and an effective anisotropy constant value of 12.6 kJ/m3. This effective anisotropy is due to the combining effects of demagnetizing field and, volume and surface magnetic anisotropies KV =3.1 kJ/m3 and KS =16 μJ/m2.

  3. Study on chaos control of second-order non-autonomous phase-locked loop based on state observer

    Energy Technology Data Exchange (ETDEWEB)

    Zhao Yibo [College of physics and Electronic Information, Anhui Normal University, Wuhu 241000 (China)], E-mail: zhyb26@yahoo.com.cn; Wei Duqu; Luo Xiaoshu [College of Physics and Electronic engineering, Guangxi Normal University, Guilin 541004 (China)

    2009-02-28

    With system parameters falling into a certain area, the second-order non-autonomous phase locked loop (PLL) is experiencing chaotic behavior which is undesirable in system, where it is necessary to estimate the phase of a received signal. In order to control chaos in PLL and drive it to the locked state, dynamical equation for phase error model of PLL is firstly derived. Then, the state values of phase and transient frequency errors were estimated by a state observer. Moreover, by exploiting these state estimations, a non-linear feedback controller is designed. Since the presented controller does not need to change the controlled system structure and not to use any information of system except the system state variables, the designed controller is simple and desirable. Simulation results show that the presented control law is very effective.

  4. Theoretical studies in nuclear reactions and nuclear structure. Progress report

    Energy Technology Data Exchange (ETDEWEB)

    1992-05-01

    Research in the Maryland Nuclear Theory Group focusses on problems in four basic areas of current relevance. Hadrons in nuclear matter; the structure of hadrons; relativistic nuclear physics and heavy ion dynamics and related processes. The section on hadrons in nuclear matter groups together research items which are aimed at exploring ways in which the properties of nucleons and the mesons which play a role in the nuclear force are modified in the nuclear medium. A very interesting result has been the finding that QCD sum rules supply a new insight into the decrease of the nucleon`s mass in the nuclear medium. The quark condensate, which characterizes spontaneous chiral symmetry breaking of the late QCD vacuum, decreases in nuclear matter and this is responsible for the decrease of the nucleon`s mass. The section on the structure of hadrons contains progress reports on our research aimed at understanding the structure of the nucleon. Widely different approaches are being studied, e.g., lattice gauge calculations, QCD sum rules, quark-meson models with confinement and other hedgehog models. A major goal of this type of research is to develop appropriate links between nuclear physics and QCD. The section on relativistic nuclear physics represents our continuing interest in developing an appropriate relativistic framework for nuclear dynamics. A Lorentz-invariant description of the nuclear force suggests a similar decrease of the nucleon`s mass in the nuclear medium as has been found from QCD sum rules. Work in progress extends previous successes in elastic scattering to inelastic scattering of protons by nuclei. The section on heavy ion dynamics and related processes reports on research into the e{sup +}e{sup {minus}} problem and heavy ion dynamics.

  5. Theoretical studies in nuclear reactions and nuclear structure

    Energy Technology Data Exchange (ETDEWEB)

    1992-05-01

    Research in the Maryland Nuclear Theory Group focusses on problems in four basic areas of current relevance. Hadrons in nuclear matter; the structure of hadrons; relativistic nuclear physics and heavy ion dynamics and related processes. The section on hadrons in nuclear matter groups together research items which are aimed at exploring ways in which the properties of nucleons and the mesons which play a role in the nuclear force are modified in the nuclear medium. A very interesting result has been the finding that QCD sum rules supply a new insight into the decrease of the nucleon's mass in the nuclear medium. The quark condensate, which characterizes spontaneous chiral symmetry breaking of the late QCD vacuum, decreases in nuclear matter and this is responsible for the decrease of the nucleon's mass. The section on the structure of hadrons contains progress reports on our research aimed at understanding the structure of the nucleon. Widely different approaches are being studied, e.g., lattice gauge calculations, QCD sum rules, quark-meson models with confinement and other hedgehog models. A major goal of this type of research is to develop appropriate links between nuclear physics and QCD. The section on relativistic nuclear physics represents our continuing interest in developing an appropriate relativistic framework for nuclear dynamics. A Lorentz-invariant description of the nuclear force suggests a similar decrease of the nucleon's mass in the nuclear medium as has been found from QCD sum rules. Work in progress extends previous successes in elastic scattering to inelastic scattering of protons by nuclei. The section on heavy ion dynamics and related processes reports on research into the e{sup +}e{sup {minus}} problem and heavy ion dynamics.

  6. Systematic study of the pp {yields}pp{omega} reaction

    Energy Technology Data Exchange (ETDEWEB)

    Abdel-Bary, M.; Abdel-Samad, S.; Gast, W.; Gillitzer, A.; Jaeger, H.; Kilian, K.; Paul, N.; Ritman, J.; Roderburg, E.; Sefzick, T.; Wintz, P.; Wuestner, P. [Forschungszentrum Juelich, Institut fuer Kernphysik, Juelich (Germany); Brinkmann, K.T.; Dietrich, J.; Dshemuchadse, S.; Freiesleben, H.; Gottwald, J.; Jakob, B.; Jaekel, R.; Karsch, L.; Kuhlmann, E.; Plettner, C.; Reimann, S.; Richter, M.; Schoenmeier, P.; Schulte-Wissermann, M.; Sun, G.Y.; Ullrich, W.; Wenzel, R. [Technische Universitaet Dresden, Institut fuer Kern- und Teilchenphysik, Dresden (Germany); Clement, H.; Doroshkevich, E.; Ehrhardt, K.; Erhardt, A.; Kress, J.; Wagner, G.J. [Universitaet Tuebingen, Physikalisches Institut, Tuebingen (Germany); Eyrich, W.; Fritsch, M.; Krapp, M.; Lehmann, A.; Pizzolotto, C.; Schroeder, W.; Teufel, A.; Wagner, M. [Universitaet Erlangen-Nuernberg, Physikalisches Institut, Erlangen (Germany); Filippi, A.; Marcello, S. [INFN Torino, Torino (Italy); Koch, H.; Mauro, S.; Steinke, M.; Wilms, A. [Ruhr-Universitaet Bochum, Institut fuer Experimentalphysik, Bochum (Germany); Michel, P.; Moller, K.; Naumann, L.; Schamlott, A. [Forschungszentrum Dresden-Rossendorf, Institut fuer Kern- und Hadronenphysik, Dresden (Germany); Morsch, H.P. [Forschungszentrum Juelich, Institut fuer Kernphysik, Juelich (Germany); Soltan Institute for Nuclear Studies, Swierk/Otwock (Poland)

    2010-04-15

    A systematic study of the production of {omega}-mesons in proton-proton collisions was carried out in a kinematically complete experiment at three excess energies ({epsilon}=92, 128, 173 MeV). Both protons were detected using the large-acceptance COSY-TOF spectrometer at an external beam line at the Cooler Synchrotron COSY at Forschungszentrum Juelich. The total cross-section, angular distributions of both {omega}-mesons and protons were measured and presented in various reference frames such as the overall CMS, helicity and Jackson frame. In addition, the orientation of the {omega}-spin and invariant-mass spectra were determined. We observe {omega}-production to take place dominantly in Ss and Sp final states at {epsilon}=92, 128 MeV and, additionally, in Sd at {epsilon}=173 MeV. No obvious indication of resonant {omega}-production via N{sup *}-resonances was found, as proton angular distributions are almost isotropic and invariant-mass spectra are compatible with phase space distributions. A dominant role of {sup 3}P{sub 1} and {sup 1}S{sub 0} initial partial waves for {omega}-production was concluded from the orientation of the decay plane of the {omega}-meson. Although the Jackson angle distributions in the {omega} p-Jackson frame are anisotropic we argue that this is not an indication of a resonance but rather a kinematical effect reflecting the anisotropy of the {omega} angular distribution. The helicity angle distribution in the {omega} p-helicity frame shows an anisotropy which probably reflects effects of the {omega} angular momenta in the final state; this observable may be, in addition to the orientation of the {omega} decay plane, the most sensitive one to judge the validity of theoretical descriptions of the production process. (orig.)

  7. Systematic study of the pp rightarrow pp ω reaction

    Science.gov (United States)

    Abdel-Bary, M.; Abdel-Samad, S.; Brinkmann, K.-Th.; Clement, H.; Dietrich, J.; Doroshkevich, E.; Dshemuchadse, S.; Ehrhardt, K.; Erhardt, A.; Eyrich, W.; Filippi, A.; Freiesleben, H.; Fritsch, M.; Gast, W.; Gillitzer, A.; Gottwald, J.; Jäger, H.; Jakob, B.; Jäkel, R.; Karsch, L.; Kilian, K.; Koch, H.; Krapp, M.; Kreß, J.; Kuhlmann, E.; Lehmann, A.; Marcello, S.; Mauro, S.; Michel, P.; Móller, K.; Morsch, H. P.; Naumann, L.; Paul, N.; Pizzolotto, C.; Plettner, Ch.; Reimann, S.; Richter, M.; Ritman, J.; Roderburg, E.; Schamlott, A.; Schönmeier, P.; Schroeder, W.; Schulte-Wissermann, M.; Sefzick, T.; Steinke, M.; Sun, G. Y.; Teufel, A.; Ullrich, W.; Wagner, G. J.; Wagner, M.; Wenzel, R.; Wilms, A.; Wintz, P.; Wüstner, P.; Zupranski, P.; COSY-TOF Collaboration

    2010-04-01

    A systematic study of the production of ω -mesons in proton-proton collisions was carried out in a kinematically complete experiment at three excess energies ( \\varepsilon = 92, 128, 173 MeV). Both protons were detected using the large-acceptance COSY-TOF spectrometer at an external beam line at the Cooler Synchrotron COSY at Forschungszentrum Jülich. The total cross-section, angular distributions of both ω -mesons and protons were measured and presented in various reference frames such as the overall CMS, helicity and Jackson frame. In addition, the orientation of the ω -spin and invariant-mass spectra were determined. We observe ω -production to take place dominantly in Ss and Sp final states at \\varepsilon = 92, 128 MeV and, additionally, in Sd at \\varepsilon = 173 MeV. No obvious indication of resonant ω -production via N*-resonances was found, as proton angular distributions are almost isotropic and invariant-mass spectra are compatible with phase space distributions. A dominant role of 3 P 1 and 1 S 0 initial partial waves for ω -production was concluded from the orientation of the decay plane of the ω -meson. Although the Jackson angle distributions in the ω p-Jackson frame are anisotropic we argue that this is not an indication of a resonance but rather a kinematical effect reflecting the anisotropy of the ω angular distribution. The helicity angle distribution in the ω p-helicity frame shows an anisotropy which probably reflects effects of the ω angular momenta in the final state; this observable may be, in addition to the orientation of the ω decay plane, the most sensitive one to judge the validity of theoretical descriptions of the production process.

  8. Complement activation in leprosy: a retrospective study shows elevated circulating terminal complement complex in reactional leprosy.

    Science.gov (United States)

    Bahia El Idrissi, N; Hakobyan, S; Ramaglia, V; Geluk, A; Morgan, B Paul; Das, P Kumar; Baas, F

    2016-06-01

    Mycobacterium leprae infection gives rise to the immunologically and histopathologically classified spectrum of leprosy. At present, several tools for the stratification of patients are based on acquired immunity markers. However, the role of innate immunity, particularly the complement system, is largely unexplored. The present retrospective study was undertaken to explore whether the systemic levels of complement activation components and regulators can stratify leprosy patients, particularly in reference to the reactional state of the disease. Serum samples from two cohorts were analysed. The cohort from Bangladesh included multi-bacillary (MB) patients with (n = 12) or without (n = 46) reaction (R) at intake and endemic controls (n = 20). The cohort from Ethiopia included pauci-bacillary (PB) (n = 7) and MB (n = 23) patients without reaction and MB (n = 15) patients with reaction. The results showed that the activation products terminal complement complex (TCC) (P ≤ 0·01), C4d (P ≤ 0·05) and iC3b (P ≤ 0·05) were specifically elevated in Bangladeshi patients with reaction at intake compared to endemic controls. In addition, levels of the regulator clusterin (P ≤ 0·001 without R; P < 0·05 with R) were also elevated in MB patients, irrespective of a reaction. Similar analysis of the Ethiopian cohort confirmed that, irrespective of a reaction, serum TCC levels were increased significantly in patients with reactions compared to patients without reactions (P ≤ 0·05). Our findings suggests that serum TCC levels may prove to be a valuable tool in diagnosing patients at risk of developing reactions. © 2016 British Society for Immunology.

  9. Kinetic studies of the infrared-induced reaction between atomic chlorine and solid parahydrogen

    Science.gov (United States)

    Raston, Paul L.; Kettwich, Sharon C.; Anderson, David T.

    2015-04-01

    We present Fourier-transform infrared (FTIR) spectroscopic studies of the IR-induced Cl + H2(v = 1) → HCl + H reaction in a parahydrogen (pH2) matrix aimed at distinguishing between two proposed reactions mechanisms; direct-IR and vibron-mediated. The Cl atom reactants are produced via 355 nm in situ photolysis of a Cl2 doped pH2 matrix. After photolysis is complete, a long-pass IR filter in the FTIR beam is removed and we measure the ensuing IR-induced reaction kinetics using rapid scan FTIR spectroscopy. We follow both the decay of the Cl atom reactant and growth of the HCl product using the Cl spin-orbit (SO) + Q1(0) and HCl R1(0) transitions, respectively. We show the IR-induced reaction mechanism depends on the spectral profile of the IR radiation; for IR spectral profiles that have significant IR intensities between 4000 and 5000 cm-1 we observe first-order kinetics that are assigned to a vibron-mediated mechanism and for spectral profiles that have significant IR intensities that include the Cl SO + Q1(0) transition near 5094 cm-1 we observe bi-exponential kinetics that are dominated by the direct-IR mechanism at early reaction times. We can distinguish between the two mechanisms using the observed kinetics. We investigate the reaction kinetics for different FTIR optical setups, for a range of sample conditions, and start and stop the IR-induced reaction to investigate the importance of secondary H atom reactions. We also study the IR-induced reaction in Br/Cl co-doped pH2 samples and show the presence of the Br atom quenches the vibron-mediated reaction kinetics presumably because the Br-atoms serve as efficient vibron traps. This paper indicates that in a highly enriched pH2 matrix the H atoms that are produced by the IR-induced Cl atom reaction likely do not play a significant role in the measured reaction kinetics which implies these secondary H atom reactions are highly selective.

  10. Students' Understanding of Loops and Nested Loops in Computer Programming: An APOS Theory Perspective

    Science.gov (United States)

    Cetin, Ibrahim

    2015-01-01

    The purpose of this study is to explore students' understanding of loops and nested loops concepts. Sixty-three mechanical engineering students attending an introductory programming course participated in the study. APOS (Action, Process, Object, Schema) is a constructivist theory developed originally for mathematics education. This study is the…

  11. Structure and Reactions of Carbon and Hydrogen on Ru(0001): A Scanning Tunneling Microscopy Study

    Energy Technology Data Exchange (ETDEWEB)

    Shimizu, Tomoko K.; Mugarza, Aitor; Cerda, Jorge; Salmeron, Miquel

    2008-09-09

    The interaction between carbon and hydrogen atoms on a Ru(0001) surface was studied using scanning tunneling microscopy (STM), Density Functional Theory (DFT) and STM image calculations. Formation of CH species by reaction between adsorbed H and C was observed to occur readily at 100 K. When the coverage of H increased new complexes of the form CH+nH (n = 1, 2 and 3) were observed. These complexes, never observed before, might be precursors for further hydrogenation reactions. DFT analysis reveals that a considerable energy barrier exists for the CH+H {yields} CH{sub 2} reaction.

  12. Ab Initio MO Studies on the Reaction Mechanism for Carbonyl Insertion Catalyzed by Carbonyl Cobalt Complex

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    Ab initio method, under the effective core potential(ECP) approximation at HF/LANL2DZ level, has been employed to study the reaction mechanism of the carbonyl insertion of olefin hydroformylation catalyzed by a carbonyl cobalt HCo(CO)3. The two reaction paths have been discussed. The calculated potential energy barriers for the carbonyl migration and the ethyl group migration are 105.0 kJ/mol and 39.17 kJ/mol, respectively. The results indicate that the reaction path via ethyl migration is more energetically favorable than that via carbonyl insertion.

  13. Study of the reaction $\\gamma p\\to p\\pi^0\\eta$

    CERN Document Server

    Horn, I; Anton, G; Bantes, R; Bartholomy, O; Beck, R; Beloglazov, Y; Bogendorfer, R; Castelijns, R; Cred, V; Ehmanns, A; Ernst, J; Fabry, I; Flemming, H; Fsel, A; Fuchs, M; Funke, C; Gothe, R; Gridnev, A; Gutz, E; Hoffgen, S; Hol, J; Junkersfeld, J; Kalinowsky, H; Klein, F; Klempt, E; Koch, H; Konrad, M; Kopf, B; Krusche, B; Langheinrich, J; Löhner, H; Lopatin, I; Lotz, J; Matthy, H; Menze, D; Messchendorp, J; Metag, V; Nikonov, V A; Novinski, D; Ostrick, M; Van Pee, H; Radkov, A; Sarantsev, A V; Schmidt, C; Schmieden, H; Schoch, B; Suft, G; Sumachev, V; Szczepanek, T; Thoma, U; Walther, D; Weinheimer, C

    2008-01-01

    The reaction $\\gamma p\\to p\\pi^0\\eta$ has been studied with the CBELSA detector at the tagged photon beam of the Bonn electron stretcher facility. The reaction shows contributions from $\\Delta^+(1232)\\eta$, $N(1535)^+\\pi^0$ and $pa_0(980)$ as intermediate states. A partial wave analysis suggests that the reaction proceeds via formation of six $\\Delta$ resonances, $\\Delta(1600)P_{33}$, $\\Delta(1920)P_{33}$, $\\Delta(1700)D_{33}$, $\\Delta(1940)D_{33}$, $\\Delta(1905)F_{35}$, $\\Delta(2360)D_{33}$, and two nucleon resonances $N(1880)P_{11}$ and $N(2200)P_{13}$, for which pole positions and decay branching ratios are given.

  14. Theoretical Study of the Photochemical Reaction Mechanism of Bicyclo[4.1.0]heptane

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    The photochemical reaction of bicyclo[4.1.0]heptane was studied at the complete active space SCF(CASSCF) level with a 6-31G* basis set. A multireference MP2 algorithm that has been implemented in the Gaussian program was used to correct the energetics for the dynamic correlation. Starting from the Franck-Condon excitation of bicyclo [4.1.0] heptane, the reaction is via two bonds' breakage to give rise to 1,6-heptdiene. One internal conversion(IC) and two intersystem crossing points(ISC) were located and are discussed separately. The reaction proceeds to its own characteristic product on the ground state.

  15. Natively unstructured loops differ from other loops.

    Directory of Open Access Journals (Sweden)

    Avner Schlessinger

    2007-07-01

    Full Text Available Natively unstructured or disordered protein regions may increase the functional complexity of an organism; they are particularly abundant in eukaryotes and often evade structure determination. Many computational methods predict unstructured regions by training on outliers in otherwise well-ordered structures. Here, we introduce an approach that uses a neural network in a very different and novel way. We hypothesize that very long contiguous segments with nonregular secondary structure (NORS regions differ significantly from regular, well-structured loops, and that a method detecting such features could predict natively unstructured regions. Training our new method, NORSnet, on predicted information rather than on experimental data yielded three major advantages: it removed the overlap between testing and training, it systematically covered entire proteomes, and it explicitly focused on one particular aspect of unstructured regions with a simple structural interpretation, namely that they are loops. Our hypothesis was correct: well-structured and unstructured loops differ so substantially that NORSnet succeeded in their distinction. Benchmarks on previously used and new experimental data of unstructured regions revealed that NORSnet performed very well. Although it was not the best single prediction method, NORSnet was sufficiently accurate to flag unstructured regions in proteins that were previously not annotated. In one application, NORSnet revealed previously undetected unstructured regions in putative targets for structural genomics and may thereby contribute to increasing structural coverage of large eukaryotic families. NORSnet found unstructured regions more often in domain boundaries than expected at random. In another application, we estimated that 50%-70% of all worm proteins observed to have more than seven protein-protein interaction partners have unstructured regions. The comparative analysis between NORSnet and DISOPRED2 suggested

  16. Natively unstructured loops differ from other loops.

    Science.gov (United States)

    Schlessinger, Avner; Liu, Jinfeng; Rost, Burkhard

    2007-07-01

    Natively unstructured or disordered protein regions may increase the functional complexity of an organism; they are particularly abundant in eukaryotes and often evade structure determination. Many computational methods predict unstructured regions by training on outliers in otherwise well-ordered structures. Here, we introduce an approach that uses a neural network in a very different and novel way. We hypothesize that very long contiguous segments with nonregular secondary structure (NORS regions) differ significantly from regular, well-structured loops, and that a method detecting such features could predict natively unstructured regions. Training our new method, NORSnet, on predicted information rather than on experimental data yielded three major advantages: it removed the overlap between testing and training, it systematically covered entire proteomes, and it explicitly focused on one particular aspect of unstructured regions with a simple structural interpretation, namely that they are loops. Our hypothesis was correct: well-structured and unstructured loops differ so substantially that NORSnet succeeded in their distinction. Benchmarks on previously used and new experimental data of unstructured regions revealed that NORSnet performed very well. Although it was not the best single prediction method, NORSnet was sufficiently accurate to flag unstructured regions in proteins that were previously not annotated. In one application, NORSnet revealed previously undetected unstructured regions in putative targets for structural genomics and may thereby contribute to increasing structural coverage of large eukaryotic families. NORSnet found unstructured regions more often in domain boundaries than expected at random. In another application, we estimated that 50%-70% of all worm proteins observed to have more than seven protein-protein interaction partners have unstructured regions. The comparative analysis between NORSnet and DISOPRED2 suggested that long

  17. Candidate states of Helicobacter pylori's genome-scale metabolic network upon application of "loop law" thermodynamic constraints.

    Science.gov (United States)

    Price, Nathan D; Thiele, Ines; Palsson, Bernhard Ø

    2006-06-01

    Constraint-based modeling has proven to be a useful tool in the analysis of biochemical networks. To date, most studies in this field have focused on the use of linear constraints, resulting from mass balance and capacity constraints, which lead to the definition of convex solution spaces. One additional constraint arising out of thermodynamics is known as the "loop law" for reaction fluxes, which states that the net flux around a closed biochemical loop must be zero because no net thermodynamic driving force exists. The imposition of the loop-law can lead to nonconvex solution spaces making the analysis of the consequences of its imposition challenging. A four-step approach is developed here to apply the loop-law to study metabolic network properties: 1), determine linear equality constraints that are necessary (but not necessarily sufficient) for thermodynamic feasibility; 2), tighten V(max) and V(min) constraints to enclose the remaining nonconvex space; 3), uniformly sample the convex space that encloses the nonconvex space using standard Monte Carlo techniques; and 4), eliminate from the resulting set all solutions that violate the loop-law, leaving a subset of steady-state solutions. This subset of solutions represents a uniform random sample of the space that is defined by the additional imposition of the loop-law. This approach is used to evaluate the effect of imposing the loop-law on predicted candidate states of the genome-scale metabolic network of Helicobacter pylori.

  18. Introduction to Loop Heat Pipes

    Science.gov (United States)

    Ku, Jentung

    2015-01-01

    This is the presentation file for the short course Introduction to Loop Heat Pipes, to be conducted at the 2015 Thermal Fluids and Analysis Workshop, August 3-7, 2015, Silver Spring, Maryland. This course will discuss operating principles and performance characteristics of a loop heat pipe. Topics include: 1) pressure profiles in the loop; 2) loop operating temperature; 3) operating temperature control; 4) loop startup; 4) loop shutdown; 5) loop transient behaviors; 6) sizing of loop components and determination of fluid inventory; 7) analytical modeling; 8) examples of flight applications; and 9) recent LHP developments.

  19. Study of apoptosis in skin lesions of leprosy in relation to treatment and lepra reactions.

    Science.gov (United States)

    Ajith, C; Gupta, Sachin; Radotra, Bishan D; Arora, Sunil K; Kumar, Bhushan; Dogra, Sunil; Kaur, Inderjeet

    2005-12-01

    In leprosy on treatment, one factor contributing to the healing of skin lesions with minimal fibrosis may be apoptosis of inflammatory cells, even though apoptosis is sparse in leprosy as compared to tuberculosis. The degree of apoptosis in skin lesions of leprosy was studied by histopathologic examination (HPE) and by DNA fragmentation and electrophoresis. The effect of various parameters on apoptosis was noted in untreated disease, during treatment at 3 and 6 months, and in lepra reactions in different parts of the spectrum of leprosy. Of the 31 patients, 13 had paucibacillary (PB) and 18 multibacillary (MB) disease. Twenty one patients were in reaction: 16 had type 1 reaction and 5 had type 2 reaction. The controls included patients with non-granulomatous skin diseases; there were no normal controls, and no separate controls for cases with reaction. Apoptosis occurred more frequently in patients with leprosy as compared to the controls. In both PB & MB lesions, apoptosis was observed to increase progressively with treatment at 3 and 6 months, and was more prominent in the MB cases at 6 months of treatment. When lesions in either type 1 or type 2 reaction were compared to lesions not in reaction, a significant increase in apoptosis (p = 0.014) was found only in lesions with type 2 reaction and those which were at 6 months of treatment. The type of treatment regimen, or oral steroids given for reactions, did not significantly alter the degree of apoptosis. Our observations indicate that increased apoptosis is present in leprosy lesions and that in leprosy it progressively increases with anti-leprosy treatment up to 6 months. If the process of apoptosis in skin lesions is followed up for a longer period of time, the degree of apoptosis may be expected to decline. The study of apoptosis may help to understand the mechanism of clearance of bacilli and resolution of granulomas in leprosy patients.

  20. Dynamics and Kinetics Study of "In-Water" Chemical Reactions by Enhanced Sampling of Reactive Trajectories.

    Science.gov (United States)

    Zhang, Jun; Yang, Y Isaac; Yang, Lijiang; Gao, Yi Qin

    2015-11-12

    High potential energy barriers and engagement of solvent coordinates set challenges for in silico studies of chemical reactions, and one is quite commonly limited to study reactions along predefined reaction coordinate(s). A systematic protocol, QM/MM MD simulations using enhanced sampling of reactive trajectories (ESoRT), is established to quantitatively study chemical transitions in complex systems. A number of trajectories for Claisen rearrangement in water and toluene were collected and analyzed, respectively. Evidence was found that the bond making and breaking during this reaction are concerted processes in solutions, preferentially through a chairlike configuration. Water plays an important dynamic role that helps stabilize the transition sate, and the dipole-dipole interaction between water and the solute also lowers the transition barrier. The calculated rate coefficient is consistent with the experimental measurement. Compared with water, the reaction pathway in toluene is "narrower" and the reaction rate is slower by almost three orders of magnitude due to the absence of proper interactions to stabilize the transition state. This study suggests that the "in-water" nature of the Claisen rearrangement in aqueous solution influences its thermodynamics, kinetics, as well as dynamics.

  1. Theoretical study of the P-Ylide reaction in the carbon nanotube

    Institute of Scientific and Technical Information of China (English)

    XIAO Bo; ZHAO JingXiang; DING YiHong; SUN ChiaChung

    2009-01-01

    Recent studies have shown that the inner phase of carbon nanotubes (CNTs) can not only change the properties of molecules inside the tube,but also enhance or restrain the S_N2 reactions.Thus,the CNTs can be considered a form of solid solvent.In this paper,we study the[2+2]cycloaddition reaction between CH_2O and PH_3CH_2 in the gas phase,benzene solution and inner phase of CNT using the density functional theory (DFT).The results indicate that the inner phase of CNT has little effect on the[2+2]cycloaddition reaction.This can be explained as that while taking the linear arrangement for S_N2 reaction,the reactants do not possess the axial symmetry for the studied[2+2]cycloaddition reaction.Therefore,although the CNT has large axial polarizability,it can exert little influence on the[2+2]cycloaddition reaction.Our studies will be helpful for further understanding of the inner phase chemistry of CNTs.

  2. Theoretical study of the P-Ylide reaction in the carbon nanotube

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    Recent studies have shown that the inner phase of carbon nanotubes(CNTs) can not only change the properties of molecules inside the tube,but also enhance or restrain the SN2 reactions.Thus,the CNTs can be considered a form of solid solvent.In this paper,we study the [2+2] cycloaddition reaction between CH2O and PH3CH2 in the gas phase,benzene solution and inner phase of CNT using the density functional theory(DFT).The results indicate that the inner phase of CNT has little effect on the [2+2] cycloaddition reaction.This can be explained as that while taking the linear arrangement for SN2 reaction,the reactants do not possess the axial symmetry for the studied [2+2] cycloaddition reaction.Therefore,although the CNT has large axial polarizability,it can exert little influence on the [2+2] cycloaddition reaction.Our studies will be helpful for further understanding of the inner phase chemistry of CNTs.

  3. Using causal loop diagrams for the initialization of stakeholder engagement in soil salinity management in agricultural watersheds in developing countries: a case study in the Rechna Doab watershed, Pakistan.

    Science.gov (United States)

    Inam, Azhar; Adamowski, Jan; Halbe, Johannes; Prasher, Shiv

    2015-04-01

    Over the course of the last twenty years, participatory modeling has increasingly been advocated as an integral component of integrated, adaptive, and collaborative water resources management. However, issues of high cost, time, and expertise are significant hurdles to the widespread adoption of participatory modeling in many developing countries. In this study, a step-wise method to initialize the involvement of key stakeholders in the development of qualitative system dynamics models (i.e. causal loop diagrams) is presented. The proposed approach is designed to overcome the challenges of low expertise, time and financial resources that have hampered previous participatory modeling efforts in developing countries. The methodological framework was applied in a case study of soil salinity management in the Rechna Doab region of Pakistan, with a focus on the application of qualitative modeling through stakeholder-built causal loop diagrams to address soil salinity problems in the basin. Individual causal loop diagrams were developed by key stakeholder groups, following which an overall group causal loop diagram of the entire system was built based on the individual causal loop diagrams to form a holistic qualitative model of the whole system. The case study demonstrates the usefulness of the proposed approach, based on using causal loop diagrams in initiating stakeholder involvement in the participatory model building process. In addition, the results point to social-economic aspects of soil salinity that have not been considered by other modeling studies to date. Copyright © 2015 Elsevier Ltd. All rights reserved.

  4. Molecular dynamics study of phase separation in fluids with chemical reactions.

    Science.gov (United States)

    Krishnan, Raishma; Puri, Sanjay

    2015-11-01

    We present results from the first d=3 molecular dynamics (MD) study of phase-separating fluid mixtures (AB) with simple chemical reactions (A⇌B). We focus on the case where the rates of forward and backward reactions are equal. The chemical reactions compete with segregation, and the coarsening system settles into a steady-state mesoscale morphology. However, hydrodynamic effects destroy the lamellar morphology which characterizes the diffusive case. This has important consequences for the phase-separating structure, which we study in detail. In particular, the equilibrium length scale (ℓ(eq)) in the steady state suggests a power-law dependence on the reaction rate ε:ℓ(eq)∼ε(-θ) with θ≃1.0.

  5. The reaction of nitromethane with hydrogen and deuterium atoms in the gas phase. A mechanistic study

    DEFF Research Database (Denmark)

    Lund Thomsen, E.; Nielsen, O.J.; Egsgaard, H.

    1993-01-01

    The mechanism of the reaction between H and CH3NO2, has been studied in a discharge flow system using electron paramagnetic resonance and modulated molecular beam mass spectrometry for the detection of reactants and products. Deuterium atoms have, in addition to CD3NO2, been used to support...... the proposed reaction mechanism. The reaction was studied with the atomic reactant in slight excess at 298 K and a total pressure of 2 Torr. Two concurrent reaction channels: (1a) H+CH3NO2-->HONO+.CH3 and (1b) H+CH3NO2-->CH3NO+.OH were observed. The branching ratio, k1a/(k1a+k1b), is 0.7+/-0.2....

  6. A loop quantum multiverse?

    CERN Document Server

    Bojowald, Martin

    2013-01-01

    Inhomogeneous space-times in loop quantum cosmology have come under better control with recent advances in effective methods. Even highly inhomogeneous situations, for which multiverse scenarios provide extreme examples, can now be considered at least qualitatively.

  7. Blind loop syndrome

    Science.gov (United States)

    ... part of the stomach) and operations for extreme obesity As a complication of inflammatory bowel disease Diseases such as diabetes or scleroderma may slow down movement in a segment of the intestine, leading to blind loop syndrome.

  8. Diffusion of Wilson Loops

    CERN Document Server

    Brzoska, A M; Negele, J W; Thies, M

    2004-01-01

    A phenomenological analysis of the distribution of Wilson loops in SU(2) Yang-Mills theory is presented in which Wilson loop distributions are described as the result of a diffusion process on the group manifold. It is shown that, in the absence of forces, diffusion implies Casimir scaling and, conversely, exact Casimir scaling implies free diffusion. Screening processes occur if diffusion takes place in a potential. The crucial distinction between screening of fundamental and adjoint loops is formulated as a symmetry property related to the center symmetry of the underlying gauge theory. The results are expressed in terms of an effective Wilson loop action and compared with various limits of SU(2) Yang-Mills theory.

  9. Pulse radiolysis study on the mechanisms of reactions of CCl3OO· radical with quercetin, rutin and epigallocatechin gallate

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The mechanisms of reactions between CCl3OO· radical and quercetin, rutin and epigallocatechin gallate (EGCG) have been studied using pulse radiolytic technique. It is suggested that the electron transfer reaction is the main reaction between CCl3OO· radical and rutin, EGCG, but there are two main pathways for the reaction of CCl3OO· radical with quercetin, one is the electron transfer reaction, the other is addition reaction. The reaction rate constants were determined. It is proved that quercetin and rutin are better CCl3OO· radical scavengers than EGCG.

  10. Study of catalytic effect of ammonium molybdate on the bisphthalonitrile resins curing reaction with aromatic amine

    Institute of Scientific and Technical Information of China (English)

    Wen Ting Li; Fang Zuo; Kun Jia; Xiao Bo Liu

    2009-01-01

    A kind of catalyst, ammonium molybdate was developed in this paper to promote the curing reaction of bisphthalonitrile resins with aromatic amine as curing agent, and the catalytic effect was studied by differential scanning calorimetry (DSC), rheometric measurements and thermogravimetric analysis (TGA). The results indicated that the catalyst could improve the curing rate and increase the curing degree, which could be regulated by the content of the catalyst used in the reaction.

  11. Study of the Reaction $np \\rightarrow np \\pi^+ \\pi^-$ at Intermediate Energies

    OpenAIRE

    Jerusalimov, A. P.; Troyan, Yu. A.; Troyan, A. Yu.; Belyaev, A. V.; Plekhanov, E. B.

    2011-01-01

    The reaction $np \\rightarrow np \\pi^+ \\pi^-$ was studied at the various momenta of incident neutrons. It was shown that the characteristics of the reaction at the momenta above 3 GeV/c could be described by the model of reggeized $\\pi$ exchange (OPER). At the momenta below 3 GeV/c, it was necessary to use additionally the mechanism of one baryon exchange (OBE).

  12. Basophil activation test in the study of food and drug hypersensitivity reactions

    OpenAIRE

    Carrapatoso, I; Cadinha, S; Sanz, ML

    2005-01-01

    The increase in the prevalence of adverse reactions to foods and drugs represents a constant challenge to the development of new methods of diagnosis. A meta-analysis on published studies concerning the clinical usefulness of the Basophil activation test (BAT) in these reactions was performed. High sensibilities and specificities can be achieved if certain technical requirements are observed. BAT results have a positive and high significant correlations with other routine diagnostic ...

  13. From Loops to Surfaces

    CERN Document Server

    Neuberger, H

    2010-01-01

    The generating function for all antisymmetric characters of a Wilson loop matrix in SU(N) Yang Mills theory is the partition function of a fermion living on the curve describing the loop. This generalizes to fermion subsystems living on higher dimensional submanifolds, for example, surfaces. This write-up also contains some extra background, in response to some questions raised during the oral presentation.

  14. A Pilot Study of Ion - Molecule Reactions at Temperatures Relevant to the Atmosphere of Titan

    Science.gov (United States)

    Zymak, Illia; Žabka, Ján; Polášek, Miroslav; Španěl, Patrik; Smith, David

    2016-11-01

    Reliable theoretical models of the chemical kinetics of the ionosphere of Saturn's moon, Titan, is highly dependent on the precision of the rates of the reactions of ambient ions with hydrocarbon molecules at relevant temperatures. A Variable Temperature Selected Ions Flow Tube technique, which has been developed primarily to study these reactions at temperatures within the range of 200-330 K, is briefly described. The flow tube temperature regulation system and the thermalisation of ions are also discussed. Preliminary studies of two reactions have been carried out to check the reliability and efficacy of kinetics measurements: (i) Rate constants of the reaction of CH3 + ions with molecular oxygen were measured at different temperatures, which indicate values in agreement with previous ion cyclotron resonance measurements ostensibly made at 300 K. (ii) Formation of CH3 + ions in the reaction of N2 + ions with CH4 molecules were studied at temperatures within the range 240-310 K which showed a small but statistically significant decrease of the ratio of product CH3 + ions to reactant N2 + ions with reaction temperature.

  15. Spontaneous monitoring of adverse reactions to drugs by Italian dermatologists: a pilot study. Gruppo Italiano Studi Epidemiologici in Dermatologia.

    Science.gov (United States)

    1991-01-01

    During 1988, the Gruppo Italiano Studi Epidemiologici in Dermatologia (GISED) coordinated a pilot study aimed at evaluating the feasibility of a system for spontaneous monitoring of adverse drug reactions in dermatological practice in Italy. Approximately 400 dermatologists were asked to collaborate, and 141 agreed to the study. Procedures similar to those well established in other surveillance programs (including the use of standard forms and standardized assessment procedure) were adopted. In a 2-month period 775 reports were collected, of which 711 were maintained after careful evaluation. The general profile of the adverse reactions reported was in accordance with the experience derived by other spontaneous surveillance programs. The main purpose of spontaneous reporting systems is the identification of new reactions, and a model analysis was proposed, in our study, with reference to skin reactions to bamifylline. The demonstration of the feasibility of a drug-monitoring program in Italy, where little tradition exists in the area, is the most important result of our study.

  16. Role of the hippocampal-entorhinal loop in temporal lobe epilepsy: extra- and intracellular study in the isolated guinea pig brain in vitro.

    Science.gov (United States)

    Paré, D; deCurtis, M; Llinás, R

    1992-05-01

    This article introduces a new experimental paradigm for the study of temporal lobe epilepsy. This approach utilizes the isolated guinea pig brain in vitro preparation, which generates a pattern of hypersynchronous neuronal activity similar to the peculiar 8-30 Hz rhythm characterizing stereoelectroencephalographic hippocampal recordings in human temporal lobe epilepsy. The present report describes an attempt to identify the functional events underlying the epileptiform activities observed in this preparation. Rhythmic epileptiform discharges (EDs), here defined as population spikes (PSs) recorded from somata or dendritic layers, were induced in the hippocampal formation of the isolated guinea pig brain maintained in vitro by tetanic stimulation of the entorhinal cortex (EC). Two patterns of EDs were distinguished by performing simultaneous field potential recordings along the dentate gyrus (DG), EC, CA1, and CA3. During stage 1, the first self-sustained EDs were isolated PSs occurring at a frequency of 2-3 Hz at all levels of the entorhinal-hippocampal loop, the only exception being the DG, where no signs of synchronized neuronal discharge could be found. Over the next 30-50 sec, the temporal organization of these EDs changed dramatically. During stage 2, at all levels of the entorhinal-hippocampal loop, EDs occurred in 0.3-0.5 sec trains of 16-25 Hz population spikes interrupted by 0.7-1.3 sec silent periods. The transition between stages 1 and 2 coincided with the occurrence of population spikes in the DG. Laminar analyses and multiple simultaneous field potential recordings revealed that the trains of EDs observed in stage 2 resulted from the repetitive, sequential activation of the hippocampal-entorhinal loop. In the transverse axis, the earliest event usually occurred in the CA3 region. Thereafter, population spikes occurred sequentially in the CA1 region, EC, DG, and back to the CA3 region. Intracellular recordings confirmed that the EDs recorded

  17. Closing the tau loop: the missing tau mutation.

    Science.gov (United States)

    McCarthy, Allan; Lonergan, Roisin; Olszewska, Diana A; O'Dowd, Sean; Cummins, Gemma; Magennis, Brian; Fallon, Emer M; Pender, Niall; Huey, Edward D; Cosentino, Stephanie; O'Rourke, Killian; Kelly, Brendan D; O'Connell, Martin; Delon, Isabelle; Farrell, Michael; Spillantini, Maria Grazia; Rowland, Lewis P; Fahn, Stanley; Craig, Peter; Hutton, Michael; Lynch, Tim

    2015-10-01

    Frontotemporal lobar degeneration comprises a group of disorders characterized by behavioural, executive, language impairment and sometimes features of parkinsonism and motor neuron disease. In 1994 we described an Irish-American family with frontotemporal dementia linked to chromosome 17 associated with extensive tau pathology. We named this disinhibition-dementia-parkinsonism-amyotrophy complex. We subsequently identified mutations in the MAPT gene. Eleven MAPT gene splice site stem loop mutations were identified over time except for 5' splice site of exon 10. We recently identified another Irish family with autosomal dominant early amnesia and behavioural change or parkinsonism associated with the 'missing' +15 mutation at the intronic boundary of exon 10. We performed a clinical, neuropsychological and neuroimaging study on the proband and four siblings, including two affected siblings. We sequenced MAPT and performed segregation analysis. We looked for a biological effect of the tau variant by performing real-time polymerase chain reaction analysis of RNA extracted from human embryonic kidney cells transfected with exon trapping constructs. We found a c.915+15A>C exon 10/intron 10 stem loop mutation in all affected subjects but not in the unaffected. The c.915+15A>C variant caused a shift in tau splicing pattern to a predominantly exon 10+ pattern presumably resulting in predominant 4 repeat tau and little 3 repeat tau. This strongly suggests that the c.915+15A>C variant is a mutation and that it causes frontotemporal dementia linked to chromosome 17 in this pedigree by shifting tau transcription and translation to +4 repeat tau. Tau (MAPT) screening should be considered in families where amnesia or atypical parkinsonism coexists with behavioural disturbance early in the disease process. We describe the final missing stem loop tau mutation predicted 15 years ago. Mutations have now been identified at all predicted sites within the 'stem' when the stem-loop

  18. C-13 isotopic studies of the surface catalysed reactions of methane

    Energy Technology Data Exchange (ETDEWEB)

    Long, M.A.; He, S.J.X.; Adebajo, M. [University of New South Wales, Sydney, NSW (Australia). School of Chemistry

    1997-10-01

    The ability of methane to methylate aromatic compounds, which are considered to be models for coal, is being studied. Related to this reaction, but at higher temperatures, is the direct formation of benzene from methane in the presence of these catalysts. Controversy exists in the literature on the former reaction, and {sup 13}C isotope studies are being used to resolve the question. The interest in this reaction arises because the utilisation of methane, in the form of natural gas, in place of hydrogen for direct coal liquefaction would have major economic advantage. For this reason Isotope studies in this area have contributed significantly to an understanding of the methylation reactions. The paper describes experiments utilising methane{sup 13}C, which show that methylation of aromatics such as naphthalene by the methane{sup 13}C is catalysed by microporous, Cu-exchanged SAPO-5, at elevated pressures (6.8 MPa) and temperatures around 400 degree C. The mass spectrometric analysis and n.m.r. study of the isotopic composition of the products of the methylation reaction demonstrate unequivocally that methane provides the additional carbon atom for the methylated products. Thermodynamic calculations predict that the reaction is favourable at high methane pressures under these experimental conditions. The mechanism as suggested by the isotope study is discussed. The catalysts which show activity for the activation of methane for direct methylation of organic compounds, such as naphthalene, toluene, phenol and pyrene, are substituted aluminophosphate molecular sieves, EIAPO-5 (where El=Pb, Cu, Ni and Si) and a number of metal substituted zeolites. Our earlier tritium studies had shown that these catalysts will activate alkanes, at least as far as isotope hydrogen exchange reactions are concerned

  19. Theoretical Study of Reaction Mechanism of 1-Propenyl Radical with NO

    Institute of Scientific and Technical Information of China (English)

    Xue-li Cheng; Yan-yun Zhao; Feng Li; Ren-tao Wu

    2008-01-01

    The reaction system of 1-propenyl radical with NO is an ideal model for studying the intermolecu- lax and intramolecular reactions of complex organic free radicals containing C=C double bonds. On the basis of the full optimization of all species with the Gaussian 98 package at the B3LYP/6- 311++G** level, the reaction mechanism was elucidated extensively using the vibrational mode analy- sis. There are seven reaction pathways and five sets of small molecule end products: CH2O+CH3CN, CH2CHCN+H2O, CH3CHO+HCN, CH3CHO+HNC, and CH3CCH+HNO. The channel of C3H5·+NO→IM1→TS1→IM2→TS2→IM3→TS3→CH3CHO+HCN is thermodynamically most favorable.

  20. Neutron Scattering in Hydrogenous Moderators, Studied by Time Dependent Reaction Rate Method

    Energy Technology Data Exchange (ETDEWEB)

    Larsson, L.G.; Moeller, E.; Purohit, S.N.

    1966-03-15

    The moderation and absorption of a neutron burst in water, poisoned with the non-1/v absorbers cadmium and gadolinium, has been followed on the time scale by multigroup calculations, using scattering kernels for the proton gas and the Nelkin model. The time dependent reaction rate curves for each absorber display clear differences for the two models, and the separation between the curves does not depend much on the absorber concentration. An experimental method for the measurement of infinite medium reaction rate curves in a limited geometry has been investigated. This method makes the measurement of the time dependent reaction rate generally useful for thermalization studies in a small geometry of a liquid hydrogenous moderator, provided that the experiment is coupled to programs for the calculation of scattering kernels and time dependent neutron spectra. Good agreement has been found between the reaction rate curve, measured with cadmium in water, and a calculated curve, where the Haywood kernel has been used.

  1. Theoretical Study on the NO2 + NO2- Electron Transfer Reaction

    Institute of Scientific and Technical Information of China (English)

    ZHOU,Zheng-Yu(周正宇); GAO,Hong-Wei(高洪伟); XING,Yu-Mei(邢玉梅); GUO,Li(郭丽); QU,Yu-Hui(曲玉辉)

    2002-01-01

    The NO2 + NO2- electron transfer reaction was studied with DFT-B3LYP method at 6-311 + G* basis set level for the eight selected structures: four species favor the strucure of "head to head". The geometry of transition state was obtained by the linear coordinate method. Three parameters, non-adiahatic activation energy (Ead), coupling matrix element (Hif) and reorganization energy (λ) for electron transfer reaction can be calculated. According to the reorganization energy of the ET reaction, the values obtained from George-Griffith-Marcus (GGM) method (the contribution only from diagonal elements of force constant matrix) are larger than those obtained from Hessian matrix method (including the contribution from both diagonal and off-diagonal elements), which suggests that the coupling interactions between different vibrational modes are important to the inner-sphere reogrganization energy for the ET reactions in gaseous phase. The value of rate constant was obtained by using above three activation parameters.

  2. Studies on electron transfer reactions of Keggin-type mixed addenda heteropolytungstovanadophosphates with NADH

    Indian Academy of Sciences (India)

    Ponnusamy Sami; Kasi Rajasekaran

    2009-03-01

    The coenzyme nicotinamide adenine dinucleotide (NADH) undergoes facile electron transfer reaction with vanadium (V) substituted Keggin-type heteropolyanions (HPA) [PVVW11O40]4- (PV1) and [PV$^{V}_{2}$W10O40]5- (PV2) in aqueous phosphate buffer of pH 6 at ambient temperature. Electrochemical and optical studies show that the stoichiometry of the reaction is 1 : 2 (NADH : HPA). EPR and optical studies show that HPA act as one electron acceptor and the products of electron transfer reactions are one electron reduced heteropoly blues (HPB), viz. [PVIVW11O40]5- and [PVIVVVW10O40]6-. Oxygraph measurements show that there is no uptake of molecular oxygen during the course of reaction. The reaction proceeds through multi-step electron-proton-electron transfer mechanism, with rate limiting initial one electron transfer from NADH to HPA by outer sphere electron transfer process. Bimolecular rate constant for electron transfer reaction between NADH and PV2 in phosphate buffer of pH = 6 has been determined spectrophotometrically.

  3. Experimental study of the astrophysical gamma-process reaction 124Xe(alpha,gamma)128Ba

    CERN Document Server

    Halász, Z; Gyürky, Gy; Elekes, Z; Fülöp, Zs; Szücs, T; Kiss, G G; Szegedi, N; Rauscher, T; Görres, J; Wiescher, M

    2016-01-01

    The synthesis of heavy, proton rich isotopes in the astrophysical gamma-process proceeds through photodisintegration reactions. For the improved understanding of the process, the rates of the involved nuclear reactions must be known. The reaction 128Ba(g,a)124Xe was found to affect the abundance of the p nucleus 124Xe. Since the stellar rate for this reaction cannot be determined by a measurement directly, the aim of the present work was to measure the cross section of the inverse 124Xe(a,g)128Ba reaction and to compare the results with statistical model predictions. Of great importance is the fact that data below the (a,n) threshold was obtained. Studying simultaneously the 124Xe(a,n)127Ba reaction channel at higher energy allowed to further identify the source of a discrepancy between data and prediction. The 124Xe + alpha cross sections were measured with the activation method using a thin window 124Xe gas cell. The studied energy range was between E = 11 and 15 MeV close above the astrophysically relevant...

  4. Development of a reaction cell for in-situ/operando studies of surface of a catalyst under a reaction condition and during catalysis.

    Science.gov (United States)

    Nguyen, Luan; Tao, Franklin Feng

    2016-06-01

    Tracking surface chemistry of a catalyst during catalysis is significant for fundamental understanding of catalytic performance of the catalyst since it allows for establishing an intrinsic correlation between surface chemistry of a catalyst at its working status and its corresponding catalytic performance. Ambient pressure X-ray photoelectron spectroscopy can be used for in-situ studies of surfaces of different materials or devices in a gas. To simulate the gaseous environment of a catalyst in a fixed-bed a flowing gaseous environment of reactants around the catalyst is necessary. Here, we report the development of a new flowing reaction cell for simulating in-situ study of a catalyst surface under a reaction condition in gas of one reactant or during catalysis in a mixture of reactants of a catalytic reaction. The homemade reaction cell is installed in a high vacuum (HV) or ultrahigh vacuum (UHV) environment of a chamber. The flowing gas in the reaction cell is separated from the HV or UHV environment through well sealings at three interfaces between the reaction cell and X-ray window, sample door and aperture of front cone of an energy analyzer. Catalyst in the cell is heated through infrared laser beam introduced through a fiber optics interfaced with the reaction cell through a homemade feedthrough. The highly localized heating on the sample holder and Au-passivated internal surface of the reaction cell effectively minimizes any unwanted reactions potentially catalyzed by the reaction cell. The incorporated laser heating allows a fast heating and a high thermal stability of the sample at a high temperature. With this cell, a catalyst at 800 °C in a flowing gas can be tracked readily.

  5. Fusion and quasifission studies in reactions forming Rn via evaporation residue measurements

    Science.gov (United States)

    Shamlath, A.; Prasad, E.; Madhavan, N.; Laveen, P. V.; Gehlot, J.; Nasirov, A. K.; Giardina, G.; Mandaglio, G.; Nath, S.; Banerjee, Tathagata; Vinodkumar, A. M.; Shareef, M.; Jhingan, A.; Varughese, T.; Kumar, Dvgrks; Devi, P. Sandya; Khushboo, Jisha, P.; Kumar, Neeraj; Hosamani, M. M.; Kailas, S.

    2017-03-01

    Background: Formation of the compound nucleus (CN) is highly suppressed by quasifission in heavy-ion collisions involving massive nuclei. Though considerable progress has been made in the understanding of fusion-fission and quasifission, the exact dependence of fusion probability on various entrance channel variables is not completely clear, which is very important for the synthesis of new heavy and superheavy elements. Purpose: To study the interplay between fusion and quasifission in reactions forming CN in the boundary region where the fusion probability starts to deviate from unity. Methods: Fusion evaporation residue cross sections were measured for the Si,3028+180Hf reactions using the Hybrid Recoil Mass Analyser at IUAC, New Delhi. Experimental data were compared with data from other reactions forming the same CN or isotopes of the CN. Theoretical calculations were performed using the dinuclear system and statistical models. Results: Reduced evaporation residue cross sections were observed for the reactions studied compared with the asymmetric reaction forming the same CN, indicating fusion suppression in more symmetric systems. The observations are consistent with fission fragment measurements performed in the same or similar systems. Larger ER cross sections are observed with increase in mass in the isotopic chain of the CN. Conclusions: Fusion probability varies significantly with the entrance channels in reactions forming the same CN. While complete fusion occurs for the 16O+194Pt reaction, the fusion probability drops to approximately 60 -70 % for the 30Si+180Hf and less than 20 % for the 50Ti+160Gd reactions, respectively, forming the same CN at similar excitation energies.

  6. Healthy Change Processes-A Diary Study of Five Organizational Units. Establishing a Healthy Change Feedback Loop.

    Science.gov (United States)

    Lien, Mathilde; Saksvik, Per Øystein

    2016-10-01

    This paper explores a change process in the Central Norway Regional Health Authority that was brought about by the implementation of a new economics and logistics system. The purpose of this paper is to contribute to understanding of how employees' attitudes towards change develop over time and how attitudes differ between the five health trusts under this authority. In this paper, we argue that a process-oriented focus through a longitudinal diary method, in addition to action research and feedback loops, will provide greater understanding of the evaluation of organizational change and interventions. This is explored through the assumption that different units will have different perspectives and attitudes towards the same intervention over time because of different contextual and time-related factors. The diary method aims to capture the context, events, reflections and interactions when they occur and allows for a nuanced frame of reference for the different phases of the implementation process and how these phases are perceived by employees. Copyright © 2016 John Wiley & Sons, Ltd. Copyright © 2016 John Wiley & Sons, Ltd.

  7. A Comparison Study of Heat-Transfer Simulations in a Closed-Loop Geothermal Heat- Pump System

    Science.gov (United States)

    Kim, S.; Seol, Y.; Bae, G.; Lee, K.

    2006-12-01

    Calculating heat transfer, particularly at the boundary between two different materials with varying heat conductivities, often involves weighting the heat conductivities of the two materials. However, the validity of the weighting scheme would be weak for a system in which heat conductivities vary considerably. We implemented the concept of a heat-transfer coefficient into heat transfer simulations to replace the weighting schemes. The heat-transfer coefficient can be experimentally measured to capture heat transfer between two materials whose heat conductivities significantly differ. A numerical code incorporating the heat-transfer coefficient was developed for simulations of heat transfer in a geothermal heat pump system (GHP) that consists of heat pipes, enclosing grouting material, surrounding porous media, and ambient groundwater flow. The code was applied to a simplified closed-loop GHP system with a single U-shaped heat pipe, and temperature changes in the system with circulating water through the pipe were monitored. The simulated temperature distribution results from this code were compared with results using the conventional weighting schemes of TOUGH2, a widely accepted simulator for heat and water flow in geothermal systems. Detailed discussion on the comparison analysis will be presented.

  8. STUDYING THE INTERSTELLAR MEDIUM AND THE INNER REGION OF NPS/LOOP 1 WITH SHADOW OBSERVATIONS TOWARD MBM36

    Energy Technology Data Exchange (ETDEWEB)

    Ursino, E.; Galeazzi, M.; Liu, W., E-mail: galeazzi@physics.miami.edu [Physics Department, University of Miami, Coral Gables, FL 33155 (United States)

    2016-01-01

    We analyzed data from a shadow observation of the high density molecular cloud MBM36 (l ∼ 4°, b ∼ 35°) with Suzaku. MBM36 is located in a region that emits relatively weakly in the 3/4 keV band compared to the surrounding North Polar Spur (NPS)/Loop 1 structure and the Galactic Bulge (GB). The contrast between high and low density targets in the MBM36 area allows one to separate the local and distant contributors to the soft diffuse X-ray background, providing a much better characterization of the individual components compared to single pointing observations. We identify two non-local thermal components, one at kT ≈ 0.12 keV and one at kT ≈ 0.29 keV. The colder component matches well with models of emission from the higher latitude region of the GB. The emission of the warmer component is in agreement with models predicting that the NPS is due to a hypershell from the center of the Milky Way. Geometrical and pressure calculations rule out a nearby bubble as responsible for the emission associated with the NPS. Any Galactic Halo/circumgalactic halo emission, if present, is outshined by the other components. We also report an excess emission around 0.9 keV, likely due to an overabundance of Ne ix.

  9. QM/MD studies of the dynamics of the MTSL spin label in Aurora-A kinase protein activation loop

    CERN Document Server

    Concilio, Maria Grazia; Bayliss, Richard; Burgess, Selena

    2015-01-01

    Molecular dynamics(MD)simulations using a graphics processing unit (GPU) has been employed in order to determine the conformational space of the methane-thiosulfonate spin label (MTSL) attached to the activation loop of the Aurora-A kinase protein and compared with quantum mechanical (QM) methods rooted on density functional theory (DFT). MD provided a wealth of information about interactions between the MTSL and the residues of the protein and on the different motional contributions to the overall dynamics of the MTSL. Data obtained from MD were seen to be in good agreement with those obtained from QM but the dynamics of the system revealed more interactions than those observed from QM methods. A strong correlation between the tumbling of the protein and the transitions of the X4 and X5 dihedral angles of the MTSL, was observed with a consequent effect also the distribution of the nitroxide(NO)group in the space. Theoretical EPR spectra calculated from opportunely selected MD frames showing interactions betw...

  10. Interaction of sweet proteins with their receptor. A conformational study of peptides corresponding to loops of brazzein, monellin and thaumatin.

    Science.gov (United States)

    Tancredi, Teodorico; Pastore, Annalisa; Salvadori, Severo; Esposito, Veronica; Temussi, Piero A

    2004-06-01

    The mechanism of interaction of sweet proteins with the T1R2-T1R3 sweet taste receptor has not yet been elucidated. Low molecular mass sweeteners and sweet proteins interact with the same receptor, the human T1R2-T1R3 receptor. The presence on the surface of the proteins of "sweet fingers", i.e. protruding features with chemical groups similar to those of low molecular mass sweeteners that can probe the active site of the receptor, would be consistent with a single mechanism for the two classes of compounds. We have synthesized three cyclic peptides corresponding to the best potential "sweet fingers" of brazzein, monellin and thaumatin, the sweet proteins whose structures are well characterized. NMR data show that all three peptides have a clear tendency, in aqueous solution, to assume hairpin conformations consistent with the conformation of the same sequences in the parent proteins. The peptide corresponding to the only possible loop of brazzein, c[CFYDEKRNLQC(37-47)], exists in solution in a well ordered hairpin conformation very similar to that of the same sequence in the parent protein. However, none of the peptides has a sweet taste. This finding strongly suggests that sweet proteins recognize a binding site different from the one that binds small molecular mass sweeteners. The data of the present work support an alternative mechanism of interaction, the "wedge model", recently proposed for sweet proteins [Temussi, P. A. (2002) FEBS Lett.526, 1-3.].

  11. Studying the Interstellar Medium and the inner region of NPS/Loop 1 with shadow observations toward MBM36

    CERN Document Server

    Ursino, E; Liu, W

    2015-01-01

    We analyzed data from a shadow observation of the high density molecular cloud MBM36 (l~4{\\deg}, b~35{\\deg}) with Suzaku. MBM36 is located in a region that emits relatively weakly in the 3/4~keV band, compared to the surrounding NPS/Loop 1 structure and the Galactic Bulge. The contrast between a high and low density targets in the MBM36 area allows one to separate the local and distant contributors to the Soft Diffuse X-ray Background, providing a much better characterization of the individual components compared to single pointing observations. We identify two non-local thermal components, one at kT~0.12 keV and one at kT~0.29keV. The colder component matches well with models of emission from the higher latitude region of the Galactic Bulge. The emission of the warmer component is in agreement with models predicting that the NPS is due to a hypershell from the center of the Milky Way. Geometrical and pressure calculations rule out a nearby bubble as responsible for the emission associate with the NPS. Any Ga...

  12. Numerical study of the accessorial loop with a micro-pump and ejector for the capillary pumped loop%CPL微泵引射辅助回路的数值研究

    Institute of Scientific and Technical Information of China (English)

    涂正凯; 刘超; 刘志春; 刘伟

    2009-01-01

    An accessorial loop with a micro-pump and ejector was applied into the capillary pumped loop(CPL) to enhance the heat transfer capability of CPL. A 3D model was developed to investigate the operation performance of the ejector. The numerical results show that the primary loop will not only can operate normally but the mass flux can be enhanced with an accessorial loop. However, vapor can be found in the outlet of the ejector and it can flow into the evaporator, which is a big disad- vantage for system, hence, a sub-cooler is necessary to locate between the outlet of the ejector and the inlet of the evaporator to condense the mixed fluid into liquid.%在毛细相变流体回路(CPL)系统中加入微泵引射辅助回路,以提高其传热能力,并建立一个三维模型来分析引射器的工作性能.数值结果表明:主回路不但能正常运行,而且辅助冋路能够提高主回路流体的质量流量;但在引射器的出口中包含气相,这些气体能够流入蒸发器,对整个系统都会造成不利影响.因此在引人微泵引射辅助回路的同时必须在引射器出口和蒸发器入口段之间加入过冷器.使得引射器出口中的气相冷凝成液体进入蒸发器,保证蒸发器的正常工作.

  13. The loop gravity string

    CERN Document Server

    Freidel, Laurent; Pranzetti, Daniele

    2016-01-01

    In this work we study canonical gravity in finite regions for which we introduce a generalisation of the Gibbons-Hawking boundary term including the Immirzi parameter. We study the canonical formulation on a spacelike hypersuface with a boundary sphere and show how the presence of this term leads to an unprecedented type of degrees of freedom coming from the restoration of the gauge and diffeomorphism symmetry at the boundary. In the presence of a loop quantum gravity state, these boundary degrees of freedom localize along a set of punctures on the boundary sphere. We demonstrate that these degrees of freedom are effectively described by auxiliary strings with a 3-dimensional internal target space attached to each puncture. We show that the string currents represent the local frame field, that the string angular momenta represent the area flux and that the string stress tensor represents the two dimensional metric on the boundary of the region of interest. Finally, we show that the commutators of these broken...

  14. Spin-2 Form Factors at Three Loop in QCD

    CERN Document Server

    Ahmed, Taushif; Mathews, Prakash; Rana, Narayan; Ravindran, V

    2015-01-01

    Spin-2 fields are often candidates in physics beyond the Standard Model namely the models with extra-dimensions where spin-2 Kaluza-Klein gravitons couple to the fields of the SM. Also, in the context of Higgs searches, spin-2 fields have been studied as an alternative to the scalar Higgs boson. In this article, we present the complete three loop QCD radiative corrections to the spin-2 quark-antiquark and spin-2 gluon-gluon form factors in SU(N) gauge theory with $n_f$ light flavors. These form factors contribute to both quark-antiquark and gluon-gluon initiated processes involving spin-2 particle in the hadronic reactions at the LHC. We have studied the structure of infrared singularities in these form factors up to three loop level using Sudakov integro-differential equation and found that the anomalous dimensions originating from soft and collinear regions of the loop integrals coincide with those of the electroweak vector boson and Higgs form factors confirming the universality of the infrared singulariti...

  15. Spin-2 form factors at three loop in QCD

    Science.gov (United States)

    Ahmed, Taushif; Das, Goutam; Mathews, Prakash; Rana, Narayan; Ravindran, V.

    2015-12-01

    Spin-2 fields are often candidates in physics beyond the Standard Model namely the models with extra-dimensions where spin-2 Kaluza-Klein gravitons couple to the fields of the Standard Model. Also, in the context of Higgs searches, spin-2 fields have been studied as an alternative to the scalar Higgs boson. In this article, we present the complete three loop QCD radiative corrections to the spin-2 quark-antiquark and spin-2 gluon-gluon form factors in SU(N) gauge theory with n f light flavors. These form factors contribute to both quark-antiquark and gluon-gluon initiated processes involving spin-2 particle in the hadronic reactions at the LHC. We have studied the structure of infrared singularities in these form factors up to three loop level using Sudakov integro-differential equation and found that the anomalous dimensions originating from soft and collinear regions of the loop integrals coincide with those of the electroweak vector boson and Higgs form factors confirming the universality of the infrared singularities in QCD amplitudes.

  16. Spin-2 form factors at three loop in QCD

    Energy Technology Data Exchange (ETDEWEB)

    Ahmed, Taushif [The Institute of Mathematical Sciences,IV Cross Road, CIT Campus, Chennai 600 113 (India); Das, Goutam; Mathews, Prakash [Saha Institute of Nuclear Physics,1/AF Bidhan Nagar, Kolkata 700 064 (India); Rana, Narayan; Ravindran, V. [The Institute of Mathematical Sciences,IV Cross Road, CIT Campus, Chennai 600 113 (India)

    2015-12-15

    Spin-2 fields are often candidates in physics beyond the Standard Model namely the models with extra-dimensions where spin-2 Kaluza-Klein gravitons couple to the fields of the Standard Model. Also, in the context of Higgs searches, spin-2 fields have been studied as an alternative to the scalar Higgs boson. In this article, we present the complete three loop QCD radiative corrections to the spin-2 quark-antiquark and spin-2 gluon-gluon form factors in SU(N) gauge theory with n{sub f} light flavors. These form factors contribute to both quark-antiquark and gluon-gluon initiated processes involving spin-2 particle in the hadronic reactions at the LHC. We have studied the structure of infrared singularities in these form factors up to three loop level using Sudakov integro-differential equation and found that the anomalous dimensions originating from soft and collinear regions of the loop integrals coincide with those of the electroweak vector boson and Higgs form factors confirming the universality of the infrared singularities in QCD amplitudes.

  17. Study of the 10B ( p ,α)7Be reaction through the indirect Trojan Horse method

    Science.gov (United States)

    Puglia, S. M. R.; Spitaleri, C.; Lamia, L.; Romano, S.; Burjan, V.; Carlin, N.; Chengbo, L.; Del Santo, M. G.; Kroha, V.; Hons, Z.; Irgaziev, B.; La Cognata, M.; Mrazek, J.; Mukhamedzhanov, A.; Munhoz, M. G.; Pizzone, R. G.; Qungang, W.; Rapisarda, G. G.; Shu-Hua, Z.; Sergi, M. L.; Somoryai, E.; Souza, F.; Szanto de Toledo, A.; Tabacaru, G.; Tumino, A.; Wakabayashi, Y.; Yamaguchi, H.

    2015-02-01

    Boron abundances in stellar atmospheres, as well as berillium and lithium ones, can give useful hints for non-standard transport processes discrimination in stars. They can also be relevant for understanding several astrophysical processes (e.g. primordial nucleosynthesis and spallation reactions in ISM). A comprehensive study of Li Be B abundances can therefore confirm or not the presence of non-standard mixing processes in stellar envelopes. For this reason nuclear processes producing or depleting boron isotope abundance need to be studied at astrophysical energies. The 10B ( p ,α)7Be reaction has been studied by means of the Trojan Horse Method. The Trojan Horse Method was thus applied to the 10B ( d ,α7Be ) n reaction, studied at 24 MeV. The obtained results will be discussed.

  18. Innovative Waste Management in the Mercury Loop of the EURISOL Multi-MW Converter Target

    CERN Document Server

    PSI: Jörg Neuhausen, Dorothea Schumann, Rugard Dressler, Susanne Horn, Sabrina Lüthi, Stephan Heinitz, Suresh ChirikiCERN: Thierry Stora, Martin Eller

    The choice of mercury as target material imposes various questions concerning the safe operation of such a system that are related to the physical and chemical properties of the target material itself and the nuclear reaction products produced within the target during its life time of several decades. Therefore, a subtask was created within the EURISOL-DS project that is concerned with studying an innovative waste management for the generated radioactivity by chemical means. Such a study strongly depends on the radioactive inventory and its distribution throughout the target and loop system. Radioactive inventory calculations were performed within task 5 [6]. The distribution of nuclear reaction products and their chemical state that can be expected within the target and loop system is one of the topics covered in this report. Based on the results obtained by theoretical studies as well as laboratory scale experiments, the feasibility of waste reduction using chemical methods, both conventional (e.g. leaching...

  19. Quantum Chemical Studies of the Substituent Effect on the Reaction of Carbonyl Oxime with Amine.

    Science.gov (United States)

    Kaya, Yunus

    2016-07-21

    The reaction of the two different substitue carbonyl oximes (isonitrosoacetylnaphthaline, inanH and nitro-isonitrosoacetophenone, ninapH) with two different amines (1-phenylethanol amine, pea, and ethanol amine, ea) was carried out and characterized by elemental analyses, IR, and (1)H and (13)C NMR spectroscopic methods. As a result of these experimental studies, two different levels for all reactions were determined: (I) formation of imine oxime and (II) rearrangement of imine oxime or formation of amido alcohol. After a mechanism was suggested for all of these reactions, the reaction mechanism of carbonyl oxime with amine was first studied by means of the B3LYP/6-311G(d,p) method. Because of the deficiency of density functional theory (DFT) on dispersion effects, the wB97X-D/6-311G(d,p) method, which includes dispersion correction, was used to obtain the reaction heat and free energy barriers to explain why the formation (imine oxime) and unexpected rearrangement products (amido alcohol) occurred or did not occur. The statistical thermodynamic method was used to obtain the changes in thermodynamic properties of the studied molecules between 100 and 500 K. From a kinetic viewpoint, the slowest step of the reactions is the IN1-TS2-IN2 step, which determines the steps of the reaction kinetics. In addition, spectroscopic properties such as vibrational and NMR chemical shifts were studied for all of the molecules. The frontier molecular orbitals (FMOs), highest occupied molecular orbitals (HOMOs), and lowest unoccupied molecular orbitals (LUMOs) were monitored for all of the molecules.

  20. Loops In Proteins (LIP)--a comprehensive loop database for homology modelling.

    Science.gov (United States)

    Michalsky, E; Goede, A; Preissner, R

    2003-12-01

    One of the most important and challenging tasks in protein modelling is the prediction of loops, as can be seen in the large variety of existing approaches. Loops In Proteins (LIP) is a database that includes all protein segments of a length up to 15 residues contained in the Protein Data Bank (PDB). In this study, the applicability of LIP to loop prediction in the framework of homology modelling is investigated. Searching the database for loop candidates takes less than 1 s on a desktop PC, and ranking them takes a few minutes. This is an order of magnitude faster than most existing procedures. The measure of accuracy is the root mean square deviation (RMSD) with respect to the main-chain atoms after local superposition of target loop and predicted loop. Loops of up to nine residues length were modelled with a local RMSD <1 A and those of length up to 14 residues with an accuracy better than 2 A. The results were compared in detail with a thoroughly evaluated and tested ab initio method published recently and additionally with two further methods for a small loop test set. The LIP method produced very good predictions. In particular for longer loops it outperformed other methods.

  1. Uranyl Nitrate Flow Loop

    Energy Technology Data Exchange (ETDEWEB)

    Ladd-Lively, Jennifer L [ORNL

    2008-10-01

    The objectives of the work discussed in this report were to: (1) develop a flow loop that would simulate the purified uranium-bearing aqueous stream exiting the solvent extraction process in a natural uranium conversion plant (NUCP); (2) develop a test plan that would simulate normal operation and disturbances that could be anticipated in an NUCP; (3) use the flow loop to test commercially available flowmeters for use as safeguards monitors; and (4) recommend a flowmeter for production-scale testing at an NUCP. There has been interest in safeguarding conversion plants because the intermediate products [uranium dioxide (UO{sub 2}), uranium tetrafluoride (UF{sub 4}), and uranium hexafluoride (UF{sub 6})] are all suitable uranium feedstocks for producing special nuclear materials. Furthermore, if safeguards are not applied virtually any nuclear weapons program can obtain these feedstocks without detection by the International Atomic Energy Agency (IAEA). Historically, IAEA had not implemented safeguards until the purified UF{sub 6} product was declared as feedstock for enrichment plants. H. A. Elayat et al. provide a basic definition of a safeguards system: 'The function of a safeguards system on a chemical conversion plant is in general terms to verify that no useful nuclear material is being diverted to use in a nuclear weapons program'. The IAEA now considers all highly purified uranium compounds as candidates for safeguarding. DOE is currently interested in 'developing instruments, tools, strategies, and methods that could be of use to the IAEA in the application of safeguards' for materials found in the front end of the nuclear fuel cycle-prior to the production of the uranium hexafluoride or oxides that have been the traditional starting point for IAEA safeguards. Several national laboratories, including Oak Ridge, Los Alamos, Lawrence Livermore, and Brookhaven, have been involved in developing tools or techniques for safeguarding conversion

  2. A ring polymer molecular dynamics study of the Cl + O3 reaction.

    Science.gov (United States)

    de Tudela, R Pérez; Suleimanov, Y V; Menéndez, M; Castillo, J F; Aoiz, F J

    2014-02-21

    We have performed ring polymer molecular dynamics (RPMD) calculations on the Cl + O3 → ClO + O2 reaction at temperatures ranging from 200 K to 400 K, and compared the results with previous theoretical studies and also with the available experimental data. This reaction presents a couple of features which makes it a particularly interesting and challenging case to be studied using RPMD. First, classically, this is essentially a barrierless reaction, with a saddle point located below the reactants. However, the free energy profiles along the reaction coordinate display small barriers due to the fact that the decrease in enthalpy from reactants to the TS is somewhat compensated by a decrease in entropy. To our knowledge this is the first time such a process is studied using this technique. Second, the transition state is located early in the reactant valley, therefore the inclusion of the recrossing correction in the RPMD calculations is crucial to determine rate coefficients. Regarding quantum effects, our calculations show that RPMD results are within the error bars of the purely classical ones. This implies that tunnelling is negligible in this reaction at the temperatures studied, not surprisingly for a system including oxygen and chlorine atoms, and that the zero point energies of reactants, transition state and products are practically the same. Finally, the rate coefficients presented in this work are in a fairly good agreement with the recommended experimental values, somewhat better than those obtained using other approaches.

  3. Studying astrophysical reactions with low-energy RI beams at CRIB

    Directory of Open Access Journals (Sweden)

    Yamaguchi H.

    2016-01-01

    Full Text Available Studies on nuclear astrophysics, nuclear structure, and other interests have been performed using the radioactive-isotope (RI beams at the low-energy RI beam separator CRIB, operated by Center for Nuclear Study (CNS, the University of Tokyo. A typical measurement performed at CRIB is the elastic resonant scattering with the inverse kinematics. One recent experiment was on the α resonant scattering with 7Li and 7Be beams. This study is related to the astrophysical 7Li/7Be(α,γ reactions, important at hot p-p chain and νp-process in supernovae. There have also been measurements based on other experimental methods. The first THM measurement using an RI beam has been performed at CRIB, to study the 18F(p, α15O reaction at astrophysical energies via the three body reaction 2H(18F, α15On. The 18F(p, α 15O reaction rate is crucial to understand the 511-keV γ-ray production in nova explosion phenomena, and we successfully evaluated the reaction cross section at novae temperature and below experimentally for the first time.

  4. Nucleosome repositioning via loop formation

    CERN Document Server

    Kulic, M L

    2002-01-01

    Active (catalysed) and passive (intrinsic) nucleosome repositioning is known to be a crucial event during the transcriptional activation of certain eucaryotic genes. Here we consider theoretically the intrinsic mechanism and study in detail the energetics and dynamics of DNA-loop-mediated nucleosome repositioning, as previously proposed by Schiessel et al. (H. Schiessel, J. Widom, R. F. Bruinsma, and W. M. Gelbart. 2001. {\\it Phys. Rev. Lett.} 86:4414-4417). The surprising outcome of the present study is the inherent nonlocality of nucleosome motion within this model -- being a direct physical consequence of the loop mechanism. On long enough DNA templates the longer jumps dominate over the previously predicted local motion, a fact that contrasts simple diffusive mechanisms considered before. The possible experimental outcome resulting from the considered mechanism is predicted, discussed and compared to existing experimental findings.

  5. Genetic Programming with Simple Loops

    Institute of Scientific and Technical Information of China (English)

    QI Yuesheng; WANG Baozhong; KANG Lishan

    1999-01-01

    A kind of loop function LoopN inGenetic Programming (GP) is proposed.Different from other forms of loopfunction, such as While-Do and Repeat-Until, LoopNtakes only oneargument as its loop body and makes its loop body simply run N times,soinfinite loops will never happen. The problem of how to avoid too manylayers ofloops in Genetic Programming is also solved. The advantage ofLoopN in GP is shown bythe computational results in solving the mowerproblem.

  6. Study of the autocatalytic chlorate–triiodide reaction in acidic and neutral media

    Directory of Open Access Journals (Sweden)

    Ahmad M. Mohammad

    2010-07-01

    Full Text Available The oxidation reaction of triiodide, I3−, by chlorate is investigated in a slightly acidic and neutral media. The reaction was verified and monitored both potentiometrically and spectrophotometrically. Generally, a slow linear decay preceded by an induction period was observed for the triiodide concentration following the addition of chlorate. The induction period is likely to be related to the time required for the generation of suitable concentrations of plausible intermediates (HIO and HIO2, which are assumed to auto-catalyse the reaction. We examined the effect of acidity and concentrations of both chlorate and triiodide on the induction time for this reaction. The acidity of the medium influenced the induction period, while the oxidation of iodide by chlorate competed with that of iodine as the medium acidity increased, making the reaction more complicated. Therefore, a suitable pH is highly recommended for studying the chlorate–triiodide reaction. A plausible mechanism involving the HIO, HIO2, and I2O species is proposed.

  7. Non-allergic cutaneous reactions in airborne chemical sensitivity--a population based study.

    Science.gov (United States)

    Berg, Nikolaj Drimer; Linneberg, Allan; Thyssen, Jacob Pontoppidan; Dirksen, Asger; Elberling, Jesper

    2011-06-01

    Multiple chemical sensitivity (MCS) is characterised by adverse effects due to exposure to low levels of chemical substances. The aetiology is unknown, but chemical related respiratory symptoms have been found associated with positive patch test. The purpose of this study was to investigate the relationship between cutaneous reactions from patch testing and self-reported severity of chemical sensitivity to common airborne chemicals. A total of 3460 individuals participating in a general health examination, Health 2006, were patch tested with allergens from the European standard series and screened for chemical sensitivity with a standardised questionnaire dividing the participants into four severity groups of chemical sensitivity. Both allergic and non-allergic cutaneous reactions--defined as irritative, follicular, or doubtful allergic reactions--were analysed in relationship with severity of chemical sensitivity. Associations were controlled for the possible confounding effects of sex, age, asthma, eczema, atopic dermatitis, psychological and social factors, and smoking habits. In unadjusted analyses we found associations between allergic and non-allergic cutaneous reactions on patch testing and the two most severe groups of self-reported sensitivity to airborne chemicals. When adjusting for confounding, associations were weakened, and only non-allergic cutaneous reactions were significantly associated with individuals most severely affected by inhalation of airborne chemicals (odds ratio = 2.5, p = 0.006). Our results suggest that individuals with self-reported chemical sensitivity show increased non-allergic cutaneous reactions based on day 2 readings of patch tests.

  8. Application of an electrochemical hydrogen meter for studying reactions in liquid sodium

    Science.gov (United States)

    Gnanasekaran, T.; Ganesan, V.; Periaswami, G.; Mathews, C. K.; Borgstedt, H. U.

    1990-05-01

    An electrochemical hydrogen meter based on a CaCl2- CaH2 solid electrolyte was used to study the reactions of rust (FeOOH) and hydrocarbon based oil with liquid sodium in the temperature range of 623 to 748 K. The results indicated that the reaction between FeOOH and sodium is slow at 623 K and fast at 723 K. The hydrogen concentration in sodium is increased due to the reaction. Similarly, the reaction between oil and sodium proceeds slowly at 623 K whereas above 673 K, it takes place rapidly. The gaseous products released during sodium-oil reactions were analysed by means of the gas Chromatographie technique. It was found that methane was the major gaseous product formed and its formation obeyed a parabolic rate law. The response of the meter for the liberation of hydrogen in both reactions was found to be fast, qualifying the meter for detecting the ingress of hydrogen bearing compounds into sodium.

  9. A Review of Study on Thermal Energy Transport System by Synthesis and Decomposition Reactions of Methanol

    Science.gov (United States)

    Liu, Qiusheng; Yabe, Akira; Kajiyama, Shiro; Fukuda, Katsuya

    The study on thermal energy transport system by synthesis and decomposition reactions of methanol was reviewed. To promote energy conservation and global environment protection, a two-step liquid-phase methanol synthesis process, which starts with carbonylation of methanol to methyl formate, then followed by the hydrogenolysis of the formate, was studied to recover wasted or unused discharged heat from industrial sources for the thermal energy demands of residential and commercial areas by chemical reactions. The research and development of the system were focused on the following three points. (1) Development of low-temperature decomposition and synthetic catalysts, (2) Development of liquid phase reactor (heat exchanger accompanying chemical reaction), (3) Simulation of the energy transport efficiency of entire system which contains heat recovery and supply sections. As the result of the development of catalyst, promising catalysts which agree with the development purposes for the methyl formate decomposition reaction and the synthetic reaction are being developed though some studies remain for the methanol decomposition and synthetic reactions. In the fundamental development of liquid phase reactor, the solubilities of CO and H2 gases in methanol and methyl formate were measured by the method of total pressure decrease due to absorption under pressures up to 1500kPa and temperatures up to 140°C. The diffusivity of CO gas in methanol was determined by measuring the diameter and solution time of single CO bubbles in methanol. The chemical reaction rate of methanol synthesis by hydrogenolysis of methyl formate was measured using a plate-type of Raney copper catalyst in a reactor with rectangular channel and in an autoclave reactor. The reaction characteristics were investigated by carrying out the experiments at various temperatures, flow rates and at various catalyst development conditions. We focused on the effect of Raney copper catalyst thickness on the liquid

  10. Inflammatory reactions in onchocerciasis: a report on current knowledge and recommendations for further study*

    Science.gov (United States)

    Henson, P. M.; Mackenzie, C. D.; Spector, W. G.

    1979-01-01

    This report concerns the host's reactions to the presence of the parasite both in the course of the natural disease and during drug treatment. The various stages of Onchocerca volvulus are discussed in terms of the type of tissue reaction seen. The discussion then turns to basic hypotheses concerning the etiology of these reactions, emphasis being placed on the fact that while pathological changes are considerable in some locations there is a remarkable lack of reaction in others. Some of the mechanisms possibly involved in this apparent absence of host response are discussed, including anti-complement factors, poor antigenicity, acquisition of host antigen, immune tolerance, and blocking antibodies. In any study of the inflammatory response it is recommended that critical evaluations be made of histological material, haematological studies, the definition of the antigenic nature of O. volvulus, characterization of immunological reactivity of patients, and the definition of the migratory pathways of the parasite. The marked host reactions seen following chemotherapy, especially those related to the interaction of the drug diethylcarbamazine with microfilariae, are discussed at some length. The etiology of these reactions is considered and recommendations are made for the experimental elucidation of the mechanisms involved. Emphasis is placed on the necessity for detailed sequential histopathological and immunopathological studies in the definition of the tissue lesions found in onchocerciasis. Characterization of these lesions will assist greatly the approach to control of the adverse reactions seen during treatment. The use of anti-inflammatory agents in clinical trials is discussed and comments are made concerning the most suitable clinical situations for testing drugs and the types of drug that should be tested. PMID:396050

  11. Inflammatory reactions in onchocerciasis: a report on current knowledge and recommendations for further study.

    Science.gov (United States)

    Henson, P M; Mackenzie, C D; Spector, W G

    1979-01-01

    This report concerns the host's reactions to the presence of the parasite both in the course of the natural disease and during drug treatment. The various stages of Onchocerca volvulus are discussed in terms of the type of tissue reaction seen. The discussion then turns to basic hypotheses concerning the etiology of these reactions, emphasis being placed on the fact that while pathological changes are considerable in some locations there is a remarkable lack of reaction in others. Some of the mechanisms possibly involved in this apparent absence of host response are discussed, including anti-complement factors, poor antigenicity, acquisition of host antigen, immune tolerance, and blocking antibodies. In any study of the inflammatory response it is recommended that critical evaluations be made of histological material, haematological studies, the definition of the antigenic nature of O. volvulus, characterization of immunological reactivity of patients, and the definition of the migratory pathways of the parasite.The marked host reactions seen following chemotherapy, especially those related to the interaction of the drug diethylcarbamazine with microfilariae, are discussed at some length. The etiology of these reactions is considered and recommendations are made for the experimental elucidation of the mechanisms involved. Emphasis is placed on the necessity for detailed sequential histopathological and immunopathological studies in the definition of the tissue lesions found in onchocerciasis. Characterization of these lesions will assist greatly the approach to control of the adverse reactions seen during treatment.The use of anti-inflammatory agents in clinical trials is discussed and comments are made concerning the most suitable clinical situations for testing drugs and the types of drug that should be tested.

  12. A Pilot Study of Quantitative Loop-mediated Isothermal Amplification-guided Target Therapies for Hospital-acquired Pneumonia

    Institute of Scientific and Technical Information of China (English)

    Fang Wang; Ran Li; Ying Shang; Can Wang; Guo-Qing Wang; De-Xun Zhou; Dong-Hong Yang

    2016-01-01

    Background:It is important to achieve the definitive pathogen identification in hospital-acquired pneumonia (HAP),but the traditional culture results always delay the target antibiotic therapy.We assessed the method called quantitative loop-mediated isothermal amplification (qLAMP) as a new implement for steering of the antibiotic decision-making in HAP.Methods:Totally,76 respiratory tract aspiration samples were prospectively collected from 60 HAP patients.DNA was isolated from these samples.Specific DNA fragments for identifying 11 pneumonia-related bacteria were amplified by qLAMP assay.Culture results of these patients were compared with the qLAMP results.Clinical data and treatment strategies were analyzed to evaluate the effects of qLAMP results on clinical data.McNemar test and Fisher's exact test were used for statistical analysis.Results:The detection of Staphylococcus aureus,Escherichia coli,Pseudomonas aeruginosa,Klebsiella pneumonia,Stenotrophomonas maltophilia,Streptococcus pneumonia,and Acinetobacter baumannii by qLAMP was consistent with sputum culture (P > 0.05).The qLAMP results of 4 samples for Haemophilus influenzae,Legionella pneumophila,or Mycoplasma pneumonia (MP) were inconsistent with culture results;however,clinical data revealed that the qLAMP results were all reliable except 1 MP positive sample due to the lack of specific species identified in the final diagnosis.The improvement of clinical condition was more significant (P < 0.00l) in patients with pathogen target-driven therapy based on qLAMP results than those with empirical therapy.Conclusion:qLAMP is a more promising method for detection of pathogens in an early,rapid,sensitive,and specific manner than culture.

  13. Experimental study to explore the 8Be-induced nuclear reaction via the Trojan horse method

    Science.gov (United States)

    Wen, Qun-Gang; Li, Cheng-Bo; Zhou, Shu-Hua; Irgaziev, Bakhadir; Fu, Yuan-Yong; Spitaleri, Claudio; La Cognata, Marco; Zhou, Jing; Meng, Qiu-Ying; Lamia, Livio; Lattuada, Marcello

    2016-03-01

    To explore a possible indirect method for 8Be induced astrophysical reactions, the 8Be=(8Be+n ) cluster structure has been studied via the Trojan horse method. For the first time a 8Be nucleus having an ultrashort lifetime is studied by the Trojan horse method and a 9Be nucleus in the ground state is used for this purpose. The 9Be nucleus is assumed to have a (8Be+n ) cluster structure and used as a Trojan horse nucleus. The 8Be nucleus acts as a participant, while the neutron is a spectator to the virtual 8Be+d →α +6Li reaction via the 3-body reaction 8Be+d →α +6Li+n . The experimental neutron momentum distribution inside 9Be has been reconstructed. The agreement between the experimental momentum distribution and the theoretical one indicates that a (8Be+n ) cluster structure inside 9Be is very likely. Therefore, the experimental study of 8Be induced reactions, for example, the measurement of the 8Be+α →12C reaction proceeding through the Hoyle state, is possible.

  14. Study Protocol Evaluating the Use of Bowel Stimulation Before Loop Ileostomy Closure to Reduce Postoperative Ileus: A Multicenter Randomized Controlled Trial.

    Science.gov (United States)

    Garfinkle, Richard; Trabulsi, Nora; Morin, Nancy; Phang, Terry; Liberman, Sender; Feldman, Liane; Fried, Gerald; Boutros, Marylise

    2017-05-12

    Postoperative ileus is the most commonly observed morbidity following ileostomy closure. Studies have demonstrated that the defunctionalized bowel of a loop ileostomy undergoes a series of functional and structural changes, such as atrophy of the intestinal villi and muscular layers, which may contribute to ileus. A single-center study in Spain demonstrated that preoperative bowel stimulation via the distal limb of the loop ileostomy decreased postoperative ileus, length of stay, and time to gastrointestinal function. A multicenter randomized controlled trial involving patients from Canadian institutions was designed to evaluate the effect of preoperative bowel stimulation before ileostomy closure on postoperative ileus. Stimulation will include canalizing the distal limb of the ileostomy loop with an 18Fr Foley catheter and infusing it with a solution of 500mL of normal saline mixed with 30g of a thickening-agent (Nestle© Thicken-Up©). This will be performed 10 times over the three weeks prior to ileostomy closure on an outpatient clinic setting by a trained Enterostomal Therapy nurse. Surgeons and the treating surgical team will be blinded to their patient's group allocation. Data regarding patient demographics, operative, and postoperative variables will be collected prospectively. Primary outcome will be postoperative ileus, defined as an intolerance to oral food in the absence of clinical or radiological signs of obstruction, that either a) requires nasogastric tube insertion; or b) is associated with 2 of the following: nausea/vomiting, abdominal distension, and the absence of flatus, on or after post-operative day 3. Secondary outcomes will include length of stay, time to tolerating a regular diet, time to first passage of flatus or stool, and overall morbidity. A cost-analysis will be performed to compare the costs of conventional care to conventional care plus preoperative stimulation. This manuscript discusses the potential benefits of preoperative

  15. Study of the {sup 17}O(n,α){sup 14}C reaction: Extension of the Trojan Horse Method to neutron induced reactions

    Energy Technology Data Exchange (ETDEWEB)

    Guardo, G. L.; Lamia, L.; Spitaleri, C.; Cherubini, S.; Rapisarda, G. G.; Sergi, M. L. [INFN - Laboratori Nazionali del Sud, Catania, Italy and Department of Physics and Astronomy, University of Catania, Catania (Italy); Gulino, M. [INFN - Laboratori Nazionali del Sud, Catania, Italy and University of Enna (Italy); Tang, X. D.; Bucher, B.; Couder, M.; Davies, P.; Boer, R. de; Fang, X.; Lamm, L.; Ma, C.; Notani, M.; OBrien, S.; Roberson, D.; Tan, W.; Wiescher, M. [Department of Physics and Joint Institute for Nuclear Astrophysics, University of Notre Dame, IN (United States); and others

    2014-05-02

    The experimental study of the {sup 17}O(n,α){sup 14}C reaction has been performed in the energy range 0-350 keV. This reaction could play an important role in explaining heavy elements (s-process) nucleosynthesis in various astrophysical scenario. To overcome the practical problems arising from the neutrons production, a new application of the Trojan Horse Method has been recently suggested. In more details, the {sup 17}O(n,α){sup 14}C reaction has been studied using the quasi-free {sup 2}H({sup 17}O,α{sup 14}C){sup 1}H reaction, induced at an energy of 43.5 MeV. The measurement allows one to investigate the ℓ=3, 75 keV resonance (E*=8.125 MeV, J{sup π}=5{sup −}), absent in the available direct measurements because of centrifugal suppression effects.

  16. Prospective Observational Study of Adverse Drug Reactions of Anticancer Drugs Used in Cancer Treatment in a Tertiary Care Hospital

    OpenAIRE

    Saini, V. K.; Sewal, R. K.; Ahmad, Yusra; B Medhi

    2015-01-01

    Adverse drug reactions associated with the use of anticancer drugs are a worldwide problem and cannot be ignored. Adverse drug reactions can range from nausea, vomiting or any other mild reaction to severe myelosuppression. The study was planned to observe the suspected adverse drug reactions of cancer chemotherapy in patients aged >18 years having cancer attending Postgraduate Institute of Medical Education and Research, Chandigarh. During the study period, 101 patients of breast cancer and ...

  17. X-ray diffraction study of multiphase reverse reaction with molten CuCl and oxygen

    Energy Technology Data Exchange (ETDEWEB)

    Marin, G.D.; Wang, Z. [Faculty of Engineering and Applied Science, University of Ontario Institute of Technology, 2000 Simcoe Street North, Oshawa, Ontario, Canada L1H 7K4 (Canada); Naterer, G.F., E-mail: greg.naterer@uoit.ca [Faculty of Engineering and Applied Science, University of Ontario Institute of Technology, 2000 Simcoe Street North, Oshawa, Ontario, Canada L1H 7K4 (Canada); Gabriel, K. [Faculty of Engineering and Applied Science, University of Ontario Institute of Technology, 2000 Simcoe Street North, Oshawa, Ontario, Canada L1H 7K4 (Canada)

    2011-09-20

    Highlights: {yields} This paper examines the reverse reactions associated with copper oxychloride decomposition in the copper-chlorine cycle of hydrogen production. {yields} Experiments are designed to disperse oxygen gas into a molten CuCl bath to study its reaction at 450-500 {sup o}C and the composition of the products is quantified with X-ray diffraction measurements. {yields} It is found that the optimal operating parameters for minimizing the reverse reaction lie in the pressure range of 1-2 bar and a temperature range of 500-525 {sup o}C. - Abstract: The thermochemical copper-chlorine (Cu-Cl) cycle for hydrogen production includes three chemical reactions of hydrolysis, decomposition and electrolysis. The decomposition of copper oxychloride for oxygen production establishes the high-temperature limit of the cycle. At 450-530 {sup o}C, copper oxychloride (Cu{sub 2}OCl{sub 2}) decomposes to produce a molten salt of cuprous chloride (CuCl, copper I chloride) and oxygen gas. Minimization of the reverse reaction and undesirable products is critical for the proper operation of the Cu-Cl cycle. This paper examines the operating conditions that disfavor the reverse reaction of the oxygen production, and the parameters that maximize the extent of the forward reaction. Experiments were designed to disperse oxygen gas into a molten CuCl bath to study its reaction at 450-500 {sup o}C. The composition of the products was quantified with X-ray diffraction measurements. Experimental results indicate that a high decomposition extent of copper oxychloride is obtained at equilibrium when the temperature is higher than 500 {sup o}C, and the oxygen pressure is below 2 bar. The thermochemistry data of the reactants and products were also determined and reported. These thermodynamic data provide a key missing gap in the understanding of the Cu-Cl cycle of thermochemical hydrogen production. The data includes the standard formation entropy, enthalpy and Gibbs free energy at

  18. Remarks on correlators of Polyakov Loops

    CERN Document Server

    Neuberger, Herbert

    2013-01-01

    Polyakov loop eigenvalues and their N-dependence are studied in 2 and 4 dimensional SU(N) YM theory. The connected correlation function of the single eigenvalue distributions of two separated Polyakov loops in 2D YM is calculated and is found to have a structure differing from the one of corresponding hermitian random matrix ensembles. No large $N$ non-analyticities are found for two point functions in the confining regime. Suggestions are made for situations in which large-N phase transitions involving Polyakov loops might occur.

  19. A study of the photocatalytic effects of aqueous suspensions of platinized semiconductor materials on the reaction rates of candidate redox reactions

    Science.gov (United States)

    Miles, A. M.

    1982-01-01

    The effectiveness of powdered semiconductor materials in photocatalyzing candidate redox reactions was investigated. The rate of the photocatalyzed oxidation of cyanide at platinized TiO2 was studied. The extent of the cyanide reaction was followed directly using an electroanalytical method (i.e. differential pulse polarography). Experiments were performed in natural or artificial light. A comparison was made of kinetic data obtained for photocatalysis at platinized powders with rate data for nonplatinized powders.

  20. Mitotic chromosome compaction via active loop extrusion

    Science.gov (United States)

    Goloborodko, Anton; Imakaev, Maxim; Marko, John; Mirny, Leonid; MIT-Northwestern Team

    During cell division, two copies of each chromosome are segregated from each other and compacted more than hundred-fold into the canonical X-shaped structures. According to earlier microscopic observations and the recent Hi-C study, chromosomes are compacted into arrays of consecutive loops of ~100 kilobases. Mechanisms that lead to formation of such loop arrays are largely unknown. Here we propose that, during cell division, chromosomes can be compacted by enzymes that extrude loops on chromatin fibers. First, we use computer simulations and analytical modeling to show that a system of loop-extruding enzymes on a chromatin fiber self-organizes into an array of consecutive dynamic loops. Second, we model the process of loop extrusion in 3D and show that, coupled with the topo II strand-passing activity, it leads to robust compaction and segregation of sister chromatids. This mechanism of chromosomal condensation and segregation does not require additional proteins or specific DNA markup and is robust against variations in the number and properties of such loop extruding enzymes. Work at NU was supported by the NSF through Grants DMR-1206868 and MCB-1022117, and by the NIH through Grants GM105847 and CA193419. Work at MIT was supported by the NIH through Grants GM114190 R01HG003143.