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Sample records for photonuclear reaction yields

  1. Systematization of the yields of products of photonuclear reactions on enriched-tin targets at the bremsstrahlung-photon endpoint energy of 4.5 GeV

    SciTech Connect

    Balabekyan, A. R.

    2008-11-15

    Yields of photonuclear-reaction products formed in targets from separated tin isotopes under the effect of beams of bremsstrahlung photons whose endpoint energy is 4.5 GeV were investigated. The systematization performed on this basis revealed an isoscaling character of the behavior of the production yields for various regions of reaction-product masses.

  2. Photonuclear reactions: Past, present, and future

    SciTech Connect

    Pietralla, N.

    2012-07-09

    This contribution is supposed to provide an introduction to the discussion of future research opportunities at the planned {gamma}-ray beam of the ELI-Nuclear Physics pillar. It contains a brief overview on the history of photonuclear science, some fundamental facts on photonuclear reactions at energies below 20 MeV, a few examples for recent photonuclear research, and a brief outlook to a future with ELI-NP.

  3. Measurements of high-energy photonuclear reaction yields in the 2.5 GeV electron beam stop

    NASA Astrophysics Data System (ADS)

    Sato, Tatsuhiko; Shin, Kazuo; Ban, Syuichi; Namito, Yoshihito; Nakamura, Hajime; Hirayama, Hideo

    1997-02-01

    Measurements were made for radioactive nuclide yields formed in Al, Fe, Cu and Nb foils by the irradiation of bremsstrahlung generated by ˜2.5 GeV electrons. The foils were inserted in a Cu beam stop and irradiated by electrons. For a comparison, calculations of the yields were carried out. The photon energy spectrum obtained by the EGS4 code was multiplied by the photonuclear cross sections evaluated by the PICA code at photon energies below 350 MeV, and by Rudstam's formula at higher energies above 350 MeV. It was found that the calculated values tended to overestimate the measured ones, especially for nuclides whose mass was moderately far from that of target nuclide.

  4. Studying photonuclear reactions using the activation technique

    NASA Astrophysics Data System (ADS)

    Belyshev, S. S.; Ermakov, A. N.; Ishkhanov, B. S.; Khankin, V. V.; Kurilik, A. S.; Kuznetsov, A. A.; Shvedunov, V. I.; Stopani, K. A.

    2014-05-01

    The experimental setup that is used at the Skobeltsyn Institute of Nuclear Physics of the Moscow State University to study photonuclear reactions using the activation technique is described. The system is based on two modern compact race track microtrons with maximum energy of electrons of up to 55 and 67.7 MeV. A low-background HPGe detector is used to measure the induced gamma activity. The data acquisition and analysis system, used to process the measured spectra, is described. The described system is used to study multiparticle photonuclear reactions and production of nuclei far from the beta stability region.

  5. Photonuclear reactions on titanium isotopes

    SciTech Connect

    Belyshev, S. S.; Dzhilavyan, L. Z.; Ishkhanov, B. S.; Kapitonov, I. M.; Kuznetsov, A. A. Orlin, V. N.; Stopani, K. A.

    2015-03-15

    The photodisintegration of titanium isotopes in the giant-dipole-resonance energy region is studied by the photon-activation method. Bremsstrahlung photons whose spectrum has the endpoint energy of 55 MeV is used. The yields and integrated cross sections are determined for photoproton reactions on the titanium isotopes {sup 47,48,49,50}Ti. The respective experimental results are compared with their counterparts calculated on the basis of the TALYS code and a combined photonucleon-reaction model. The TALYS code disregards the isospin structure of the giant dipole resonance and is therefore unable to describe the yield of photoproton reactions on the heavy titanium isotopes {sup 49,50}Ti.

  6. ''Yields of Radionuclides Created by Photonuclear Reactions on Be, C, Na, C1, and Ge, Using Bremsstrahlung of 150-MeV Electrons''

    SciTech Connect

    Dickens, J.K.

    2001-12-13

    The bremsstrahlung created by 150-MeV electrons impinging on a tantalum radiator was used to study photonuclear reactions on samples containing Be, C, Na, Cl and Ge. For Ge fifteen radioisotopes, ranging in half life between 2.6 min and 271 days, and in mass between 65 and 75, were obtained in sufficient amount to determine their yields quantitatively using known decay gamma-rays. Special equipment is described which was developed to create the bremsstrahlung using a beam-sharing mode, while minimizing the neutron flux on the sample. Relative production rates were determined. These were analyzed to provide absolute average cross sections for production of three reactions: <{sigma}> for {sup 35}Cl({gamma}, n) {sup 34}Cl{sup isom}- = 4.7 mb; <{sigma}> for {sup 70}Ge({gamma}, n){sup 69}Ge = 56 mb; and <{sigma}> for {sup 76}Ge({gamma}, n){sup 75}Ge = 53 mb, where the ({gamma}, n) values are averages over the giant resonances of the stable target isotopes.

  7. Energy calibration of a linear accelerator with photonuclear reactions

    SciTech Connect

    St. George, F.; Anderson, D.W.

    1982-05-01

    Photonuclear reactions have been used to calibrate the energy of a Sagittaire clinical electron accelerator between 10 and 30 MeV. Thresholds at 10.8 MeV for the /sup 63/Cu(..gamma..,n)/sup 62/Cu reaction and 29.7 MeV for the /sup 32/S(..gamma..,3p)/sup 29/Al reaction provided two energy points. The break in the /sup 16/O(..gamma..,n)/sup 15/O activation yield curve at 17.3 MeV was determined as an intermediate point. The relationship between electron kinetic enegy and current through the energy-analyzing magnet was found to be linear within 1.0% in this energy range.

  8. Calculation of two-neutron multiplicity in photonuclear reactions

    NASA Technical Reports Server (NTRS)

    Norbury, John W.; Townsend, Lawrence W.

    1989-01-01

    The most important particle emission processes for electromagnetic excitations in nucleus-nucleus collisions are the ejection of single neutrons and protons and also pairs of neutrons and protons. Methods are presented for calculating two-neutron emission cross sections in photonuclear reactions. The results are in a form suitable for application to nucleus-nucleus reactions.

  9. Calculation of two-neutron multiplicity in photonuclear reactions

    NASA Technical Reports Server (NTRS)

    Norbury, John W.; Townsend, Lawrence W.

    1990-01-01

    The most important particle emission processes for electromagnetic excitations in nucleus-nucleus collisions are the ejection of single neutrons and protons and also pairs of neutrons and protons. Methods are presented for calculating two-neutron emission cross sections in photonuclear reactions. The results are in a form suitable for application to nucleus-nucleus reactions.

  10. Efficient initiation of photonuclear reactions using quasimonoenergetic electron beams from laser wakefield acceleration

    SciTech Connect

    Reed, S. A.; Chvykov, V.; Kalintchenko, G.; Matsuoka, T.; Yanovsky, V.; Vane, C. R.; Beene, J. R.; Stracener, D.; Schultz, D. R.; Maksimchuk, A.

    2007-10-01

    Pulses of nearly monoenergetic relativistic electrons have been generated by laser wakefield acceleration and used to perform photonuclear activation of carbon, copper, and photofission in uranium. Using bremsstrahlung converter targets, the electron beams generated by this technique have been shown to be effective in producing high energy {gamma}-rays (tens of MeV) that are necessary to efficiently induce photonuclear reactions. Quantitative {gamma}-ray spectroscopy of the irradiated C, Cu, and U samples indicates that more than 10{sup 5} reactions were produced per joule of laser energy. The activation yield measurements have been compared with Monte Carlo modeling of electromagnetic cascade and photonuclear processes occurring in the targets to infer the characteristics of the laser accelerated electron beams.

  11. Photonuclear reaction to test cluster structure of Lithium

    SciTech Connect

    Akkurt, Iskender

    2008-11-11

    The lithium can be pictured as an {alpha} particle with 2 extra nucleon surrounding it. A photonuclear reaction experiment has been performed to test this structure at Maxlab in Lund-Sweden. The cross-section of the {sup 6}Li({gamma},n) reaction have been measured using TOF methods and the results were compared with results of {sup 6}Li({gamma},p) and also {sup 4}He({gamma},n) reaction.

  12. Proceedings of the Gordon Conference on Photonuclear Reactions

    NASA Astrophysics Data System (ADS)

    This report includes results of cross section measurement of a series of photonuclear reactions carried out by the research team of the School of Physics from Melbourne University using the tagged photon facilities at the Laboratory of Nuclear Research of Tohoku University, Sendai, Japan and the Saskatchewan Accelerator Laboratory of the University of Saskatchewan, Saskatoon, Canada. Planned experiments and a list of the most recent publications are briefly outlined.

  13. Experimental and calculated radionuclide production by photonuclear reactions using Bremsstrahlung photons produced by 150 MeV electrons

    SciTech Connect

    Wunstorf, R.; Bugg, W.M.; Parks, C.C.; Gabriel, T.A.; Lewis, T.A.; Dickens, J.K.

    1994-12-31

    We have developed an experimental apparatus to study radionuclide production by photonuclear reactions. A nearly neutron-free bremsstrahlung beam was created by incident electron interactions with a tantalum radiator. We studied photonuclear reactions in different samples, including the elements Be, Na, Si, Cl, and Ge. Decay gamma rays from radionuclides having half lives > 2 min were analysed. Using the PICA code, we calculated the yield of radionuclides for silicon. We have observed and assigned a new gamma ray transition, of E({gamma}) = 1153 keV, to the decay of 6.6 min 29-Al.

  14. Experimental and calculated radionuclide production by photonuclear reactions using bremsstrahlung photons produced by 150 MeV electrons

    SciTech Connect

    Wunstorf, R.; Bugg, W.M.; Parks, C.C.; Gabriel, T.A.; Lewis, T.A.; Dickens, J.K.

    1995-02-01

    The authors have developed an experimental apparatus to study radionuclide production by photonuclear reactions. A nearly neutron free bremsstrahlung beam was created by incident electron interactions with a tantalum radiator. They studied photonuclear reactions in different samples, including the elements Be, Na, Si, Cl, and Ge. Decay gamma rays from radionuclides having half lives > 2 min were analysed. Using the PICA code, the authors calculated the yield of radionuclides for silicon. They have observed and assigned a new gamma ray transition, of E(y) = 1153 keV, to the decay of 6.6 min 29-Al.

  15. Formation of medical radioisotopes 111In, 117 m Sn, 124Sb, and 177Lu in photonuclear reactions

    NASA Astrophysics Data System (ADS)

    Danagulyan, A. S.; Hovhannisyan, G. H.; Bakhshiyan, T. M.; Avagyan, R. H.; Avetisyan, A. E.; Kerobyan, I. A.; Dallakyan, R. K.

    2015-06-01

    The possibility of the photonuclear production of radioisotopes 111In, 117 m Sn, 124Sb, and 177Lu is discussed. Reaction yields were measured by the gamma-activation method. The enriched tin isotopes 112, 118Sn and Te and HfO2 of natural isotopic composition were used as targets. The targets were irradiated at the linear electron accelerator of Alikhanian National Science Laboratory (Yerevan) at the energy of 40 MeV. The experimental results obtained in this way reveal that the yield and purity of radioisotopes 111In and 117 mSn are acceptable for their production via photonuclear reactions. Reactions proceeding on targets from Te and HfO2 of natural isotopic composition and leading to the formation of 124Sb and 177Lu have small yields and are hardly appropriate for the photoproduction of these radioisotopes even in the case of enriched targets.

  16. Development of the Experimental Photo-Nuclear Reaction Database in Hokkaido University

    NASA Astrophysics Data System (ADS)

    Makinaga, A.

    2015-10-01

    Nuclear databases are important tools to apply nuclear phenomena to various fields of nuclear engineering. It is now recognized that the databases must be further developed for photo-nuclear reaction data for nuclear security, safety and nonproliferation applications. Hokkaido University Nuclear Reaction Data Centre (JCPRG) has contributed to the Experimental Nuclear Reaction Data Library (EXFOR) which is developed by the International Network of Nuclear Reaction Data Centres under coordination by IAEA. We report here on the recent compilation of the nuclear data files for the photonuclear reaction.

  17. JENDL Photonuclear Data File

    SciTech Connect

    Kishida, Norio; Murata, Toru; Asami, Tetsuo; Kosako, Kazuaki; Maki, Kouichi; Harada, Hideo; Lee, Young-Ouk; Chang, Jonghwa; Chiba, Satoshi; Fukahori, Tokio

    2005-05-24

    JENDL Photonuclear Data File 2004 was released in March 2004 and contains the photonuclear data for 68 nuclides from 2H to 237Np. We were proceeding on the evaluation work with the help of theoretical calculations based on statistical nuclear reaction models. The photonuclear cross sections that are to be contained in the file are as follows: photoabsorption cross sections, yield cross sections, and double-differential cross sections for photoneutrons, photoprotons, photodeuterons, phototritons, photo-3He-particles and photoalpha-particles, and isotope production cross sections. For the actinide nuclides, physical quantities related to photofission reactions are also included. The maximum energy of incident photons is 140 MeV, which is the energy at which the pion production channel opens.

  18. Energy Levels and Half-Lives of Gallium Isotopes Obtained by Photo-Nuclear Reaction

    NASA Astrophysics Data System (ADS)

    Dulger, F.; Akkoyun, S.; Bayram, T.; Dapo, H.; Boztosun, I.

    2015-04-01

    We have run an experiment to determine the energy levels and half-lives of Gallium nucleus by using the photonuclear reactions with end-point energy of 18 MeV bremsstrahlung photons, produced by a clinical linear accelerator. As a result of 71Ga(y,n)70Ga and 69Ga(Y,n)68Ga photonuclear reactions, the energy levels and half-lives of 70Ga and 68Ga nuclei have been determined. The results are in good agreement with the literature values.

  19. The ``light-est'' of all Projectiles: Nuclear Structure Studies Using Photonuclear Reactions

    NASA Astrophysics Data System (ADS)

    Pietralla, Norbert

    2014-03-01

    Nuclear reactions induced by photons have had and continue to have a large impact on the course of nuclear physics. Photons interact purely electromagnetically with the atomic nucleus and induce minimal momentum transfer at given excitation energy. Photonuclear reaction processes can be expanded in terms of QED and photonuclear excitations are by far dominated by one-step processes. They allow for a model independent measurement of nuclear observables and, hence, for a clean characterization of effective nuclear forces. Apart from the pioneering photonuclear reactions by Bothe and Gentner in the 1930s, bremsstrahlung has been used most widely as an intense source of gamma-rays for photonuclear reactions from the 1940s until today. The nuclear dipole strength distribution has largely been mapped out at bremsstrahlung facilities. While the continuous-energy distribution of bremsstrahlung photons offers a complete view of the spectrum of photonuclear excitations, it suffers from a poor sensitivity to specific energy intervals. Intense, energy-tunable, quasi-monochromatic gamma-ray beams from laser-Compton backscattering processes have revolutionized the field of photonuclear reactions for the last ten years. A set of new techniques is under development and new information on fundamental nuclear modes, such as the IVGDR, IVGQR, Pygmy Dipole Resonance, and the Scissors Mode, has recently been obtained. We will attempt to give a brief overview of the state of the art and dare an outlook at the research opportunities at the next generation of gamma-ray facilities under construction in the U.S. and Europe. Supported by the DFG under grant No. SFB634.

  20. Chromium and titanium isotopes produced in photonuclear reactions of vanadium, revisited

    NASA Astrophysics Data System (ADS)

    Sakamoto, K.; Yoshida, M.; Kubota, Y.; Fukasawa, T.; Kunugise, A.; Hamajima, Y.; Shibata, S.; Fujiwara, I.

    1989-10-01

    Photonuclear production yields of 51Ti und 51,49,48Cr from 51V were redetermined for bremsstrahlung end-point energies ( E0) of 30 to 1000 or 1050 MeV with the aid of radiochemical separation of Cr. The yield curves for 51Ti, 51Cr, 49Cr and 48Cr show a clear evidence for two components in the production process; one tor secondary-proton reactions at E0 < Qπ and the other for photopion reactions, at E0 > Q, Qπ being Q-values for (γ, π +) and ( γ, π+xn) reactions. The contributions of the secondary reactions for production of the Ti and Cr isotopes at E0 > Qπ were then estimated by fitting calculated secondary yields to the observed ones at E0 < Qπ, and found to be about 40%, 20%, 4% and 4% for 51Ti, 51Cr, 49Cr and 48Cr, respectively, at E0 = 400 to 1000 MeV. The calculation of the secondary yields was based on the excitation functions for 51V(n, p) and (p, x'n) calculated with the ALICE code and the reported photoneutron and photoproton spectra from 12C and some other complex nuclei. The present results for 49Cr are close to the reported ones, while the present 48Cr yields differ by a factor of about 50. For the 51Ti and 51Cr yields, there are some discrepancies between the present and reported ones. The yield corrected for the secondaries, in units of μb/equivalent quantum, were unfolded into cross sections per photon, in units of μb, as a function ol monochromatic photon energy with the LOUHI-82 code. The results for the 51Ti and 49Cr are in disagreement in both the magnitude and shape with the theoretical predictions based on DWIA and PWIA. A Monte Carlo calculation based on the PICA code by Gabriel and Alsmiller does reproduce the gross feature of the present results.

  1. Calculation of photo-nuclear reaction cross sections for 16O

    NASA Astrophysics Data System (ADS)

    Arasoglu, Ali; Faruk Ozdemir, Omer

    2015-07-01

    Because of the high thermal expansion coefficient of uranium, the fuel used in nuclear power plants is usually in the form of UO2 which has ceramic structure and small thermal expansion coefficient. UO2 include one uranium atom and two oxygen atoms. After fission progress, total energy values of emitted gamma are about 14 MeV. This gamma energy may cause transmutation of 16O isotopes. Transmutation of 16O isotopes changes physical properties of nuclear fuel. Due to above explanations, it is very important to calculate photo-nuclear reaction cross sections of 16O. In this study; for (γ,p), (γ,np), (γ,n) and (γ,2n) reactions of 16O, photo-nuclear reaction cross-sections were calculated using different models for pre-equilibrium and equilibrium effects. Taking incident gamma energy values up to 40 MeV, Hybrid and Cascade Exciton Models were used for pre-equilibrium calculations and Weisskopf-Ewing (Equilibrium) Model was used for equilibrium model calculations. Calculation results were compared with experimental and theoretical data. While experimental results were obtained from EXFOR, TENDL-2013, JENDL/PD-2004 and ENDF/B VII.1 data base were used to get theoretical results.

  2. Photonuclear reaction data and γ-ray sources for astrophysics

    NASA Astrophysics Data System (ADS)

    Utsunomiya, H.; Goko, S.; Toyokawa, H.; Ohgaki, H.; Soutome, K.; Yonehara, H.; Goriely, S.; Mohr, P.; Fülöp, Zs.

    2006-03-01

    Direct determination of photoneutron cross sections of astrophysical importance has recently become possible with use of quasi-monochromatic γ beams produced in laser Compton backscattering (LCS) from relativistic electrons at AIST. The astrophysics to be discussed with the photodisintegration cross section are both stellar and big bang nucleosyntheses regarding the production of p-process and s-process nuclei as well as light elements. Synchrotron radiations from a 10 tesla superconducting wiggler (SCW) at SPring-8 serve as an ideal photon source to determine photoreaction rates. This paper covers the latest cross section measurements with the LCS photon beams and a feasibility study of determining (γ, x) (x = n, p,α) reaction rates with the SCW radiation.

  3. Production of the (I = 19/2) high-spin isomer {sup 135}Cs in photonuclear reactions

    SciTech Connect

    Gangrsky, Yu. P.; Zhemenik, V. I.; Kolesnikov, N. N.; Lukashik, V. G.; Markov, B. N.; Myshinskiy, G. V.; Maslov, O. D.; Bozhikov, G. A.

    2010-09-15

    The yields of {sup 135}Cs nuclei in a high-spin (19/2) isomeric state and of nuclei neighboring it were measured for photonuclear reactions of the ({gamma}, f) and ({gamma}, {alpha}) types. The experiments in question were performed by using bremsstrahlung from a microtron at the maximum electron energy of 25 MeV. The product nuclei were identified by their half-lives and by the lines of gamma radiation emitted in their decay, and the reaction yields R were determined by the ratios of the intensities of these lines to the bremsstrahlung flux. The cross sections for isomer production were calculated, and the angular momenta of product nuclei immediately before the cascade of gamma transitions populating the ground or an isomeric nuclear state were evaluated on the basis of these results. An enhanced yield of the high-spin isomer of {sup 135}Cs in the fission reaction in relation to the respective ({gamma}, {alpha}) reaction and in relation to the results of the calculations is found.

  4. Photonuclear and radiative capture reaction rates for Nuclear Astrophysics

    NASA Astrophysics Data System (ADS)

    Beard, Mary; Frauendorf, S.; Kaempfer, B.; Scwengner, R.; Wiescher, M.

    2011-10-01

    The vast majority of nuclei heavier than iron are synthesisized via the capture of neutrons. There are however 35 naturally occurring nuclei, including isotopes of Mo and La, located on the neutron-deficient size of the valley of stability. It has been proposed that these nuclei, referred to as p-nuclei, are produced via sequential photo-dissociation reactions in the oxygen-neon shell burning regions of a pre-supernova star. As such, cross sections for p-nuclei production are particularly sensitive to the gamma-ray strength function, which, though dominated by the giant dipole resonance, may contain extra strength contributions near to the neutron threshold. Recently new (γ, γ') cross section measurements have been performed at the ELBE facility at Helmholtz-Zentrum Dresden-Rossendorf for the nuclei ^92-100Mo, ^88Sr, ^90Zr and ^139La probing the photo-absorption cross section over an energy range 4.5 - 6 MeV, up to the neutron separation threshold. The use of these measurements as a test of existing gamma-ray strength function models, and the consequent impact on p-nuclei production rates, will be discussed.

  5. Photonuclear reactions of actinide and pre-actinide nuclei at intermediate energies

    SciTech Connect

    Mukhopadhyay, Tapan; Basu, D. N.

    2007-12-15

    Photonuclear reaction is described with an approach based on the quasideuteron nuclear photoabsorption model followed by the process of competition between light particle evaporation and fission for the excited nucleus. Thus fission process is considered as a decay mode. The evaporation-fission process of the compound nucleus is simulated in a Monte Carlo framework. Photofission reaction cross sections are analysed in a systematic manner in the energy range {approx}50-70 MeV for the actinides {sup 232}Th, {sup 233}U, {sup 235}U, {sup 238}U, and {sup 237}Np and the pre-actinide nuclei {sup 208}Pb and {sup 209}Bi. The study reproduces satisfactorily well the available experimental data of photofission cross sections at energies {approx}50-70 MeV and the increasing trend of nuclear fissility with the fissility parameter Z{sup 2}/A for the actinides and pre-actinides at intermediate energies ({approx}20-140 MeV)

  6. High energy electrons, positrons and photonuclear reactions in petawatt laser-solid experiments

    SciTech Connect

    Cowan, T E; Hunt, A W; Johnson, J; Perry, M D; Fountain, W; Hatchett, S; Key, M H; Kuehl, T; Parnell, T; Pennington, D M; Phillips, T W; Roth, M; Takahashi, Y; Wilks, S C

    1999-09-09

    The Petawatt laser at LLNL has opened a new regime of high-energy laser-matter interactions in which the quiver motion of plasma electrons is fully relativistic with energies extending well above the threshold for nuclear processes. We have observed that, in addition to the large flux of several MeV electrons ponderomotively expelled from the ultra-intense laser focus, there is a high energy component of electrons extending to -100 MeV, apparently from relativistic self-focusing and plasma acceleration in the underdense pre-formed plasma. The generation of hard bremsstrahlung cascade as these electrons traverse the solid target material, and the resulting photo-nuclear reactions, nuclear fission, and positron-electron pair production are described.

  7. Formation of medical radioisotopes {sup 111}In, {sup 117m}Sn, {sup 124}Sb, and {sup 177}Lu in photonuclear reactions

    SciTech Connect

    Danagulyan, A. S.; Hovhannisyan, G. H. Bakhshiyan, T. M.; Avagyan, R. H.; Avetisyan, A. E.; Kerobyan, I. A.; Dallakyan, R. K.

    2015-06-15

    The possibility of the photonuclear production of radioisotopes {sup 111}In, {sup 117m}Sn, {sup 124}Sb, and {sup 177}Lu is discussed. Reaction yields were measured by the gamma-activation method. The enriched tin isotopes {sup 112,} {sup 118}Sn and Te and HfO{sub 2} of natural isotopic composition were used as targets. The targets were irradiated at the linear electron accelerator of Alikhanian National Science Laboratory (Yerevan) at the energy of 40 MeV. The experimental results obtained in this way reveal that the yield and purity of radioisotopes {sup 111}In and {sup 117}mSn are acceptable for their production via photonuclear reactions. Reactions proceeding on targets from Te and HfO{sub 2} of natural isotopic composition and leading to the formation of {sup 124}Sb and {sup 177}Lu have small yields and are hardly appropriate for the photoproduction of these radioisotopes even in the case of enriched targets.

  8. Photonuclear Studies for the Isomeric Yield Ratios in the Production of natFe(γ,xnp)52m,gMn with 50-,60-, and 70-MeV Bremsstrahlung

    NASA Astrophysics Data System (ADS)

    Shakilur Rahman, Md.; Kim, Guinyun; Kim, Kyung-Sook; Lee, Manwoo; Moinul Haque Meaze, A. K. M.

    2016-02-01

    The isomeric yield ratios in the production of natFe(γ,xnp)52m,gMn have been measured with photonuclear reactions. The high purity natural Fe metallic foils were used and irradiated with bremsstrahlung beams of end point energy 50-, 60-, and 70-MeV. The bremsstrahlung beams are produced with high energy electron beam struck with 0.1mm thin tungsten target. The activation method has been used and hence the induced activities in the irradiated foils were measured by off-line γ-ray spectrometric technique using HPGe detector coupled to a PC-based 4K MCA. The experimental values of isomeric ratios are compared with the theoretical values by statistical model code TALYS. The detail of the formation of isomers by photonuclear reactions together with the literature values of the investigated nuclides are compared and discussed.

  9. Energy level and half-life determinations from photonuclear reaction on Ga target

    NASA Astrophysics Data System (ADS)

    Akkoyun, Serkan; Bayram, Tuncay; Dulger, Fatih; Đapo, Haris; Boztosun, Ismail

    2016-06-01

    Photonuclear reactions are important tools in the understanding of the nucleus. These reactions are also interesting for realizing the element creation processes in stellar environment. The use of bremsstrahlung photons generated from clinic linear accelerator is practical for performing these type of reactions. In this study, the bremsstrahlung photons with endpoint energy of 18MeV have been used for activating gallium target material. After irradiation, the transition energies and half-lives associated with the decay of 68Ga, 70Ga and 72Ga isotopes have been determined The values obtained for half-life of 68Ga, 70Ga and 72Ga isotopes are 67.5±0.9min, 21.1±0.9min and 13.8±0.4h, respectively. It has been seen that the values are consistent with the present literature values. In addition, the new measurements of gamma-ray energies for transition energies have been obtained comparable to the literature values with good uncertainties.

  10. Yields of photoneutron reactions on {sup 197}Au nuclei in the giant-dipole-resonance region

    SciTech Connect

    Belyshev, S. S.; Ermakov, A. N.; Ishkhanov, B. S.; Kuznetsov, A. A.; Kurilik, A. S.; Stopani, K. A.; Troschiev, S. Yu.

    2011-11-15

    Yields of photonuclear reactions on 197Au nuclei were measured in a beam of bremsstrahlung photons, the endpoint energy of the bremsstrahlung spectrum being 29.1 MeV. These measurements were performed by means of the gamma-activation procedure. The results obtained in this way were compared with the results of earlier experiments and theoretical calculations.

  11. Using a clinical linac to determine the energy levels of (92m)Nb via the photonuclear reaction.

    PubMed

    Aygun, M; Cesur, A; Dogru, M; Boztosun, I; Dapo, H; Kanarya, M; Kuluozturk, M F; Bal, S S; Karatepe, S

    2016-09-01

    The bremsstrahlung photons of 18MeV end-point energy produced by a clinical linear accelerator were used to irradiate (93)Nb, producing (92m)Nb via the photonuclear reaction. The gamma-ray spectrum emitted by the excited nucleus was measured with high purity germanium detector. For analysis of the energy transitions, both gf3 and ROOT spectrum analysis programs were applied. The results were shown to be comparable with the literature values, demonstrating the ability to use a clinical liner accelerator in nuclear physics measurements. PMID:27344005

  12. Photonuclear absorption cross sections

    NASA Technical Reports Server (NTRS)

    Norbury, John W.

    1989-01-01

    Neutron multiplicity in photonuclear reactions; invariance of classical electromagnetism; momentum transfer models in ion collisions; cosmic ray electromagnetic interactions; quadrupole excitations in nucleus-nucleus collisons and Y-89 interactions with relativistic nuclei; and the Weizsacker-Williams theory for nucleon emission via electromagnetic excitations in nucleus-nucleus collisions are discussed.

  13. Laser Wakefield Acceleration of High-Quality Electron Beams to 300 MeV and Efficient Initiation of Photonuclear Reactions

    SciTech Connect

    Reed, S. A.; Naumova, N.; Vane, C Randy; Beene, James R; Bulanov, S. S.; Chvykov, V.; Hou, B.; Kalintchenko, G.; Matsuoka, T.; Rousseau, P.; Schultz, David Robert; Stracener, Daniel W; Yanovsky, V.; Maksimchuk, A.

    2006-11-01

    By focusing 40-TW, 30-fs laser pulses to the intensity of 1019 W/cm2 onto a supersonic He gas jet, we generated quasi-monoenergetic electron beams for plasma density in the narrow range of 1.5<= ne <=3 1019 cm3. We show that the energy, charge, divergence and pointing stability of the beam vary sensitively with ne within this range. The observed variations can be explained physically by the interplay among pump depletion and dephasing between accelerated electrons and plasma wave. An optimized quasi-monoenergetic beam of over 300 MeV and 10 mrad angular divergence is demonstrated at a plasma density of ne~1.5 1019 cm3. The quasi-monoenergeic electron beams with energy of 100-150 MeV and charge of 0.5 nC have been used to perform gamma-nuclear photofission of natural uranium targets. Through bremsstrahlung emission, such electron beams are well suited for the efficient generation of high energy (tens of MeV) gamma-rays necessary to induce photofission reactions. Quantitative gamma-ray spectroscopy of the irradiated U sample shows that more than ~105 photonuclear reactions have been produced per Joule of laser energy, which is 10 to 50 times higher than in a previously reported experiments

  14. Laser Wakefield Acceleration of High-Quality Electron Beams to 300 MeV and Efficient Initiation of Photonuclear Reactions

    SciTech Connect

    Reed, S. A.; Naumova, N.; Bulanov, S. S.; Chvykov, V.; Hou, B.; Kalintchenko, G.; Matsuoka, T.; Rousseau, P.; Yanovsky, V.; Maksimchuk, A.; Vane, C. R.; Beene, J. R.; Schultz, D. R.; Stracener, D. W.

    2006-11-27

    By focusing 40-TW, 30-fs laser pulses to the intensity of 1019 W/cm2 onto a supersonic He gas jet, we generated quasi-monoenergetic electron beams for plasma density in the narrow range of 1.5{<=} ne {<=}3x1019 cm3. We show that the energy, charge, divergence and pointing stability of the beam vary sensitively with ne within this range. The observed variations can be explained physically by the interplay among pump depletion and dephasing between accelerated electrons and plasma wave. An optimized quasi-monoenergetic beam of over 300 MeV and 10 mrad angular divergence is demonstrated at a plasma density of ne{approx}1.5x1019 cm3. The quasi-monoenergeic electron beams with energy of 100-150 MeV and charge of 0.5 nC have been used to perform {gamma}-nuclear photofission of natural uranium targets. Through bremsstrahlung emission, such electron beams are well suited for the efficient generation of high energy (tens of MeV) {gamma}-rays necessary to induce photofission reactions. Quantitative {gamma}-ray spectroscopy of the irradiated U sample shows that more than {approx}105 photonuclear reactions have been produced per Joule of laser energy, which is 10 to 50 times higher than in a previously reported experiments.

  15. Production of medical radioisotopes with high specific activity in photonuclear reactions with γ-beams of high intensity and large brilliance

    NASA Astrophysics Data System (ADS)

    Habs, D.; Köster, U.

    2011-05-01

    We study the production of radioisotopes for nuclear medicine in ( γ, xn+ yp) photonuclear reactions or ( γ, γ') photoexcitation reactions with high-flux [(1013-1015) γ/s], small diameter ˜(100 μm)2 and small bandwidth (Δ E/ E≈10-3-10-4) γ beams produced by Compton back-scattering of laser light from relativistic brilliant electron beams. We compare them to (ion, xn+ yp) reactions with (ion = p,d, α) from particle accelerators like cyclotrons and (n, γ) or (n,f) reactions from nuclear reactors. For photonuclear reactions with a narrow γ-beam the energy deposition in the target can be managed by using a stack of thin target foils or wires, hence avoiding direct stopping of the Compton and pair electrons (positrons). However, for ions with a strong atomic stopping only a fraction of less than 10-2 leads to nuclear reactions resulting in a target heating, which is at least 105 times larger per produced radioactive ion and often limits the achievable activity. In photonuclear reactions the well defined initial excitation energy of the compound nucleus leads to a small number of reaction channels and enables new combinations of target isotope and final radioisotope. The narrow bandwidth γ excitation may make use of the fine structure of the Pygmy Dipole Resonance (PDR) or fluctuations in γ-width leading to increased cross sections. Within a rather short period compared to the isotopic half-life, a target area of the order of (100 μm)2 can be highly transmuted, resulting in a very high specific activity. ( γ, γ') isomer production via specially selected γ cascades allows to produce high specific activity in multiple excitations, where no back-pumping of the isomer to the ground state occurs. We discuss in detail many specific radioisotopes for diagnostics and therapy applications. Photonuclear reactions with γ-beams allow to produce certain radioisotopes, e.g. 47Sc, 44Ti, 67Cu, 103Pd, 117 m Sn, 169Er, 195 m Pt or 225Ac, with higher specific activity

  16. Photonuclear Reaction Studies at HIγS: Developing the Science of Remote Detection of Nuclear Materials

    NASA Astrophysics Data System (ADS)

    Howell, C. R.

    2015-10-01

    Development of gamma-ray beam interrogation technologies for remote detection of special nuclear materials and isotope analysis requires comprehensive databases of nuclear structure information and gamma-ray induced nuclear reaction observables. Relevant nuclear structure details include the energy, spin and parity of excited states that have significant probability for electromagnetic transition from the ground state, i.e, the angular momentum transferred in the reaction is Δl ≤ 2. This talk will report recent Nuclear Resonance Fluorescence (NRF) measurements to identify and characterize new low-spin states in actinide nuclei at energies from 1 to 4 MeV, which is the energy range most important for remote analysis methods. These measurements are carried out using the nearly mono-energetic linearly polarized gamma-ray beam at the High Intensity Gamma-ray Source (HIγS) at the Triangle Universities Nuclear Laboratory. Also, studies of the (γ, n) reaction on a variety of nuclei with linearly polarized beams at HIγS indicate that this reaction might be used to discern between fissile and non-fissile materials. This work will be described. In addition, an overview will be given of a concept for a next generation laser Compton-backing scattering gamma-ray source to be implemented as an upgrade to increase the beam intensity at HIγS by more than an order of magnitude.

  17. Simplest photonuclear reactions accompanied by the excitation of isovector giant dipole and quadrupole resonances: Semimicroscopic description

    SciTech Connect

    Tulupov, B. A.; Urin, M. H.

    2012-09-15

    A semimicroscopic approach based on the continuum version of the random-phase approximation (CRPA) and on a semiphenomenological inclusion of the fragmentation effect is applied to describing cross sections for photoabsorption and direct plus semidirect and inverse reactions accompanied by the excitation of isovector giant dipole and quadrupole resonances. In addition to the spinless part of the Landau-Migdal interaction and a partly self-consistent phenomenological mean field of the nucleus, that version of the approach which is used here takes into account isovector separable velocity-dependent forces, as well as the effect of the fragmentation shift of the giant-resonance energy. The results obtained by calculating various features of the aforementioned cross sections for a number of magic and semimagic medium-mass nuclei are compared with respective experimental data.

  18. Photonuclear Benchmarks with a Comparison of COG and MCNPX Results

    SciTech Connect

    Heinrichs, D P; Lent, E M

    2003-10-20

    The Nuclear Data Section of the International Atomic Energy Agency (IAEA) has distributed an evaluated photonuclear data library in standard ENDF-6 format that is intended for use in transport codes. This ''IAEA Photonuclear Data Library'' consists of a number of individual ASCII text files for various elements that have been recently processed into the single binary (COG data library) file ''COGPNUC'' with corresponding changes to the COG code for use in transport calculations involving photonuclear reactions.

  19. Photonuclear reaction based high-energy x-ray spectrometer to cover from 2 MeV to 20 MeV

    SciTech Connect

    Sakata, S. Arikawa, Y.; Kojima, S.; Ikenouchi, T.; Nagai, T.; Abe, Y.; Inoue, H.; Morace, A.; Utsugi, M.; Nishimura, H.; Nakai, M.; Shiraga, H.; Fujioka, S.; Azechi, H.; Kato, R.

    2014-11-15

    A photonuclear-reaction-based hard x-ray spectrometer is developed to measure the number and energy spectrum of fast electrons generated by interactions between plasma and intense laser light. In this spectrometer, x-rays are converted to neutrons through photonuclear reactions, and the neutrons are counted with a bubble detector that is insensitive to x-rays. The spectrometer consists of a bundle of hard x-ray detectors that respond to different photon-energy ranges. Proof-of-principle experiment was performed on a linear accelerator facility. A quasi-monoenergetic electron bunch (N{sub e} = 1.0 × 10{sup −6} C, E{sub e} = 16 ± 0.32 MeV) was injected into a 5-mm-thick lead plate. Bremsstrahlung x-rays, which emanate from the lead plate, were measured with the spectrometer. The measured spectral shape and intensity agree fairly well with those computed with a Monte Carlo simulation code. The result shows that high-energy x-rays can be measured absolutely with a photon-counting accuracy of 50%–70% in the energy range from 2 MeV to 20 MeV with a spectral resolution (Δhν/hν) of about 15%. Quantum efficiency of this spectrometer was designed to be 10{sup −7}, 10{sup −4}, 10{sup −5}, respectively, for 2–10, 11–15, and 15–25 MeV of photon energy ranges.

  20. Recoil studies of photonuclear reactions on natCu, natAg, natTa, and 197Au at intermediate energies

    NASA Astrophysics Data System (ADS)

    Fujiwara, I.; Haba, H.; Matsumura, H.; Sakamoto, K.; Miyamoto, Y.; Oura, Y.; Shibata, S.; Furukawa, M.

    1999-01-01

    The recoil properties of nuclides produced in the photonuclear reactions on natCu, natAg, natTa, and 197Au induced by bremsstrahlung of end-point energies (E o) of 250 to 1000 MeV have been investigated using the thick-target thick-catcher method. The obtained mean ranges of produced nuclides smoothly increase with an increase of the mass difference (ΔA) between products and target, and show E 0-independence at E 0≥600 MeV, reflecting the limiting behavior above (3, 3) resonance region. The mean kinetic energies, T, deduced from the mean ranges show the following two components; (1) (γ, xn) products by giant-resonance and/or quasi-deuteron resonance absorption, (2) (γ, xnyp) products by mainly (3, 3) resonance absorption. Slightly rapid increase of T was found around ΔA=15, 18, 24, and 25 for natCu, natAg, natTa and 197Au, respectively, reflecting a change in mechanism. Kinematic properties of the product nuclei were calculated by using the PICA (Photon-Induced Intranuclear Cascade Analysis) code. The T calculated by the PICA code at E 0=400 MeV well reproduced the experimental results of natCu, but the same calculation for natAg, natTa, and 197Au gave lower mean kinetic energies than the experimental results.

  1. Recoil studies of photonuclear reactions on natCu, natAg, natTa, and 197Au at intermediate energies

    NASA Astrophysics Data System (ADS)

    Fujiwara, I.; Haba, H.; Matsumura, H.; Sakamoto, K.; Miyamoto, Y.; Oura, Y.; Shibata, S.; Furukawa, M.

    1999-01-01

    The recoil properties of nuclides produced in the photonuclear reactions on natCu, natAg, natTa, and 197Au induced by bremsstrahlung of end-point energies ( E o) of 250 to 1000 MeV have been investigated using the thick-target thick-catcher method. The obtained mean ranges of produced nuclides smoothly increase with an increase of the mass difference (ΔA) between products and target, and show E 0-independence at E 0≥600 MeV, reflecting the limiting behavior above (3, 3) resonance region. The mean kinetic energies, T, deduced from the mean ranges show the following two components; (1) (γ, xn) products by giant-resonance and/or quasi-deuteron resonance absorption, (2) (γ, xnyp) products by mainly (3, 3) resonance absorption. Slightly rapid increase of T was found around ΔA=15, 18, 24, and 25 for natCu, natAg, natTa and 197Au, respectively, reflecting a change in mechanism. Kinematic properties of the product nuclei were calculated by using the PICA (Photon-Induced Intranuclear Cascade Analysis) code. The T calculated by the PICA code at E 0=400 MeV well reproduced the experimental results of natCu, but the same calculation for natAg, natTa, and 197Au gave lower mean kinetic energies than the experimental results.

  2. Product yields of sup 235 U, sup 238 U, sup 237 Np, and sup 239 Pu by photofission reactions with 20-, 30-, and 60-MeV Bremsstrahlung

    SciTech Connect

    Kase, T.; Yamadera, A.; Nakamura, T. ); Shibata, S. ); Fujiwara, I. )

    1992-08-01

    This paper reports that as a basic study of photonuclear transmutation of actinides in high-level radioactive wastes using electron-produced bremsstrahlung, the absolute yields of cumulative mass distributions and the transmutation rate of {sup 235}U, {sup 238}U, {sup 237}Np, and {sup 239}Pu by photofission reactions induced by 20-, 30-, and 60-MeV bremsstrahlung were measured. The results of mass yield distributions and transmutation yields agree well with other experimental results and those calculated using photofission cross sections, respectively. The transmutation efficiency per electron increases about one order of magnitude with electron energy from 20 to 60 MeV.

  3. Resonant photonuclear isotope detection using medium-energy photon beam

    NASA Astrophysics Data System (ADS)

    Ejiri, Hiroyasu; Shima, Tatsushi

    2012-02-01

    Resonant photonuclear isotope detection (RPID) is a nondestructive detection/assay of nuclear isotopes by measuring γ rays following photonuclear reaction products. Medium-energy wideband photons of Eγ=12-16MeV are used for the photonuclear (γ,n) reactions and γ rays characteristic of the reaction products are measured by means of high-sensitivity Ge detectors. Impurities of stable and radioactive isotopes of the orders of μgr—ngr and ppm—ppb are investigated. RPID is used to study nuclear isotopes of astronuclear and particle physics interests and those of geological and historical interests. It is used to identify radioactive isotopes of fission products as well.

  4. Optimization of commercial scale photonuclear production of radioisotopes

    SciTech Connect

    Bindu, K. C.; Harmon, Frank; Starovoitova, Valeriia N.; Stoner, Jon; Wells, Douglas P.

    2013-04-19

    Photonuclear production of radioisotopes driven by bremsstrahlung photons using a linear electron accelerator in the suitable energy range is a promising method for producing radioisotopes. The photonuclear production method is capable of making radioisotopes more conveniently, cheaply and with much less radioactive waste compared to existing methods. Historically, photo-nuclear reactions have not been exploited for isotope production because of the low specific activity that is generally associated with this production process, although the technique is well-known to be capable of producing large quantities of certain radioisotopes. We describe an optimization technique for a set of parameters to maximize specific activity of the final product. This set includes the electron beam energy and current, the end station design (an integrated converter and target as well as cooling system), the purity of materials used, and the activation time. These parameters are mutually dependent and thus their optimization is not trivial. {sup 67}Cu photonuclear production via {sup 68}Zn({gamma}p){sup 67}Cu reaction was used as an example of such an optimization process.

  5. Photonuclear activation of pure isotopic mediums.

    SciTech Connect

    Grohman, Mark A.; Lukosi, Eric Daniel

    2010-06-01

    This work simulated the response of idealized isotopic U-235, U-238, Th-232, and Pu-239 mediums to photonuclear activation with various photon energies. These simulations were conducted using MCNPX version 2.6.0. It was found that photon energies between 14-16 MeV produce the highest response with respect to neutron production rates from all photonuclear reactions. In all cases, Pu-239 responds the highest, followed by U-238. Th-232 produces more overall neutrons at lower photon energies then U-235 when material thickness is above 3.943 centimeters. The time it takes each isotopic material to reach stable neutron production rates in time is directly proportional to the material thickness and stopping power of the medium, where thicker mediums take longer to reach stable neutron production rates and thinner media display a neutron production plateau effect, due to the lack of significant attenuation of the activating photons in the isotopic mediums. At this time, no neutron sensor system has time resolutions capable of verifying these simulations, but various indirect methods are possible and should be explored for verification of these results.

  6. Monte Carlo characterizations mapping of the (γ,n) and (n,γ) photonuclear reactions in the high energy X-ray radiation therapy

    PubMed Central

    Ghiasi, Hosein

    2013-01-01

    Aim The aim of this work was to map the characteristics of (n,γ) and (γ,n) reactions in a high energy photon radiation therapy. Background Photoneutrons produced in the high energy X-Ray radiation therapy may damage patients and staff. It is due to high RBE of the produced neutrons according to their energy and isotropic emission. Characterization of the photoneutrons can help us in appropriate shielding. Materials and methods This study focused on the photoneutron and capture gamma ray phenomena. Characteristics such as dose value, fluence and spectra of both the neutrons and the by produced prompt gamma ray were described. Results and discussion Neutron and prompt gamma spectra in different points showed the neutrons to be thermalized when increasing the distance from the linac. Energy of the neutrons changed from about 0.6 MeV at the isocentre to around 10−08 MeV at the outer door position. Although the neutrons were found as fast neutrons, their spectra showed they were thermal neutrons at the outer door position. Additionally, it was seen that the energy of the gamma rays is higher than the scattered X-ray energy. The energy of gamma rays was seen to be up to 10 MeV while the linac photons had energy lower than 1 MeV. Neutron source strength obtained in this work was in good agreement with the published data, which may be a confirmation of our simulation accuracy. Conclusion The study showed that the Monte Carlo simulation can be applied in the radiotherapy and industrial radiation works as a useful and precise estimator. We also concluded that the dose from the prompt gamma ray at the outer door location is higher than the scattered radiation from the linac and should be considered in the shielding. PMID:24936317

  7. Perspectives for photonuclear research at the Extreme Light Infrastructure - Nuclear Physics (ELI-NP) facility

    NASA Astrophysics Data System (ADS)

    Filipescu, D.; Anzalone, A.; Balabanski, D. L.; Belyshev, S. S.; Camera, F.; La Cognata, M.; Constantin, P.; Csige, L.; Cuong, P. V.; Cwiok, M.; Derya, V.; Dominik, W.; Gai, M.; Gales, S.; Gheorghe, I.; Ishkhanov, B. S.; Krasznahorkay, A.; Kuznetsov, A. A.; Mazzocchi, C.; Orlin, V. N.; Pietralla, N.; Sin, M.; Spitaleri, C.; Stopani, K. A.; Tesileanu, O.; Ur, C. A.; Ursu, I.; Utsunomiya, H.; Varlamov, V. V.; Weller, H. R.; Zamfir, N. V.; Zilges, A.

    2015-12-01

    The perspectives for photonuclear experiments at the new Extreme Light Infrastructure - Nuclear Physics (ELI-NP) facility are discussed in view of the need to accumulate novel and more precise nuclear data. The parameters of the ELI-NP gamma beam system are presented. The emerging experimental program, which will be realized at ELI-NP, is presented. Examples of day-one experiments with the nuclear resonance fluorescence technique, photonuclear reaction measurements, photofission experiments and studies of nuclear collective excitation modes and competition between various decay channels are discussed. The advantages which ELI-NP provides for all these experiments compared to the existing facilities are discussed.

  8. Theory of pulsed Reaction Yield Detected Magnetic Resonance.

    PubMed

    Nasibulov, Egor A; Kulik, Leonid V; Kaptein, Robert; Ivanov, Konstantin L

    2012-10-14

    We propose pulse sequences for Reaction Yield Detected Magnetic Resonance (RYDMR), which are based on refocusing the zero-quantum coherences in radical pairs by non-selective microwave pulses and using the population of a radical pair singlet spin state as an observable. The new experiments are analogues of existing EPR experiments such as the primary echo, Carr-Purcell, ESEEM, stimulated echo and Mims ENDOR. All pulse sequences are supported by analytical results and numerical calculations. The pulse sequences can be used for more efficient and highly detailed characterization of intermediates of chemical reactions and charge carriers in organic semiconductors. PMID:22930135

  9. Weisskopf-Ewing and Hauser-Feshbach calculations of photonuclear cross sections used for electromagnetic dissociation

    NASA Astrophysics Data System (ADS)

    Adamczyk, Anne M.; Norbury, John W.; Townsend, Lawrence W.

    2013-09-01

    The Weisskopf-Ewing (WE) and Hauser-Feshbach (HF) theory are statistical methods, which are often used to calculate photonuclear cross sections for compound nucleus reactions. In our past work, WE methodology was presented and photonuclear reaction cross sections for nucleon emission were calculated using WE theory. Here, our previous results, which neglect pre-equilibrium emissions and do not include multiple particle emission, are compared to those calculated with HF theory and experimental data. For the reactions considered herein, it is found that the WE theory and HF method are in reasonable agreement below the two neutron separation energy assuming an energy dependent branching ratio for intermediate and heavy nuclei. In addition, qualitative confidence of WE theory for electromagnetic dissociation (EMD) cross section calculations was found. The Weisskopf-Ewing (WE) theory is reviewed. Photonuclear cross sections calculated with WE theory are compared to HF predictions. The WE theory and the HF method give similar photonuclear cross sections. Qualitative confidence of WE theory for EMD cross section calculations is found.

  10. Advanced scheme for high-yield laser driven nuclear reactions

    NASA Astrophysics Data System (ADS)

    Margarone, D.; Picciotto, A.; Velyhan, A.; Krasa, J.; Kucharik, M.; Mangione, A.; Szydlowsky, A.; Malinowska, A.; Bertuccio, G.; Shi, Y.; Crivellari, M.; Ullschmied, J.; Bellutti, P.; Korn, G.

    2015-01-01

    The use of a low contrast nanosecond laser pulse with a relatively low intensity (3  ×  1016 W cm-2) allowed the enhancing of the yield of induced nuclear reactions in advanced solid targets. In particular the ‘ultraclean’ proton-boron fusion reaction, producing energetic alpha particles without neutron generation, was chosen. A spatially well-defined layer of boron dopants in a hydrogen-enriched silicon substrate was used as a target. A combination of the specific target composition and the laser pulse temporal shape allowed the enhancing of the yield of alpha particles up to 109 per steradian. This result can be ascribed to the interaction of the long-laser pre-pulse with the target and to the optimal target geometry and composition.

  11. High yield neutron generators using the DD reaction

    NASA Astrophysics Data System (ADS)

    Vainionpaa, J. H.; Harris, J. L.; Piestrup, M. A.; Gary, C. K.; Williams, D. L.; Apodaca, M. D.; Cremer, J. T.; Ji, Qing; Ludewigt, B. A.; Jones, G.

    2013-04-01

    A product line of high yield neutron generators has been developed at Adelphi technology inc. The generators use the D-D fusion reaction and are driven by an ion beam supplied by a microwave ion source. Yields of up to 5 × 109 n/s have been achieved, which are comparable to those obtained using the more efficient D-T reaction. The microwave-driven plasma uses the electron cyclotron resonance (ECR) to produce a high plasma density for high current and high atomic ion species. These generators have an actively pumped vacuum system that allows operation at reduced pressure in the target chamber, increasing the overall system reliability. Since no radioactive tritium is used, the generators can be easily serviced, and components can be easily replaced, providing essentially an unlimited lifetime. Fast neutron source size can be adjusted by selecting the aperture and target geometries according to customer specifications. Pulsed and continuous operation has been demonstrated. Minimum pulse lengths of 50 μs have been achieved. Since the generators are easily serviceable, they offer a long lifetime neutron generator for laboratories and commercial systems requiring continuous operation. Several of the generators have been enclosed in radiation shielding/moderator structures designed for customer specifications. These generators have been proven to be useful for prompt gamma neutron activation analysis (PGNAA), neutron activation analysis (NAA) and fast neutron radiography. Thus these generators make excellent fast, epithermal and thermal neutron sources for laboratories and industrial applications that require neutrons with safe operation, small footprint, low cost and small regulatory burden.

  12. High yield neutron generators using the DD reaction

    SciTech Connect

    Vainionpaa, J. H.; Harris, J. L.; Piestrup, M. A.; Gary, C. K.; Williams, D. L.; Apodaca, M. D.; Cremer, J. T.; Ji, Qing; Ludewigt, B. A.; Jones, G.

    2013-04-19

    A product line of high yield neutron generators has been developed at Adelphi technology inc. The generators use the D-D fusion reaction and are driven by an ion beam supplied by a microwave ion source. Yields of up to 5 Multiplication-Sign 10{sup 9} n/s have been achieved, which are comparable to those obtained using the more efficient D-T reaction. The microwave-driven plasma uses the electron cyclotron resonance (ECR) to produce a high plasma density for high current and high atomic ion species. These generators have an actively pumped vacuum system that allows operation at reduced pressure in the target chamber, increasing the overall system reliability. Since no radioactive tritium is used, the generators can be easily serviced, and components can be easily replaced, providing essentially an unlimited lifetime. Fast neutron source size can be adjusted by selecting the aperture and target geometries according to customer specifications. Pulsed and continuous operation has been demonstrated. Minimum pulse lengths of 50 {mu}s have been achieved. Since the generators are easily serviceable, they offer a long lifetime neutron generator for laboratories and commercial systems requiring continuous operation. Several of the generators have been enclosed in radiation shielding/moderator structures designed for customer specifications. These generators have been proven to be useful for prompt gamma neutron activation analysis (PGNAA), neutron activation analysis (NAA) and fast neutron radiography. Thus these generators make excellent fast, epithermal and thermal neutron sources for laboratories and industrial applications that require neutrons with safe operation, small footprint, low cost and small regulatory burden.

  13. MCNPX-CINDER'90 Simulation of Photonuclear Mo-99 Production Experiments

    SciTech Connect

    Kelsey, Charles T. IV; Chemerizov, Sergey D.; Dale, Gregory E.; Harvey, James T.; Tkac, Peter; Vandegrift, George R III

    2011-01-01

    The MCNPX and CINDER'90 codes were used to support design of experiments investigating Mo-99 production with a 20-MeV electron beam. Bremsstrahlung photons produced by the electron beam interacting with the target drive the desired Mo-100({gamma},n)Mo-99 reaction, as well as many undesired reactions important to accurate prediction of radiation hazards. MCNPX is a radiation transport code and CINDER'90 is a transmutation code. They are routinely used together for accelerator activation calculations. Low energy neutron fluxes and production rates for nonneutron and high energy neutron induced reactions computed using MCNPX are inputs to CINDER'90. CINDER'90 presently has only a neutron reaction cross section library up to 25 MeV and normally the other reaction rates come from MCNPX physics models. For this work MCNPX photon flux tallies modified by energy response functions prepared from evaluated photonuclear cross section data were used to tally the reaction rates for CINDER'90 input. The cross section evaluations do not provide isomer to ground state yield ratios so a spin based approximation was used. Post irradiation dose rates were calculated using MCNPX with CINDER'90 produced decay photon spectra. The sensitivity of radionuclide activities and dose rates to beam parameters including energy, position, and profile, as well as underlying isomer assumptions, was investigated. Three experimental production targets were irradiated, two natural Mo and one Mo-100 enriched. Natural Mo foils upstream of the targets were used to analyze beam position and profile by exposing Gafchromic film to the foils after each irradiation. Activation and dose rate calculations were rerun after the experiments using measured beam parameters for comparison with measured Mo-99 activities and dose rates.

  14. Updated Photonuclear Data Library and Database for Photon Strength Functions

    NASA Astrophysics Data System (ADS)

    Dimitriou, Paraskevi; Firestone, Richard B.; Siem, Sunniva; Bečvár, František; Krtička, Milan; Varlamov, Vladimir V.; Wiedeking, Mathis

    2015-05-01

    Photonuclear cross sections and gamma-ray data used to extract Photon Strength Functions are important for a large range of applications including basic sciences. The recommendations of an IAEA Consultant's Meeting to update the IAEA Photonuclear Data Library and create a Reference Database for Photon Strength Functions are presented.

  15. Isotope yield ratios of fragments from heavy-ion reactions

    SciTech Connect

    Deak, F.; Kiss, A. ); Seres, Z. ); Galonsky, A.; Heilbronn, L. )

    1991-05-01

    Isotope yield ratios produced in collisions of 35 MeV/nucleon {sup 14}N with targets of C, Ni, Ag, and Ho have an exponential dependence on total neutron-to-proton ratio. A statistical multifragmentation model including particle emission from excited fragments predicted such behavior for yield ratios measured earlier at the higher energy of 84 MeV/nucleon.

  16. Energy-shifting formulae yield reliable reaction and capture probabilities

    NASA Astrophysics Data System (ADS)

    Diaz-Torres, A.; Adamian, G. G.; Sargsyan, V. V.; Antonenko, N. V.

    2014-12-01

    Predictions of energy-shifting formulae for partial reaction and capture probabilities are compared with coupled channels calculations. The quality of the agreement notably improves with increasing mass of the system and/or decreasing mass asymmetry in the heavy-ion collision. The formulae are reliable and useful for circumventing impracticable reaction calculations at low energies.

  17. Pulsed Photonuclear Assessment (PPA) Technology Enhancement Study

    SciTech Connect

    Not Available

    2006-04-01

    The Idaho National Laboratory (INL) along with the Los Alamos National Laboratory (LANL) and Idaho State University’s Idaho Accelerator Center (IAC) has designed and tested a nominal 10-MeV prototype Pulsed Photonuclear Assessment (PPA) inspection system to detect shielded nuclear material. This report highlights two specific areas that will provide further PPA technology enhancements, namely, an optimal gamma-ray detection system and the off axis radiation detection sensitivity. Detection of low-atomic number (Z) shielded nuclear material had been initially addressed by the inclusion of dedicated Geiger-Müller (GM) detectors co-located above each of the Photonuclear Neutron Detectors (PNDs). Several different radiation detectors were investigated to assess if this type of gamma-ray detector was optimal. The LND 719 GM detector was shown to have the best photon sensitivity and demonstrated an optimal ability to detect low-Z shielded nuclear material. Beyond the technical performance of this detector, its low cost and availability makes it a logical choice for a field-deployable system. In terms of off-axis detection sensitivity, simulation and benchmarking experiments have indicated that the PPA inspection system can successfully detect nuclear material (within 120 seconds) in various shielding configurations even when it is located at a distance of as much as 30 cm off the interrogating beam axis (the exact sensitivity to off-axis interrogations will be largely dependent on the actual shielding material). As a general rule, high-Z shielding will allow detection at larger off-axis distances than low-Z materials.

  18. Infrared chemiluminescence study of the reaction Cl + HI yielding HCl + I at enhanced collision energies.

    NASA Technical Reports Server (NTRS)

    Cowley, L. T.; Horne, D. S.; Polanyi, J. C.

    1971-01-01

    Performed chemiluminescence and beam experiments show a markedly increased efficiency of conversion of the reaction energy into vibration and a markedly enhanced tendency for forward scattering in the reaction Cl + HI yields HCl + I as compared with H + Cl2 yields HCl + Cl. These differences appear to be due predominantly to the difference in the masses involved.

  19. Some limitations of detailed balance for inverse reaction calculations in the astrophysical p-process

    SciTech Connect

    Gardner, D.G.; Gardner, M.A.

    1990-12-05

    p-Process modeling of some rare but stable proton-rich nuclei requires knowledge of a variety of neutron, charged particle, and photonuclear reaction rates at temperatures of 2 to 3 {times} 10{sup 9} {degrees}K. Detailed balance is usually invoked to obtain the stellar photonuclear rates, in spite of a number of well-known constraints. In this work we attempt to calculate directly the stellar rates for ({gamma},n) and ({gamma},{alpha}) reactions on {sup 151}Eu. These are compared with stellar rates obtained from detailed balance, using the same input parameters for the stellar (n,{gamma}) and ({alpha},{gamma}) reactions on {sup 150}Eu and {sup 147}Pm, respectively. The two methods yielded somewhat different results, which will be discussed along with some sensitivity studies. 16 refs., 7 figs.

  20. Theoretical characterization of the reaction NH2 + O yields products

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1993-01-01

    The potential energy surface for NH2+O has been characterized using complete active space self-consistent field (CASSCF)/derivative calculations to determine stationary point geometries and frequencies followed by internally contracted configuration interaction (ICCI) calculations to determine the energetics. The calculations predict a NO bond strength of 85.8 kcal/mol for NH2O. The barrier for isomerization of NH2O to trans-HNOH is predicted to be 48.0 kcal/mol and the barriers for H+HNO forming NH2O and NHOH are predicted to be 2.1 and 8.3 kcal/mol, respectively (all corrected for zero-point energy). The computed heats of formation for NH2O and cis- and trans-HNOH are in good agreement with the present results. The barrier for H + HNO yields H2 + NO is computed to be about 0.3 kcal/mol.

  1. Nucleon-nucleon charge symmetry breaking and the dd{yields}{alpha}{pi}{sup 0} reaction

    SciTech Connect

    Fonseca, A. C.; Machleidt, R.; Miller, G. A.

    2009-08-15

    We show that using parameters consistent with the charge symmetry violating difference between the strong nn and pp scattering lengths provides significant constraints on the calculated amplitude for the dd{yields}{alpha}{pi}{sup 0} reaction.

  2. Bremstrahlung versus Monoenergetic Photons for Photonuclear Inspection Applications

    SciTech Connect

    Dr. James L. Jones

    2008-06-01

    Bremsstrahlung sources have been utilized for various non-intrusive inspection or interrogation applications for over 100 years - with the primary focus being radiographic imaging. In the last several decades, it has become evident that photons of energy greater than 6 MeV can also provide useful photonuclear information that can extend the capabilities and information available from active inspections. These energetic inspection photons can be produced as a continuum of energies (i.e., bremsstrahlung distribution) or as a set of one or more discrete photon energies (i.e., monoenergetic distribution). This paper will discuss the photonuclear process and its energetic photon energy dependence, will discuss the photonuclear role in nuclear material detection, will present applicable photon sources along with their field deployment status, and highlight some advantages and disadvantages of bremsstrahlung and monoenergetic photons sources.

  3. Quantum Yield Determination Based on Photon Number Measurement, Protocols for Firefly Bioluminescence Reactions.

    PubMed

    Niwa, Kazuki

    2016-01-01

    Quantum yield (QY), which is defined as the probability of photon production by a single bio/chemiluminescence reaction, is an important factor to characterize luminescence light intensity emitted diffusively from the reaction solution mixture. Here, methods to measure number of photons to determine QY according to the techniques of national radiometry standards are described. As an example, experiments using firefly bioluminescence reactions are introduced. PMID:27424895

  4. Photonuclear-based, nuclear material detection system for cargo containers

    NASA Astrophysics Data System (ADS)

    Jones, J. L.; Yoon, W. Y.; Norman, D. R.; Haskell, K. J.; Zabriskie, J. M.; Watson, S. M.; Sterbentz, J. W.

    2005-12-01

    The Idaho National Laboratory (INL) has been developing electron accelerator-based, photonuclear inspection technologies for over a decade. A current need, having important national implications, has been with the detection of smuggled nuclear material within air- and, especially, sea-cargo transportation containers. This paper describes the latest pulsed, photonuclear inspection system for nuclear material detection and identification in cargo configurations, the numerical responses of 5 kg of a nuclear material placed within selected cargo configurations, and the technology's potential role in addressing future inspection needs.

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

    PubMed

    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. PMID:25520216

  6. Limonene ozonolysis in the presence of nitric oxide: Gas-phase reaction products and yields

    NASA Astrophysics Data System (ADS)

    Ham, Jason E.; Harrison, Joel C.; Jackson, Stephen R.; Wells, J. R.

    2016-05-01

    The reaction products from limonene ozonolysis were investigated using the new carbonyl derivatization agent, O-tert-butylhydroxylamine hydrochloride (TBOX). With ozone (O3) as the limiting reagent, five carbonyl compounds were detected. The yields of the carbonyl compounds are discussed with and without the presence of a hydroxyl radical (OHrad) scavenger, giving insight into the influence secondary OH radicals have on limonene ozonolysis products. The observed reaction product yields for limonaketone (LimaKet), 7-hydroxyl-6-oxo-3-(prop-1-en-2-yl)heptanal (7H6O), and 2-acetyl-5-oxohexanal (2A5O) were unchanged suggesting OHrad generated by the limonene + O3 reaction does not contribute to their formation. The molar yields of 3-isopropenyl-6-oxo-heptanal (IPOH) and 3-acetyl-6-oxoheptanal (3A6O) decreased by 68% and >95%; respectively, when OHrad was removed. This suggests that OHrad radicals significantly impact the formation of these products. Nitric oxide (NO) did not significantly affect the molar yields of limonaketone or IPOH. However, NO (20 ppb) considerably decreased the molar reaction product yields of 7H6O (62%), 2A5O (63%), and 3A6O (47%), suggesting NO reacted with peroxyl intermediates, generated during limonene ozonolysis, to form other carbonyls (not detected) or organic nitrates. These studies give insight into the transformation of limonene and its reaction products that can lead to indoor exposures.

  7. Limonene ozonolysis in the presence of nitric oxide: Gas-phase reaction products and yields

    PubMed Central

    Ham, Jason E.; Harrison, Joel C.; Jackson, Stephen R.; Wells, J.R.

    2016-01-01

    The reaction products from limonene ozonolysis were investigated using the new carbonyl derivatization agent, O-tert-butylhydroxylamine hydrochloride (TBOX). With ozone (O3) as the limiting reagent, five carbonyl compounds were detected. The yields of the carbonyl compounds are discussed with and without the presence of a hydroxyl radical (OH•) scavenger, giving insight into the influence secondary OH radicals have on limonene ozonolysis products. The observed reaction product yields for limonaketone (LimaKet), 7-hydroxyl-6-oxo-3-(prop-1-en-2-yl)heptanal (7H6O), and 2-acetyl-5-oxohexanal (2A5O) were unchanged suggesting OH• generated by the limonene + O3 reaction does not contribute to their formation. The molar yields of 3-isopropenyl-6-oxo-heptanal (IPOH) and 3-acetyl-6-oxoheptanal (3A6O) decreased by 68% and >95%; respectively, when OH• was removed. This suggests that OH• radicals significantly impact the formation of these products. Nitric oxide (NO) did not significantly affect the molar yields of limonaketone or IPOH. However, NO (20 ppb) considerably decreased the molar reaction product yields of 7H6O (62%), 2A5O (63%), and 3A6O (47%), suggesting NO reacted with peroxyl intermediates, generated during limonene ozonolysis, to form other carbonyls (not detected) or organic nitrates. These studies give insight into the transformation of limonene and its reaction products that can lead to indoor exposures. PMID:27346977

  8. Evaluation of nanoparticle-immobilized cellulase for improved ethanol yield in simultaneous saccharification and fermentation reactions

    SciTech Connect

    Lupoi, Jason; Smith, Emily

    2011-12-01

    Ethanol yields were 2.1 (P = 0.06) to 2.3 (P = 0.01) times higher in simultaneous saccharification and fermentation (SSF) reactions of microcrystalline cellulose when cellulase was physisorbed on silica nanoparticles compared to enzyme in solution. In SSF reactions, cellulose is hydrolyzed to glucose by cellulase while yeast simultaneously ferments glucose to ethanol. The 35 C temperature and the presence of ethanol in SSF reactions are not optimal conditions for cellulase. Immobilization onto solid supports can stabilize the enzyme and promote activity at non-optimum reaction conditions. Mock SSF reactions that did not contain yeast were used to measure saccharification products and identify the mechanism for the improved ethanol yield using immobilized cellulase. Cellulase adsorbed to 40 nm silica nanoparticles produced 1.6 times (P = 0.01) more glucose than cellulase in solution in 96 h at pH 4.8 and 35 C. There was no significant accumulation (<250 {mu}g) of soluble cellooligomers in either the solution or immobilized enzyme reactions. This suggests that the mechanism for the immobilized enzyme's improved glucose yield compared to solution enzyme is the increased conversion of insoluble cellulose hydrolysis products to soluble cellooligomers at 35 C and in the presence of ethanol. The results show that silica-immobilized cellulase can be used to produce increased ethanol yields in the conversion of lignocellulosic materials by SSF.

  9. Threshold and spin factors in the yield of bremsstrahlung-induced reactions

    SciTech Connect

    Karamian, S. A.

    2013-12-15

    Relative yields of photon-induced reactions are systematized in a function of the threshold parameter for moderately heavy targets at the bremsstrahlung end-point energy lower than 30 MeV. Regular dependence is established for the group of (γ, n), (γ, p), and (γ, d) reactions, while the yields of (γ, 2n) and (γ,α) reactions deviate from the regularity. Physical conclusions are discussed and possible application of this systematic for data processing is proposed. In particular, the constituent threshold and spin factors in the isomer-to-ground-state ratio could be isolated separately. For spin dependence of the yields, a new regularization parameter is introduced and previously hidden peculiarities are concluded.

  10. Unconventional application of the Mitsunobu reaction: Selective flavonolignan dehydration yielding hydnocarpins

    PubMed Central

    Huang, Guozheng; Schramm, Simon; Heilmann, Jörg; Biedermann, David; Křen, Vladimír

    2016-01-01

    Summary Various Mitsunobu conditions were investigated for a series of flavonolignans (silybin A, silybin B, isosilybin A, and silychristin A) to achieve either selective esterification in position C-23 or dehydration in a one-pot reaction yielding the biologically important enantiomers of hydnocarpin D, hydnocarpin and isohydnocarpin, respectively. This represents the only one-pot semi-synthetic method to access these flavonolignans in high yields. PMID:27340458

  11. Unconventional application of the Mitsunobu reaction: Selective flavonolignan dehydration yielding hydnocarpins.

    PubMed

    Huang, Guozheng; Schramm, Simon; Heilmann, Jörg; Biedermann, David; Křen, Vladimír; Decker, Michael

    2016-01-01

    Various Mitsunobu conditions were investigated for a series of flavonolignans (silybin A, silybin B, isosilybin A, and silychristin A) to achieve either selective esterification in position C-23 or dehydration in a one-pot reaction yielding the biologically important enantiomers of hydnocarpin D, hydnocarpin and isohydnocarpin, respectively. This represents the only one-pot semi-synthetic method to access these flavonolignans in high yields. PMID:27340458

  12. Isomeric yield ratios of 87m,gY from different nuclear reactions

    NASA Astrophysics Data System (ADS)

    Naik, H.; Kim, G. N.; Kim, K.; Zaman, M.; Sahid, M.; Yang, S.-C.; Lee, M. W.; Kang, Y. R.; Shin, S. G.; Cho, M.-H.; Goswami, A.; Song, T. Y.

    2014-07-01

    The independent isomeric yield ratios of 87m,gY produced from the 93Nb( γ, α2n) and natZr( γ, p xn) reactions with the end-point bremsstrahlung energy of 45-70 MeV have been determined by an off-line γ-ray spectrometric technique using 100 MeV electron linac at the Pohang accelerator laboratory, Korea. The isomeric yield ratios of 87m,gY were also determined from the natZr(p, αxn) and the 89Y(p,p2n) reactions with E P = 15-45 MeV as well as those from the 89Y( α, α2n) reaction with E α = 32-43 MeV using the MC-50 cyclotron at the Korea Institute of Radiological and Medical Science, Korea. The isomeric yield ratios of 87m,gY from the present work in the 93Nb( γ, α2n), natZr( γ, p xn), natZr(p, αxn), 89Y(p,p2n), and 89Y( α, α2n) reactions were compared with those of the literature data in the 85Rb( α, 2n), the 86,87,88Sr(d, xn), 89Y(n,3n), and the 89Y( γ, 2n) reactions to examine the role of target, projectiles, and ejectiles through compound nucleus excitation energy and input angular momentum. The isomeric yield ratios of 87m,gY in the above eleven reactions were also calculated using the computer code TALYS 1.4 and compared with the experimental data. The different behaviors between photon- and neutron-induced reactions and charged-particle-induced reactions are discussed from the viewpoint of compound and non-compound (pre-equilibrium) process.

  13. Target effects in isobaric yield ratio differences between projectile fragmentation reactions

    NASA Astrophysics Data System (ADS)

    Ma, Chun-Wang; Zhang, Yan-Li; Qiao, Chun-Yuan; Wang, Shan-Shan

    2015-01-01

    Background: The isobaric yield ratio difference (IBD) between reactions is know to be sensitive to the density difference between projectiles in heavy-ion collisions around the Fermi energy. Purpose: The target effects in the isobaric yield ratio (IYR) and the IBD results have been studied. Methods: The amount of isotopes in the 140 A MeV 48 ,40Ca +181Ta /9Be and 58 ,64Ni +181Ta /9Be reactions have been previously measured with high accuracy. The IYR and IBD results have been obtained from these reactions to study the effects of the light 9Be and heavy 181Ta targets. A ratio (rΔ μ) between the IBD results for the reactions with Ta and Be targets is defined to quantitatively show the target dependence of the IBD results. Results The IYRs for reactions with symmetric projectiles are more easily affected than those for reactions with neutron-rich projectiles. The IBD results are suppressed by using the 181Ta target to different degrees. Conclusions: The IYR and IBD results are influenced by the target used. The IBD for the I =1 isobaric chain is suggested as a probe to study the difference between the neutron and proton densities of the reaction systems.

  14. Rate constant for the reaction Cl + HO2NO2 yielding products. [in stratospheric chemistry

    NASA Technical Reports Server (NTRS)

    Simonaitis, R.; Leu, M. T.

    1985-01-01

    The rates for the reaction of Cl atoms iwth HO2NO2 were calculated from data obtained by the use of the discharge flow/resonance fluorescence (DF/RF) and the discharge flow/mass spectrometric (DF/MS) techniques. The total rate constant, k1, for the overall reaction: 1a (Cl + HO2NO2 yielding HCl + NO2 +O2), 1b (yielding HO2 + ClNO2), and the two possible additional channels was found to be less than 1.0 x 10 to the -13th cu cm/s at 296 K. The value of (k1a + k1b) was found to be 3.4 + or - 1.4) x 10 to the -14th cu cm/s. Thus, the reaction of Cl with peroxynitric acid is too slow, by a factor of 100, to contribute significantly to the hydrogen abstraction by Cl in the stratosphere.

  15. Yields of O2(b 1 Sigma g +) from reactions of HO2. [in planetary atmospheres

    NASA Technical Reports Server (NTRS)

    Keyser, L. F.; Choo, K. Y.; Leu, M. T.

    1985-01-01

    The production of O2(b 1 Sigma g +) has been monitored for several reactions of the HO2 radical at 300 K using a discharge-flow apparatus with resonance fluorescence and chemiluminescence detection. In all cases, the resulting quantum efficiencies were found to be less than 0.03. O2(b) was observed when F atoms were added to H2O2 in the gas phase. The signal strengths of O2(b) were proportional to initial concentrations of HO2 formed by the F + H2O2 reaction. Observed /O2(b)/, /HO2/, and /OH/ vs /F/0 were analyzed using a simple three-step mechanism and a more complete computer simulation with 22 reaction steps. The results indicate that the F + HO2 reaction yields O2(b) with an efficiency of (3.6 + or - 1.4) x 10 to the -3rd. Yields from the O + OH2 reaction were less than 0.02, indicating that this reaction cannot be a major source of the O2(b) emission observed in the earth's nightglow.

  16. Kinetics and Product Yields of the Gas-Phase Reactions of Isoprene Hydroxynitrates and Isoprene Carbonynitrates

    NASA Astrophysics Data System (ADS)

    Abdelhamid, A.; Addala, R.; Vizenor, N.; Scruggs, A.; Tyndall, G. S.; Orlando, J. J.; Le, T.; Cardenas, E.; Maitra, S.; Hasson, A. S.

    2013-12-01

    Isoprene nitrates are formed in the troposphere from the reactions of isoprene with OH in the presence of NOx during the day and with NO3 during the night. Depending on their subsequent reactions, these compounds may be reservoirs or sinks for NOx, and may contribute to secondary organic aerosol formation. In this work, two isoprene hydroxynitrates (CH2=CHC(ONO2)(CH3)CH2OH, 1,2-IHN and CH2OHCH(ONO2)C(CH3)=CH2, 4,3-IHN ) and one isoprene carbonyl nitrate (CH2=CHC(ONO2)(CH3)CHO, ICN)) were synthesized. The kinetics and product yields from their reaction with O3, OH, NO3 and Cl were then investigated in a photochemical reactor using a combination of long-path Fourier transform infra-red spectroscopy, proton transfer reaction mass spectrometry and gas chromatography with flame ionization detection. Measured rate coefficients are consistent with reaction with OH and NO3 as the major chemical sinks for these compounds. Measured product yields imply that NOx is not released from these compounds in their reactions with atmospheric oxidants.

  17. Ozone deposition velocities, reaction probabilities and product yields for green building materials

    NASA Astrophysics Data System (ADS)

    Lamble, S. P.; Corsi, R. L.; Morrison, G. C.

    2011-12-01

    Indoor surfaces can passively remove ozone that enters buildings, reducing occupant exposure without an energy penalty. However, reactions between ozone and building surfaces can generate and release aerosols and irritating and carcinogenic gases. To identify desirable indoor surfaces the deposition velocity, reaction probability and carbonyl product yields of building materials considered green (listed, recycled, sustainable, etc.) were quantified. Nineteen separate floor, wall or ceiling materials were tested in a 10 L, flow-through laboratory reaction chamber. Inlet ozone concentrations were maintained between 150 and 200 ppb (generally much lower in chamber air), relative humidity at 50%, temperature at 25 °C and exposure occurred over 24 h. Deposition velocities ranged from 0.25 m h -1 for a linoleum style flooring up to 8.2 m h -1 for a clay based paint; reaction probabilities ranged from 8.8 × 10 -7 to 6.9 × 10 -5 respectively. For all materials, product yields of C 1 thru C 12 saturated n-aldehydes, plus acetone ranged from undetectable to greater than 0.70 The most promising material was a clay wall plaster which exhibited a high deposition velocity (5.0 m h -1) and a low product yield (

  18. Implantation and Testing of Photonuclear Channel in Code EMPIRE II

    SciTech Connect

    Plujko, V.A.; Bezshyyko, O.A.; Kadenko, I.M.; Golinka-Bezshyyko, L.O.

    2005-05-24

    An extension of EMPIRE II code (v.2.18) to include the photonuclear channel is made. The calculations of photoabsorption cross-sections were performed with the use of different radiative strength function models. Experimental data are compared with theoretical calculations. The MLO and GFL models can be recommended as the best ones for overall description of the photoabsorption cross-sections in the gamma-ray ranges till {<=} 20 MeV.

  19. Simulation for thick-target yields of transmutation reactions on radioactive targets, based on inverse kinematics

    NASA Astrophysics Data System (ADS)

    Ebata, Shuichiro; Aikawa, Masayuki; Imai, Shotaro

    2016-06-01

    To dispose of long-lived fission products (LLFP) ejected from nuclear reactor plants is one of the most important tasks on nuclear physics and engineering. The experiments with the radiative target are limited, due to the high radioactivity and chemical property of the target. In consequence, the nuclear reaction data for LLFP are insufficient. In this work, we propose a feasible method to obtain the data for radiative targets using inverse kinematics and simulate specific systems to evaluate the thick-target yields of the nuclear transmutation reactions for LLFP.

  20. Reaction {gamma}p {sup {yields}} {eta}' (958) p and polarization of recoil protons

    SciTech Connect

    Tryasuchev, V. A.

    2006-02-15

    On the basis of the isobar model extended by including the t-channel, the cross sections for and single-polarization features of the reaction {gamma}p {sup {yields}} {eta}'p are calculated for incident-photon energies up to 5 GeV, two poorly studied resonances, S{sub 11}(1978) and P{sub 13}(2080), being taken into account in this calculation. In order to reduce the ambiguities in the choice of resonances and their parameters that make it possible to reproduce the experimental differential cross sections, it is proposed to measure the polarization of recoil protons in the reaction being considered.

  1. Advanced scheme for high-yield laser driven proton-boron fusion reaction

    NASA Astrophysics Data System (ADS)

    Margarone, D.; Picciotto, A.; Velyhan, A.; Krasa, J.; Kucharik, M.; Morrissey, M.; Mangione, A.; Szydlowsky, A.; Malinowska, A.; Bertuccio, G.; Shi, Y.; Crivellari, M.; Ullschmied, J.; Bellutti, P.; Korn, G.

    2015-02-01

    A low contrast nanosecond laser pulse with relatively low intensity (3 × 1016 W cm-2) was used to enhance the yield of induced nuclear reactions in advanced solid targets. In particular the "ultraclean" proton-boron fusion reaction, producing energetic alpha-particles without neutron generation, was chosen. A spatially well-defined layer of boron dopants in a hydrogen-enriched silicon substrate was used as target. The combination of the specific target geometry and the laser pulse temporal shape allowed enhancing the yield of alpha-particles up to 109 per steradian, i.e 100 times higher than previous experimental achievements. Moreover the alpha particle stream presented a clearly peaked angular and energy distribution, which make this secondary source attractive for potential applications. This result can be ascribed to the interaction of the long laser pre-pulse with the target and to the optimal target geometry and composition.

  2. The Pressure Dependency of Stabilized Criegee Intermediate Yields of Selected Ozone-Alkene Reactions

    NASA Astrophysics Data System (ADS)

    Hakala, J. P.; Donahue, N. M.

    2014-12-01

    Stabilized Criegee Intermediates (SCI) play an important role as an oxidizing species in atmospheric reactions. The ozonolysis of alkenes in the atmosphere, i.e. the mechanism by which the SCIs are produced, is a major pathway to the formation of Secondary Organic Aerosols (SOA) in the atmosphere. Just how much SCIs contribute to the SOA formation is not well known and fundamental research in the kinetics of SCI formation need to be performed to shed light on this mystery. The alkene ozonolysis is highly exothermic reaction, so a third body is needed for stabilizing the SCI, thus making the SCI yield pressure dependent. We studied the production of SCIs at different pressures by studying their ability to oxidize sulfur dioxide in a pressure controlled flow reactor. We used a mixture of ultra-high purity nitrogen, oxygen, and a selective scavenger for hydroxyl radical (OH) as a carrier gas, and injected a mixture of nitrogen, sulfur dioxide and selected alkene to the center of the flow for ozonolysis to take place. With the OH radical scavenged, the SCI yield of the reaction was measured by measuring the amount of sulfuric acid formed in the reaction between SCI and sulfur dioxide with a Chemical Ionization Mass Spectrometer (CIMS). This work was supported by NASA/ROSES grant NNX12AE54G to CMU and Academy of Finland Center of Excellence project 1118615.

  3. Proposal for studying N* resonances with the pp{yields}pn{pi}{sup +} reaction

    SciTech Connect

    Wu Jiajun; Zou, B. S.; Ouyang Zhen

    2009-10-15

    A theoretical study of the pp{yields}pn{pi}{sup +} reaction for antiproton beam energy from 1 to 4 GeV is made by including contributions from various known N* and {delta}* resonances. It is found that for the beam energy around 1.5 GeV, the contribution of the Roper resonance N{sub (1440)}* produced by the t-channel {sigma} exchange dominates over all other contributions. Since such a reaction can be studied in the forthcoming PANDA experiment at the GSI Facility of Antiproton and Ion Research (FAIR), the reaction will be realistically the cleanest place for studying the properties of the Roper resonance and the best place for looking for other ''missing''N* resonances with large coupling to N{sigma}.

  4. Dynamical coupled-channels study of {pi}N{yields}{pi}{pi}N reactions

    SciTech Connect

    Kamano, H.; Julia-Diaz, B.; Lee, T.-S. H.; Matsuyama, A.; Sato, T.

    2009-02-15

    As a step toward performing a complete coupled-channels analysis of the world data of {pi}N,{gamma}*N{yields}{pi}N,{eta}N,{pi}{pi}N reactions, the {pi}N{yields}{pi}{pi}N reactions are investigated starting with the dynamical coupled-channels model developed in Phys. Rev. C 76, 065201 (2007). The channels included are {pi}N,{eta}N, and {pi}{pi}N which has {pi}{delta},{rho}N, and {sigma}N resonant components. The nonresonant amplitudes are generated from solving a set of coupled-channels equations with the meson-baryon potentials defined by effective Lagrangians. The resonant amplitudes are generated from 16 bare excited nucleon (N*) states that are dressed by the nonresonant interactions as constrained by the unitarity condition. The data of total cross sections and {pi}N and {pi}{pi} invariant mass distributions of {pi}{sup +}p{yields}{pi}{sup +}{pi}{sup +}n,{pi}{sup +}{pi}{sup 0}p and {pi}{sup -}p{yields}{pi}{sup +}{pi}{sup -}n,{pi}{sup -}{pi}{sup 0}p,{pi}{sup 0}{pi}{sup 0}n reactions from threshold to the invariant mass W=2 GeV can be described to a very large extent. We show the importance of the coupled-channels effects and the strong interference among the contributions from the {pi}{delta},{sigma}N, and {rho}N channels. The large interference between the resonant and nonresonant amplitudes is also demonstrated. Possible future developments are discussed.

  5. Initial-state Coulomb interaction in the dd{yields}{alpha}{pi}{sup 0} reaction

    SciTech Connect

    Laehde, Timo A.; Miller, Gerald A.

    2007-05-15

    The effects of initial-state Coulomb interactions in the charge-symmetry-breaking reaction dd{yields}{alpha}{pi}{sup 0} are investigated within a previously published formalism. This is a leading order effect in which the Coulomb interaction between the two initial state protons leads to the breakup of the two deuterons into a continuum state that is well connected to the final {alpha}{pi}{sup 0} state by the strong emission of a pion. As a first step, we use a simplified set of d and {alpha} wave functions and a plane-wave approximation for the initial dd state. This Coulomb mechanism, by itself, yields cross sections that are much larger than the experimental ones, and which are comparable in size to the contributions from other mechanisms. Inclusion of this mechanism is therefore necessary in a realistic calculation.

  6. Reaction {pi}N {yields} {pi}{pi}N near threshold

    SciTech Connect

    Frlez, E.

    1993-11-01

    The LAMPF E1179 experiment used the {pi}{sup 0} spectrometer and an array of charged particle range counters to detect and record {pi}{sup +}{pi}{sup 0}, {pi}{sup 0}p, and {pi}{sup +}{pi}{sup 0}p coincidences following the reaction {pi}{sup +}p {yields} {pi}{sup 0}{pi}{sup +}p near threshold. The total cross sections for single pion production were measured at the incident pion kinetic energies 190, 200, 220, 240, and 260 MeV. Absolute normalizations were fixed by measuring {pi}{sup +}p elastic scattering at 260 MeV. A detailed analysis of the {pi}{sup 0} detection efficiency was performed using cosmic ray calibrations and pion single charge exchange measurements with a 30 MeV {pi}{sup {minus}} beam. All published data on {pi}N {yields} {pi}{pi}N, including our results, are simultaneously fitted to yield a common chiral symmetry breaking parameter {xi} ={minus}0.25{plus_minus}0.10. The threshold matrix element {vert_bar}{alpha}{sub 0}({pi}{sup 0}{pi}{sup +}p){vert_bar} determined by linear extrapolation yields the value of the s-wave isospin-2 {pi}{pi} scattering length {alpha}{sub 0}{sup 2}({pi}{pi}) = {minus}0.041{plus_minus}0.003 m{sub {pi}}{sup {minus}1}, within the framework of soft-pion theory.

  7. Status of the Prototype Pulsed Photonuclear Assessment (PPA) Inspection System

    SciTech Connect

    Prototype Photonuclear Inspection Technoloby - An

    2007-08-01

    Prototype Photonuclear Inspection Technology – An Integrated Systems Approach* James L. Jonesa, Daren R. Normana, Kevin J. Haskella, James W. Sterbentza, Woo Y. Yoona, Scott M. Watsona, James T. Johnsona, John M. Zabriskiea, Calvin E. Mossb, Frank Harmonc a – Idaho National Laboratory, P.O. Box 1625-2802, Idaho Falls, Idaho 83415-2802 b – Los Alamos National Laboratory, P.O. Box 1663, MS B228, Los Alamos, New Mexico, 87585 c – Idaho State University, 1500 Alvin Ricken Dr., Pocatello, Idaho 83201 Active interrogation technologies are being pursued in order to address many of today’s challenging inspection requirements related to both nuclear and non-nuclear material detection. The Idaho National Laboratory, along with the Los Alamos National Laboratory and the Idaho State University’s Idaho Accelerator Center, continue to develop electron accelerator-based, photonuclear inspection technologies for the detection of shielded nuclear material within air-, rail-, and especially, maritime-cargo containers. This paper presents an overview and status of the prototype Pulsed Photonuclear Assessment (PPA) inspection system and its ability to detect shielded nuclear material by focusing on the integration of three major detection system components: delayed neutron measurement, delayed gamma-ray measurements, and a transmission, gray-scale mapping for shield material detection. Areas of future development and advancement within each detection component will be presented. *Supported in part by the Department of Homeland Security under DOE-ID Contract Number DE-AC07-99ID13727. POC: James L. Jones, 208-526-1730

  8. Low-Pressure Photolysis of 2,3-Pentanedione in Air: Quantum Yields and Reaction Mechanism.

    PubMed

    Bouzidi, Hichem; Djehiche, Mokhtar; Gierczak, Tomasz; Morajkar, Pranay; Fittschen, Christa; Coddeville, Patrice; Tomas, Alexandre

    2015-12-24

    Dicarbonyls in the atmosphere mainly arise from secondary sources as reaction products in the degradation of a large number of volatile organic compounds (VOC). Because of their sensitivity to solar radiation, photodissociation of dicarbonyls can dominate the fate of these VOC and impact the atmospheric radical budget. The photolysis of 2,3-pentanedione (PTD) has been investigated for the first time as a function of pressure in a static reactor equipped with continuous wave cavity ring-down spectroscopy to measure the HO2 radical photostationary concentrations along with stable species. We showed that (i) Stern-Volmer plots are consistent with low OH-radical formation yields in RCO + O2 reactions, (ii) the decrease of the photodissociation rate due to pressure increase from 26 to 1000 mbar is of about 30%, (iii) similarly to other dicarbonyls, the Stern-Volmer analysis shows a curvature at the lower pressure investigated, which may be assigned to the existence of excited singlet and triplet PTD states, (iv) PTD photolysis at 66 mbar leads to CO2, CH2O and CO with yields of (1.16 ± 0.04), (0.33 ± 0.02) and (0.070 ± 0.005), respectively, with CH2O yield independent of pressure up to 132 mbar and CO yield in agreement with that obtained at atmospheric pressure by Bouzidi et al. (2014), and (v) the PTD photolysis mechanism remains unchanged between atmospheric pressure and 66 mbar. As a part of this work, the O2 broadening coefficient for the absorption line of HO2 radicals at 6638.21 cm(-1) has been determined (γO2 = 0.0289 cm(-1) atm(-1)). PMID:26608471

  9. Proton source size measurements in the eA {yields} e{prime}ppX reaction

    SciTech Connect

    Aleksey Stavinskiy; Konstantin Mikhaylov; R. Lednicky; Alexander Vlassov; Et. Al.

    2004-06-01

    Two-proton correlations at small relative momentum q were studied in the eA({sup 3}He, {sup 4}He, C, Fe) {yields} e{prime}ppX reaction at E{sub 0} = 4.46 GeV using the CLAS detector at Jefferson Lab. The enhancement of the correlation function at small q was found to be in accordance with theoretical expectation. Emission region sizes were extracted and proved to be dependent on A and proton momentum. The size of the two-proton emission region on the lightest possible nucleus, He, was measured for the first time.

  10. The energy dependence of the pp {yields} K{sup +}n{Sigma}{sup +} reaction

    SciTech Connect

    Valdau, Yu.

    2011-10-24

    The energy dependence of the total cross section for the pp {yields} K{sup +}n{Sigma}{sup +} reaction has been investigated at the magnetic spectrometer COSY-ANKE. Signals from the production of the {Sigma}{sup +} hyperon were searched for in three simultaneously measured spectra. The values obtained for the total production cross section {sigma}({Sigma}{sup +}) are slightly below those of {sigma}({Sigma}{sup 0}) at the same excess energies. They follow a phase space dependence and do not show any evidence for strong threshold effects or a significant n{Sigma}{sup +} final state interaction.

  11. Barium and xenon isotope yields in photopion reactions of sup 133 Cs

    SciTech Connect

    Sakamoto, K.; Hamajima, Y.; Soto, M.; Kubota, Y.; Yoshida, M.; Kunugise, A.; Masatani, M. ); Shibata, S.; Imamura, M. ); Furukawa, M. ); Fujiwara, I. )

    1990-10-01

    Radiochemical yield measurements are reported for barium isotopes from {sup 133}Cs({gamma},{pi}{sup {minus}}{ital xn}){sup 133{minus}{ital x}}Ba for {ital x}=0, 2, 4, 5, 6, 7, and 9 for bremsstrahlung maximum end-point energies {ital E}{sub 0}=30--1050 MeV and for {sup 133}Xe from {sup 133}Cs({gamma},{pi}{sup +}){sup 133{ital m},{ital g}}Xe for {ital E}{sub 0}=300--1000 MeV. Emphasis was placed on Ba measurements near the pion threshold and for different target thicknesses in order to assess interfering secondary particle-induced reactions. Clear evidence of secondary reactions was found in the form of a shoulder in the yield curves for a range of values near {ital E}{sub 0}{approx lt}{ital Q}{sub {pi}{sup {minus}}}, the {ital Q}{sub {pi}{sup {minus}}} value of {sup 133}Cs({gamma},{pi}{sup {minus}}{ital xn}) reaction. This result was used for the correction of yields at {ital E}{sub 0}{approx gt}{ital Q}{sub {pi}{sup {minus}}} with the aid of reported measurements of photoproton spectra from {sup 12}C and other complex nuclei and cross sections of ({sup 133}Cs+{ital p}) reactions. The yields corrected for the secondaries {sigma}{sub {ital q}}({ital E}{sub 0}) were unfolded into cross sections per photon of energy {ital k}, {sigma}({ital k}). The characteristic features of {sigma}{sub {ital q}}({ital E}{sub 0}) and {sigma}({ital k}) are then discussed in terms of {ital E}{sub 0} and {ital k} dependences and product mass ({ital A}{sub {ital p}}=133{minus}{ital x}) by comparing the present results with those for other systems currently obtained by our group. It was found that the present results of {sigma}({ital k}) are generally reproduced by a cascade-evaporation calculation based on the PICA code of Gabriel and Alsmiller, only if the calculated values are shifted up in photon energy by 30 MeV and the neutron cutoff energy is chosen to be 1 MeV.

  12. Off-shell effects for the reaction pp{yields}{pi}d at high energies

    SciTech Connect

    Lee, T.S.H.; Locher, M.P.; Lu, Y.

    1995-08-01

    The reaction pp {yields} {pi}d is studied in a relativistic meson rescattering model. For 1.3 < T{sub p} < 2.4 GeV, the differential cross section and the asymmetry are calculated and compared to experiment. The model introduces simple form factors for the leading {pi}N partial waves, which depend on the virtuality of the exchanged {pi} and {rho} mesons. All remaining input is derived from experimental constraints. The data can be described by energy-independent form factors. The asymmetries are sensitive to pp distortion factors and further details of the model. A paper describing our results was published.

  13. Kinetics of the reaction HO2 + NO2 + M yields HO2NO2 + M

    NASA Technical Reports Server (NTRS)

    Sander, S. P.; Peterson, M. E.

    1984-01-01

    The flash photolysis/ultraviolet absorption technique was used to measure the rate constants for the reaction HO2 + NO2 + M yields HO2NO2 + M over the pressure range 50-700 torr and temperature range 229-362 K using He, O2, and N2 as diluent gases. The data were fit to the expression derived by Troe (1979) and co-workers for describing the pressure and temperature dependence of reactions in the falloff region. By combining these data with recent measurements of the rate constant for HO2NO2 thermal decomposition values of 73.8 + or - 2 eu for the standard entropy and -12.6 + or - kcal/mol for the standard enthalpy of formation of HO2NO2 were obtained. A significant enhancement in the rate constant was observed when water vapor was added to the system.

  14. Quantum yields and reaction times of photochromic diarylethenes: nonadiabatic ab initio molecular dynamics for normal- and inverse-type.

    PubMed

    Wiebeler, Christian; Schumacher, Stefan

    2014-09-11

    Photochromism is a light-induced molecular process that is likely to find its way into future optoelectronic devices. In further optimization of photochromic materials, light-induced conversion efficiencies as well as reaction times can usually only be determined once a new molecule was synthesized. Here we use nonadiabatic ab initio molecular dynamics to study the electrocyclic reaction of diarylethenes, comparing normal- and inverse-type systems. Our study highlights that reaction quantum yields can be successfully predicted in accord with experimental findings. In particular, we find that inverse-type diarylethenes show a significantly higher reaction quantum yield and cycloreversion on times typically as short as 100 fs. PMID:25140609

  15. Pulsed Photonuclear Assessment (PPA) Technique: CY-05 Project Summary Report

    SciTech Connect

    J.L. Jones; B.D. Bennett; K.J. Haskell; J.T. Johnson; D.R. Norman; J.W. Sterbentz; R.W. Watson; S.M. Watson; W.Y. Yoon; J.M. Zabriskie; C.E. Moss; K.L. Folkman; C.C. O'Neil; A.W. Hunt; R.J. Spaulding

    2005-12-01

    Idaho National Laboratory, along with Idaho State University’s Idaho Accelerator Center and Los Alamos National Laboratory, is developing an electron accelerator-based, photonuclear inspection technology, called the Pulsed Photonuclear Assessment (PPA) system, for the detection of nuclear material concealed within air-, rail-, and, primarily, maritime-cargo transportation containers. This report summarizes the advances and progress of the system’s development in 2005. The contents of this report include an overview of the prototype inspection system, selected Receiver-Operator-Characteristic curves for system detection performance characterization, a description of the approach used to integrate the three major detection components of the PPA inspection system, highlights of the gray-scale density mapping technique being used for significant shield material detection, and higher electron beam energy detection results to support an evaluation for an optimal interrogating beam energy. This project is supported by the Department of Homeland Security Office of Research and Development and, more recently, the Domestic Nuclear Detection Office.

  16. Kinetic and Product Yields of the Gas-Phase Reactions of Isoprene Hydroperoxides with Atmospheric Oxidants

    NASA Astrophysics Data System (ADS)

    Kumar, V.; Lozano, E. I.; Maitra, S.; Manning, D. M.; Cervantes, R.; Hasson, A. S.

    2015-12-01

    Isoprene is a volatile organic compound (VOC) that is emitted into the atmosphere by plants and trees. It has the largest emission rate of any non-methane VOC and is very reactive, and therefore has a major impact on the chemical composition of the atmosphere. Isoprene Hydroperoxides (IHP) are formed in the atmosphere from the chemical degradation of isoprene. These compounds can then potentially react in the atmosphere with atmospheric oxidants (ozone, OH, NO3) to produce secondary products. This chemistry is potentially important as it may contribute to particle growth and to mediation of ozone concentrations. In this work, the kinetics and mechanisms of the reactions of two IHPs with ozone were investigated. IHPs were synthesized and purified, and were characterized by NMR and HPLC. The gas phase chemistry of these compounds was then studied in chamber experiments using PTRMS as the primary analytical tool. The rate coefficients for reaction with ozone were measured at room temperature and 1 atmosphere using the relative rate technique, and yields of major gas phase reaction products were measured. Implications of these results will be discussed.

  17. Development and Implementation of Photonuclear Cross-Section Data for Mutually Coupled Neutron-Photon Transport Calculations in the Monte Carlo N-Particle (MCNP) Radiation Transport Code

    SciTech Connect

    Morgan C. White

    2000-07-01

    The fundamental motivation for the research presented in this dissertation was the need to development a more accurate prediction method for characterization of mixed radiation fields around medical electron accelerators (MEAs). Specifically, a model is developed for simulation of neutron and other particle production from photonuclear reactions and incorporated in the Monte Carlo N-Particle (MCNP) radiation transport code. This extension of the capability within the MCNP code provides for the more accurate assessment of the mixed radiation fields. The Nuclear Theory and Applications group of the Los Alamos National Laboratory has recently provided first-of-a-kind evaluated photonuclear data for a select group of isotopes. These data provide the reaction probabilities as functions of incident photon energy with angular and energy distribution information for all reaction products. The availability of these data is the cornerstone of the new methodology for state-of-the-art mutually coupled photon-neutron transport simulations. The dissertation includes details of the model development and implementation necessary to use the new photonuclear data within MCNP simulations. A new data format has been developed to include tabular photonuclear data. Data are processed from the Evaluated Nuclear Data Format (ENDF) to the new class ''u'' A Compact ENDF (ACE) format using a standalone processing code. MCNP modifications have been completed to enable Monte Carlo sampling of photonuclear reactions. Note that both neutron and gamma production are included in the present model. The new capability has been subjected to extensive verification and validation (V&V) testing. Verification testing has established the expected basic functionality. Two validation projects were undertaken. First, comparisons were made to benchmark data from literature. These calculations demonstrate the accuracy of the new data and transport routines to better than 25 percent. Second, the ability to

  18. The analysis of reactions {pi}N {yields} two mesons + N within reggeon exchanges. Basic formulas for fit

    SciTech Connect

    Anisovich, V. V. Sarantsev, A. V.

    2009-11-15

    We present technical aspects of the fitting procedure given in the paper by V.V. Anisovich and A.V. Sarantsev 'The analysis of reactions {pi}N {yields} two mesons + N within reggeon exchanges. Fit and results.'

  19. Calculated potential surfaces for the reactions: O + N2 yields NO + N and N + O2 yields NO + O

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.; Jaffe, Richard J.

    1986-01-01

    Complete Active Space SCF/Contracted CI (CASSCF/CCI) calculations, using large Gaussian basis sets, are presented for selected portions of the potential surfaces for the reactions in the Zeldovich mechanism for the conversion of N2 to NO. The N + O2 reaction is exoergic by 32 kcal/mole and is computed to have an early barrier of 10.2 kcal/mole for the (sup 2)A(sup prime) surface and 18.0 kcal/mole for the (sup 4)A(sup prime) surface. The O + N2 reaction is endoergic by 75 kcal/mole. The (sup 3)A(sup double prime) surface is calculated to have a late barrier of 0.5 kcal/mole, while the (sup 3)A(sup prime) surface is calculated to have a late barrier of 14.4 kcal/mole.

  20. THE GAS PHASE REACTION OF OZONE WITH 1,3-BUTADIENE: FORMATION YIELDS OF SOME TOXIC PRODUCTS. (R826236)

    EPA Science Inventory

    The formation yields of acrolein, 1,2-epoxy-3-butene and OH radicals have been measured from reaction of ozone with 1,3-butadiene at room temperature and atmosphere pressure. 1,3,5-Trimethyl benzene was added to scavenge OH radicals in measurements of product yields. In separa...

  1. Kinetics of the reaction O + ClO yields Cl + O2

    NASA Technical Reports Server (NTRS)

    Leu, M.-T.

    1984-01-01

    The bimolecular rate constant for the reaction O + ClO yields Cl + O2 has been measured over the temperature range 236-422 K in a discharge flow system using atomic oxygen resonance fluorescence at 130 nm to monitor the decay of O in an excess of ClO. The results are found to be independent of the method used to produce the ClO radical. At 296 K, the rate constant is given by (3.6 + or - 0.7) x 10 to the -11th cu cm/sec and the temperature dependence expressed in Arrhenius form by k2 = (5.0 + or - 1.0) x 10 to the -11th exp-(96 + or - 20)/T cu cm/sec. The results are compared with earlier values, and the implications for stratospheric chemistry are discussed briefly.

  2. Kinetics of the reaction O + ClO yields Cl + O2

    NASA Technical Reports Server (NTRS)

    Margitan, J. J.

    1984-01-01

    The kinetics of the reaction O + ClO yields Cl + O2 (k1) were studied by using resonance fluorescence to monitor the decay of O atoms which had been generated from the laser photolysis of ClO. A discharge flow system was used to generate the ClO and its concentration was measured directly by multipass absorption spectrometry. The results are k1(298) = (4.2 + or -0.8) x 10 to the -11th cu cm/s (including systematic errors) with E/R determined to lie in the range + or - 200 K. The literature data are reviewed and a composite value of k1(T) = 6.0 x 10 to the -11th exp-(100/T) is recommended for stratospheric modeling calculations. The atmospheric implications of the revised rate constant are discussed briefly.

  3. Yield decomposition and excitation energy reconstruction in an incomplete fusion reaction

    SciTech Connect

    Chbihi, A.; Sobotka, L.G.; Majka, Z.; Sarantites, D.G.; Stracener, D.W.; Abenante, V.; Semkow, T.M.; Nicolis, N.G. ); Hensley, D.C.; Beene, J.R.; Halbert, M.L. )

    1991-02-01

    The velocity distribution of fusionlike products formed in the reaction 701 MeV {sup 28}Si+{sup 100}Mo is decomposed into 26 incomplete fusion channels. If Coulomb corrections are neglected the yields of the incomplete fusion channels correlate much better with the {ital Q} value for projectile fragmentation than with the {ital Q} value for incomplete fusion. However, the correlation is much improved for incomplete fusion if a Coulomb correction is included. The partition of linear momentum between various sources is deduced using the measured residue velocity, multicomponent fits to light charged particle spectra, and mean neutron multiplicities. This reconstruction indicates that a substantial fraction of the momentum is not detected by our apparatus when slow residues are produced. With reasonable assumptions about this missing momentum component, the initial excitation of the compoundlike system is calculated as a function of the residue velocity.

  4. Probing a chemical compass: novel variants of low-frequency reaction yield detected magnetic resonance.

    PubMed

    Maeda, Kiminori; Storey, Jonathan G; Liddell, Paul A; Gust, Devens; Hore, P J; Wedge, C J; Timmel, Christiane R

    2015-02-01

    We present a study of a carotenoid-porphyrin-fullerene triad previously shown to function as a chemical compass: the photogenerated carotenoid-fullerene radical pair recombines at a rate sensitive to the orientation of an applied magnetic field. To characterize the system we develop a time-resolved Low-Frequency Reaction Yield Detected Magnetic Resonance (tr-LF-RYDMR) technique; the effect of varying the relative orientation of applied static and 36 MHz oscillating magnetic fields is shown to be strongly dependent on the strength of the oscillating magnetic field. RYDMR is a diagnostic test for involvement of the radical pair mechanism in the magnetic field sensitivity of reaction rates or yields, and has previously been applied in animal behavioural experiments to verify the involvement of radical-pair-based intermediates in the magnetic compass sense of migratory birds. The spectroscopic selection rules governing RYDMR are well understood at microwave frequencies for which the so-called 'high-field approximation' is valid, but at lower frequencies different models are required. For example, the breakdown of the rotating frame approximation has recently been investigated, but less attention has so far been given to orientation effects. Here we gain physical insights into the interplay of the different magnetic interactions affecting low-frequency RYDMR experiments performed in the challenging regime in which static and oscillating applied magnetic fields as well as internal electron-nuclear hyperfine interactions are of comparable magnitude. Our observations aid the interpretation of existing RYDMR-based animal behavioural studies and will inform future applications of the technique to verify and characterize further the biological receptors involved in avian magnetoreception. PMID:25537133

  5. Status of the prototype Pulsed Photonuclear Assessment (PPA) inspection system

    NASA Astrophysics Data System (ADS)

    Jones, James L.; Blackburn, Brandon W.; Norman, Daren R.; Watson, Scott M.; Haskell, Kevin J.; Johnson, James T.; Hunt, Alan W.; Harmon, Frank; Moss, Calvin

    2007-08-01

    The Idaho National Laboratory, in collaboration with Idaho State University's Idaho Accelerator Center and the Los Alamos National Laboratory, continues to develop the Pulsed Photonuclear Assessment (PPA) technique for shielded nuclear material detection in large volume configurations, such as cargo containers. In recent years, the Department of Homeland Security has supported the development of a prototype PPA cargo inspection system. This PPA system integrates novel neutron and gamma-ray detectors for nuclear material detection along with a complementary and unique gray scale, density mapping component for significant shield material detection. This paper will present the developmental status of the prototype system, its detection performance using several INL Calibration Pallets, and planned enhancements to further increase its nuclear material detection capability.

  6. GEANT 4 simulation of (99)Mo photonuclear production in nanoparticles.

    PubMed

    Dikiy, N P; Dovbnya, A N; Fedorchenko, D V; Khazhmuradov, M A

    2016-08-01

    GEANT 4 Monte-Carlo simulation toolkit is used to study the kinematic recoil method of (99)Mo photonuclear production. Simulation for bremsstrahlung photon spectrum with maximum photon energy 30MeV showed that for MoO3 nanoparticle escape fraction decreases from 0.24 to 0.08 when nanoparticle size increases from 20nm to 80nm. For the natural molybdenum and pure (100)Mo we obtained the lower values: from 0.17 to 0.05. The generation of accompanying molybdenum nuclei is significantly lower for pure (100)Mo and is about 3.6 nuclei per single (99)Mo nucleus, while natural molybdenum nanoparticle produce about 48 accompanying nuclei. Also, we have shown that for high-energy photons escape fraction of (99)Mo decreases, while production of unwanted molybdenum isotopes is significantly higher. PMID:27156050

  7. Photonuclear-based Detection of Nuclear Smuggling in Cargo Containers

    NASA Astrophysics Data System (ADS)

    Jones, J. L.; Haskell, K. J.; Hoggan, J. M.; Norman, D. R.; Yoon, W. Y.

    2003-08-01

    The Idaho National Engineering and Environmental Laboratory (INEEL) and the Los Alamos National Laboratory (LANL) have performed experiments in La Honda, California and at the Idaho Accelerator Center in Pocatello, Idaho to assess and develop a photonuclear-based detection system for shielded nuclear materials in cargo containers. The detection system, measuring photonuclear-related neutron emissions, is planned for integration with the ARACOR Eagle Cargo Container Inspection System (Sunnyvale, CA). The Eagle Inspection system uses a nominal 6-MeV electron accelerator and operates with safe radiation exposure limits to both container stowaways and to its operators. The INEEL has fabricated custom-built, helium-3-based, neutron detectors for this inspection application and is performing an experimental application assessment. Because the Eagle Inspection system could not be moved to LANL where special nuclear material was available, the response of the Eagle had to be determined indirectly so as to support the development and testing of the detection system. Experiments in California have successfully matched the delayed neutron emission performance of the ARACOR Eagle with that of the transportable INEEL electron accelerator (i.e., the Varitron) and are reported here. A demonstration test is planned at LANL using the Varitron and shielded special nuclear materials within a cargo container. Detector results are providing very useful information regarding the challenges of delayed neutron counting near the photofission threshold energy of 5.5 - 6.0 MeV, are identifying the possible utilization of prompt neutron emissions to allow enhanced signal-to-noise measurements, and are showing the overall benefits of using higher electron beam energies.

  8. Photonuclear-based Detection of Nuclear Smuggling in Cargo Containers

    SciTech Connect

    Jones, J.L.; Haskell, K.J.; Hoggan, J.M.; Norman, D.R.; Yoon, W.Y.

    2003-08-26

    The Idaho National Engineering and Environmental Laboratory (INEEL) and the Los Alamos National Laboratory (LANL) have performed experiments in La Honda, California and at the Idaho Accelerator Center in Pocatello, Idaho to assess and develop a photonuclear-based detection system for shielded nuclear materials in cargo containers. The detection system, measuring photonuclear-related neutron emissions, is planned for integration with the ARACOR Eagle Cargo Container Inspection System (Sunnyvale, CA). The Eagle Inspection system uses a nominal 6-MeV electron accelerator and operates with safe radiation exposure limits to both container stowaways and to its operators. The INEEL has fabricated custom-built, helium-3-based, neutron detectors for this inspection application and is performing an experimental application assessment. Because the Eagle Inspection system could not be moved to LANL where special nuclear material was available, the response of the Eagle had to be determined indirectly so as to support the development and testing of the detection system. Experiments in California have successfully matched the delayed neutron emission performance of the ARACOR Eagle with that of the transportable INEEL electron accelerator (i.e., the Varitron) and are reported here. A demonstration test is planned at LANL using the Varitron and shielded special nuclear materials within a cargo container. Detector results are providing very useful information regarding the challenges of delayed neutron counting near the photofission threshold energy of 5.5 - 6.0 MeV, are identifying the possible utilization of prompt neutron emissions to allow enhanced signal-to-noise measurements, and are showing the overall benefits of using higher electron beam energies.

  9. A Time-Dependent Quantum Dynamics Study of the H2 + CH3 yields H + CH4 Reaction

    NASA Technical Reports Server (NTRS)

    Wang, Dunyou; Kwak, Dochan (Technical Monitor)

    2002-01-01

    We present a time-dependent wave-packet propagation calculation for the H2 + CH3 yields H + CH4 reaction in six degrees of freedom and for zero total angular momentum. Initial state selected reaction probability for different initial rotational-vibrational states are presented in this study. The cumulative reaction probability (CRP) is obtained by summing over initial-state-selected reaction probability. The energy-shift approximation to account for the contribution of degrees of freedom missing in the 6D calculation is employed to obtain an approximate full-dimensional CRP. Thermal rate constant is compared with different experiment results.

  10. Fission Reaction Event Yield Algorithm, FREYA - For event-by-event simulation of fission

    NASA Astrophysics Data System (ADS)

    Verbeke, J. M.; Randrup, J.; Vogt, R.

    2015-06-01

    From nuclear materials accountability to detection of special nuclear material, SNM, the need for better modeling of fission has grown over the past decades. Current radiation transport codes compute average quantities with great accuracy and performance, but performance and averaging come at the price of limited interaction-by-interaction modeling. For fission applications, these codes often lack the capability of modeling interactions exactly: energy is not conserved, energies of emitted particles are uncorrelated, prompt fission neutron and photon multiplicities are uncorrelated. Many modern applications require more exclusive quantities than averages, such as the fluctuations in certain observables (e.g. the neutron multiplicity) and correlations between neutrons and photons. The new computational model, FREYA (Fission Reaction Event Yield Algorithm), aims to meet this need by modeling complete fission events. Thus it automatically includes fluctuations as well as correlations resulting from conservation of energy and momentum. FREYA has been integrated into the LLNL Fission Library, and will soon be part of MCNPX2.7.0, MCNP6, TRIPOLI-4.9, and Geant4.10.

  11. Photonuclear target systems for producing clinically useful quantities of 11C using an electron linear accelerator.

    PubMed

    Piltingsrud, H V; Robbins, P J

    1985-01-01

    Described in this paper are what we believe to be the first practical photonuclear target systems for production of 11C containing CO and CO2 using bremsstrahlung produced from an electron linear accelerator similar to certain radiotherapy accelerators. This is a continuation of work reported earlier concerning a similar target system presently being used for production of 15O-O2. The 11C producing systems utilized liquid carbon dioxide, liquid cyclohexane, and liquid glacial acetic acid target materials. The carbon dioxide and glacial acetic acid target materials produced principally a 11C-CO product material. The cyclohexane target material produced a 11C-hydrocarbon product which was then oxidized to CO2. Target activity yields for these systems, normalized to a 20-cm-long by 10-cm-diam target chamber irradiated in a bremsstrahlung field produced by a 26-MeV, 100-microA electron beam, were 1.9 X 10(8) Bq (5 mCi) at 7.4 X 10(8) Bq g-1 (20 mCi g-1) for carbon dioxide, 1.4 X 10(8) Bq (3.8 mCi) at 3.7 X 10(10) Bq g-1 (1 Ci g-1) for cyclohexane, and 7.4 X 10(8) Bq (20 mCi) at 3.7 X 10(10) Bq g-1 (1 Ci g-1) for glacial acetic acid. PMID:3930932

  12. Application of Molecular Topology for the Prediction of Reaction Yields and Anti-Inflammatory Activity of Heterocyclic Amidine Derivatives

    PubMed Central

    Pla-Franco, Jordi; Gálvez-Llompart, María; Gálvez, Jorge; García-Domenech, Ramón

    2011-01-01

    Topological-mathematical models based on multiple linear regression analyses have been built to predict the reaction yields and the anti-inflammatory activity of a set of heterocylic amidine derivatives, synthesized under environmental friendly conditions, using microwave irradiation. Two models with three variables each were selected. The models were validated by cross-validation and randomization tests. The final outcome demonstrates a good agreement between the predicted and experimental results, confirming the robustness of the method. These models also enabled the screening of virtual libraries for new amidine derivatives predicted to show higher values of reaction yields and anti-inflammatory activity. PMID:21541058

  13. Role of CO vibration in the complex-forming OH+CO{yields}H+CO{sub 2} reaction

    SciTech Connect

    Valero, Rosendo; Kroes, Geert-Jan

    2004-10-01

    The time-dependent wave packet method has been used to compute full-dimensional, initial-state selected total reaction probabilities for OH+CO{yields}H+CO{sub 2}, for the total angular momentum J=0. The results show a large increase in reactivity upon vibrational excitation of the CO bond. A comparison to results of an approximate model, in which the CO bond is treated diabatically, shows that the increase in reactivity with vibrational excitation is mostly due to a vibrationally inelastic energy transfer from CO to the reaction coordinate. The nonreactive CO bond does not act as a spectator in the reaction.

  14. Evaluating rates and yields of second-order, photoinitiated reactions under conditons of Gaussian-profile excitation

    SciTech Connect

    Cambron, R.T.; Zhu, X.R.; Harris, J.M.

    1994-09-01

    Under conditions of Gaussian radial profile excitation, a mixed-order kinetic model is used to interpret the rates and yields of photoinitiated reactions. This model is used to determine the triplet-triplet annihilation rate constant for benzophenone in acetonitrile and anthracene at room temperature. 34 refs., 9 figs.

  15. Assessing future drought impacts on yields based on historical irrigation reaction to drought for four major crops in Kansas.

    PubMed

    Zhang, Tianyi; Lin, Xiaomao

    2016-04-15

    Evaluation of how historical irrigation reactions can adapt to future drought is indispensable to irrigation policy, however, such reactions are poorly quantified. In this paper, county-level irrigation data for maize, soybean, grain sorghum, and wheat crops in Kansas were compiled. Statistical models were developed to quantify changes of irrigation and yields in response to drought for each crop. These were then used to evaluate the ability of current irrigation to cope with future drought impacts on each crop based on an ensemble Palmer Drought Severity Index (PDSI) prediction under the Representative Concentration Pathways 4.5 scenario. Results indicate that irrigation in response to drought varies by crop; approximately 10 to 13% additional irrigation was applied when PDSI was reduced by one unit for maize, soybean, and grain sorghum. However, the irrigation reaction for wheat exhibits a large uncertainty, indicating a weaker irrigation reaction. Analysis of future climate conditions indicates that maize, soybean, and grain sorghum yields would decrease 2.2-12.4% at the state level despite additional irrigation application induced by drought (which was expected to increase 5.1-19.0%), suggesting that future drought will exceed the range that historical irrigation reactions can adapt to. In contrast, a lower reduction (-0.99 to -0.63%) was estimated for wheat yields because wetter climate was projected in the central section of the study area. Expanding wheat areas may be helpful in avoiding future drought risks for Kansas agriculture. PMID:26851757

  16. Temperature dependent product yields for the spin forbidden singlet channel of the C(3P) + C2H2 reaction

    NASA Astrophysics Data System (ADS)

    Hickson, Kevin M.; Loison, Jean-Christophe; Wakelam, Valentine

    2016-08-01

    The atomic hydrogen formation channels of the C + C2H2 reaction have been investigated using a continuous supersonic flow reactor over the 52-296 K temperature range. H-atoms were detected directly at 121.567 nm by vacuum ultraviolet laser induced fluorescence. Absolute H-atom yields were determined by comparison with the H-atom signal generated by the C + C2H4 reaction. The product yields agree with earlier crossed beam experiments employing universal detection methods. Incorporating these branching ratios in a gas-grain model of dense interstellar clouds increases the c-C3H abundance. This reaction is a minor source of C3-containing molecules in the present simulations.

  17. Measurement of fission yields from the 241Am(2nth,f) reaction at the Lohengrin Spectrometer

    NASA Astrophysics Data System (ADS)

    Amouroux, Ch.; Blanc, A.; Bidaud, A.; Capellan, N.; Chabod, S.; Chebboubi, A.; Faust, H.; Kessedjian, G.; Köster, U.; Lemaitre, J.-F.; Letourneau, A.; Martin, F.; Materna, T.; Panebianco, S.; Sage, Ch.; Serot, O.

    2013-12-01

    The study of fission yields has a major impact on the characterization and understanding of the fission process and is mandatory for reactor applications. While the yields are known for the major actinides (235U, 239Pu) in the thermal neutron-induced fission, only few measurements have been performed on 242Am. This paper presents the results of a measurement at the Lohengrin mass spectrometer (ILL, France) on the reaction 241Am(2nth,f): a total of 41 mass yields in the light and the heavy peaks have been measured and compared with the fission process simulation code GEF. Modus operandi and first results of a second experiment performed in May 2013 on the same reaction but with the goal of extracting the isotopic yields are presented as well: 8 mass yields were re-measured and 18 isotopic yields have been investigated and are being analyzed. Results concerning the kinetic energy and its comparison with the GEF Code are also presented in this paper.

  18. Reactions of ozone with. alpha. -pinene and. beta. -pinene in air: Yields of gaseous and particulate products

    SciTech Connect

    Hatakeyama, S.; Izumi, K.; Fukuyama, T.; Akimoto, H. )

    1989-09-20

    Reactions of ozone with {alpha}-prinene and {beta}-pinene were studied for the purpose of obtaining the quantitative yields of gaseous and particulate products. Major gaseous products from {alpha}-pinene were CO, CO{sub 2}, HCHO, and aldehydes mainly composed of pinonaldehyde and nor-pinonaldehyde, while those from {beta}-pinene were CO{sub 2}, HCHO, and 6,6-dimethylbicyclo(3.1.1)heptan-2-one. Average molar yields from {alpha}-pinene were CO; 9{plus minus}1%, CO{sub 2}; 30{plus minus}2%, HCHO; 22{plus minus}1%, and aldehydes; 51{plus minus}6%. Average molar yields from {beta}-pinene were CO{sub 2}; 27{plus minus}2%, HCHO; 76{plus minus}2%, and 6,6-dimethylbicyclo(3.1.1)heptan-2-one; 40{plus minus}2%. Particulate products were found to include pinonaldehyde, nor-pinonaldehyde, pinonic acid, and nor-pinonic acid from {alpha}-pinene. The yields of the particulate aldehydes decreased with the reaction time, whereas the yields of the acids increased. This observation suggests the sequential oxidation of aldehydes to carboxylic acids. From {beta}-pinene, only 6,6-dimethylbicyclo(3.1.1)heptan-2-one was identified as a particulate product. For {alpha}-pinene, most of the products are explainable in terms of the reaction mechanism similar to that for the cyclohexene/ozone reaction, whereas for {beta}-pinene the principal reaction path is that of the doubly substituted Criegee intermediate. The total yields of organic aerosols from both {alpha}- and {beta}-pinene were measured with their concentrations at a lower ppb level. The yields were found almost constant in a pinene concentration range from 10 up to 100 ppb, being 18.3{plus minus}1.1 and 13.8{plus minus}0.8% for {alpha}- and {beta}-pinene, respectively, which are much lower than the previously reported values. {copyright} American Geophysical Union 1989

  19. Shock tube study of the reaction H plus O2 plus Ar yields HO2 plus Ar

    NASA Technical Reports Server (NTRS)

    Jachimowski, C. J.; Houghton, W. M.

    1972-01-01

    Rate coefficient data for the recombination reaction H + 02 + Ar yields H02 + Ar have been determined from studies of lean hydrogen-oxygen mixtures behind incident shock waves over the temperature range of 948 to 1125 K. Hydroxyl radical concentration profiles were measured by ultraviolet absorption spectroscopy, and rate data were obtained through analysis of induction time and exponential growth parameter data. Analysis of the data yielded a rate coefficient which was generally lower than most of the more recent values obtained from shock tube studies. The effect of boundary layer formation on the conditions behind the shock was also examined and found to be negligible.

  20. Rate constant measurements for the reaction Cl + CH2O yields HCl + CHO Implications regarding the removal of stratospheric chlorine

    NASA Technical Reports Server (NTRS)

    Anderson, P. C.; Kurylo, M. J.

    1979-01-01

    The flash photolysis resonance fluorescence technique was employed to investigate the rate constant for the reaction Cl + CH2O yields HCl + CHO from 223 to 323 K. An Arrhenius fit of the data gives a rate constant equal to (1.09 + or - 0.40) x 10 to the -10th exp/-(131 + or - 98)/T/ in units of cu cm/molecule per sec. The results are compared to two very recent kinetic studies and are assessed in view of the reaction's role in disrupting the Cl-ClO stratospheric ozone depletion chain.

  1. A Modified activation method for reaction total cross section and yield measurements at low astrophysically relevant energies

    NASA Astrophysics Data System (ADS)

    Artemov, S. V.; Igamov, S. B.; Karakhodjaev, A. A.; Radyuk, G. A.; Tojiboyev, O. R.; Salikhbaev, U. S.; Ergashev, F. Kh.; Nam, I. V.; Aliev, M. K.; Kholbaev, I.; Rumi, R. F.; Khalikov, R. I.; Eshkobilov, Sh. Kh.; Muminov, T. M.

    2016-07-01

    The activation method is proposed for collection of the sufficient statistics during the investigation of the nuclear astrophysical reactions at low energies with the short-living residual nuclei formation. The main feature is a multiple cyclical irradiation of a target by an ion beam and measurement of the radioactivity decay curve. The method was tested by the yield measurement of the 12C(p,γ)13N reaction with detecting the annihilation γγ- coincidences from 13N(β+ν)13C decay at the two-arm scintillation spectrometer.

  2. Detailed photonuclear cross-section calculations and astrophysical applications

    SciTech Connect

    Gardner, D.G.; Gardner, M.A.; Hoff, R.W.

    1989-06-15

    We have investigated the role of an isomeric state and its coupling to the ground state (g.s.) via photons and neutron inelastic scattering in a stellar environment by making detailed photonuclear and neutron cross-section calculations for /sup 176/Lu and /sup 210/Bi. In the case of /sup 176/Lu, the g.s. would function as an excellent galactic slow- (s-) process chronometer were it not for the 3.7-h isomer at 123 keV. Our calculations predicted much larger photon cross sections for production of the isomer, as well as a lower threshold, than had been assumed based on earlier measurements. These two factors combine to indicate that an enormous correction, a factor of 10/sup 7/, must be applied to shorten the current estimate of the half-life against photoexcitation of /sup 176/Lu as a function of temperature. This severely limits the use of /sup 176/Lu as a stellar chronometer and indicates a significantly lower temperature at which the two states reach thermal equilibrium. For /sup 210/Bi, our preliminary calculations of the production and destruction of the 3 /times/ 10/sup 6/ y isomeric state by neutrons and photons suggest that the /sup 210/Bi isomer may not be destroyed by photons as rapidly as assumed in certain stellar environments. This leads to an alternate production path of /sup 207/Pb and significantly affects presently interpreted lead isotopic abundances. We have been able to make such detailed nuclear cross-section calculations using: modern statistical-model codes of the Hauser-Feshbach type, with complete conservation of angular momentum and parity; reliable systematics of the input parameters required by these codes, including knowledge of the absolute gamma-ray strength-functions for E1, M1, and E2 transitions; and codes developed to compute large, discrete, nuclear level sets, their associated gamma-ray branchings, and the presence and location of isomeric states. 7 refs., 2 figs.

  3. Miniature high-throughput chemosensing of yield, ee, and absolute configuration from crude reaction mixtures.

    PubMed

    Bentley, Keith W; Zhang, Peng; Wolf, Christian

    2016-02-01

    High-throughput experimentation (HTE) has emerged as a widely used technology that accelerates discovery and optimization processes with parallel small-scale reaction setups. A high-throughput screening (HTS) method capable of comprehensive analysis of crude asymmetric reaction mixtures (eliminating product derivatization or isolation) would provide transformative impact by matching the pace of HTE. We report how spontaneous in situ construction of stereodynamic metal probes from readily available, inexpensive starting materials can be applied to chiroptical chemosensing of the total amount, enantiomeric excess (ee), and absolute configuration of a wide variety of amines, diamines, amino alcohols, amino acids, carboxylic acids, α-hydroxy acids, and diols. This advance and HTS potential are highlighted with the analysis of 1 mg of crude reaction mixtures of a catalytic asymmetric reaction. This operationally simple assay uses a robust mix-and-measure protocol, is amenable to microscale platforms and automation, and provides critical time efficiency and sustainability advantages over traditional serial methods. PMID:26933684

  4. Kinetics of the reaction OH + H2O2 yields HO2 + H2O

    NASA Technical Reports Server (NTRS)

    Sridharan, U. C.; Reimann, B.; Kaufman, F.

    1980-01-01

    The paper describes an experimental study of the title reaction that uses the discharge-flow technique, laser-induced-fluorescence detection of OH and simultaneous monitoring of O and H atoms in the 250-459 K range. The reaction is normal and free from surface effect interference in Teflon or halocarbon wax-coated tube, but not in clean Pyrex. OH radicals are generated in three ways and at low concentrations to eliminate side reactions. The rate constants were determined at 298 K and over the 250-459 K range, with a factor of two higher at 298 K and factors of 3 to 5 higher at 10 to 30 km altitude in the terrestrial atmosphere than previous studies have indicated. The effect of the higher rate constant on atmospheric processes and on recent laboratory measurements of other reactions is also discussed.

  5. Miniature high-throughput chemosensing of yield, ee, and absolute configuration from crude reaction mixtures

    PubMed Central

    Bentley, Keith W.; Zhang, Peng; Wolf, Christian

    2016-01-01

    High-throughput experimentation (HTE) has emerged as a widely used technology that accelerates discovery and optimization processes with parallel small-scale reaction setups. A high-throughput screening (HTS) method capable of comprehensive analysis of crude asymmetric reaction mixtures (eliminating product derivatization or isolation) would provide transformative impact by matching the pace of HTE. We report how spontaneous in situ construction of stereodynamic metal probes from readily available, inexpensive starting materials can be applied to chiroptical chemosensing of the total amount, enantiomeric excess (ee), and absolute configuration of a wide variety of amines, diamines, amino alcohols, amino acids, carboxylic acids, α-hydroxy acids, and diols. This advance and HTS potential are highlighted with the analysis of 1 mg of crude reaction mixtures of a catalytic asymmetric reaction. This operationally simple assay uses a robust mix-and-measure protocol, is amenable to microscale platforms and automation, and provides critical time efficiency and sustainability advantages over traditional serial methods. PMID:26933684

  6. Evidence for a scalar meson resonance in the {pi}{sup -}p{yields}n{omega}{phi} reaction

    SciTech Connect

    Ivashin, A.; Ekimov, A.; Gouz, Yu.; Kachaev, I.; Karyukhin, A.; Konstantinov, V.; Makouski, M.; Matveev, V.; Myagkov, A.; Polyakov, B.; Ryabchikov, D.; Shalanda, N.; Soldatov, M.; Solodkov, A. A.; Solodkov, A. V.; Solovianov, O.; Sugonyaev, V.; Salomatin, Yu.; Volkov, E.; Khokhlov, Yu.

    2010-08-05

    The charge-exchange reaction {pi}{sup -}p{yields}n{omega}(780){phi}(1020) is studied with the VES setup. The ({omega}{phi}) system is observed at relatively low background. Its invariant mass distribution peaks near threshold. The two-particles partial wave analyses shows that the J{sup pc} = 0{sup ++} state dominates. This wave is compared with 0{sup ++} component in the ({omega}{omega}) system at the comparable mass, which was measured earlier.

  7. Detailed mechanism of the CH2I + O2 reaction: Yield and self-reaction of the simplest Criegee intermediate CH2OO

    NASA Astrophysics Data System (ADS)

    Ting, Wei-Lun; Chang, Chun-Hung; Lee, Yu-Fang; Matsui, Hiroyuki; Lee, Yuan-Pern; Lin, Jim-Min, Jr.

    2014-09-01

    The application of a new reaction scheme using CH2I + O2 to generate the simplest Criegee intermediate, CH2OO, has stimulated lively research; the Criegee intermediates are extremely important in atmospheric chemistry. The detailed mechanism of CH2I + O2 is hence important in understanding kinetics involving CH2OO. We employed ultraviolet absorption to probe simultaneously CH2I2, CH2OO, CH2I, and IO in the reaction system of CH2I + O2 upon photolysis at 248 nm of a flowing mixture of CH2I2, O2, and N2 (or SF6) in the pressure range 7.6-779 Torr to investigate the reaction kinetics. With a detailed mechanism to model the observed temporal profiles of CH2I, CH2OO, and IO, we found that various channels of the reaction CH2I + O2 and CH2OO + I play important roles; an additional decomposition channel of CH2I + O2 to form products other than CH2OO or ICH2OO becomes important at pressure less than 60 Torr. The pressure dependence of the derived rate coefficients of various channels of reactions of CH2I + O2 and CH2OO + I has been determined. We derived a rate coefficient also for the self-reaction of CH2OO as k = (8 ± 4) × 10-11 cm3 molecule-1 s-1 at 295 K. The yield of CH2OO from CH2I + O2 was found to have a pressure dependence on N2 and O2 smaller than in previous reports; for air under 1 atm, the yield of ˜30% is about twice of previous estimates.

  8. Gas-phase reaction products and yields of terpinolene with ozone and nitric oxide using a new derivatization agent

    NASA Astrophysics Data System (ADS)

    Ham, Jason E.; Jackson, Stephen R.; Harrison, Joel C.; Wells, J. R.

    2015-12-01

    The new derivatization agent, O-tert-butylhydroxylamine hydrochloride (TBOX) was used to investigate the carbonyl reaction products from terpinolene ozonolysis. With ozone (O3) as the limiting reagent, four carbonyl compounds were detected: methylglyoxal (MG), 4-methylcyclohex-3-en-1-one, (4MCH), 6-oxo-3-(propan-2-ylidene) heptanal (6OPH), and 3,6-dioxoheptanal (36DOH). The tricarbonyl 36DOH has not been previously observed. Using cyclohexane as a hydroxyl radical (OHrad) scavenger, the yields of 6OPH and 36DOH were reduced indicating the influence secondary OHrad radicals have on terpinolene ozonolysis products. However, the MG yield increased and the 4MCH yield was unchanged when OHrad radicals were scavenged suggesting they are only made by the terpinolene + O3 reaction. The detection of 36DOH using TBOX highlights the advantages of a smaller molecular weight derivatization agent for the detection of multi-carbonyl compounds. The product yields from terpinolene ozonolysis experiments conducted in the presence of 20 ppb nitric oxide (NO) remained unchanged except for MG which decreased. However, in experiments where O3 was kept constant at 50 ppb and NO was varied (20, 50, 100 ppb) MG, 6OPH, 36DOH decreased with increasing NO while 4MCH increased with increasing NO. The use of TBOX derivatization if combined with other derivatization agents may address a recurring need to simply and accurately detect multi-functional oxygenated species in air.

  9. Water vapor effect on the HNO3 yield in the HO2 + NO reaction: experimental and theoretical evidence.

    PubMed

    Butkovskaya, Nadezhda; Rayez, Marie-Thérèse; Rayez, Jean-Claude; Kukui, Alexandre; Le Bras, Georges

    2009-10-22

    The influence of water vapor on the production of nitric acid in the gas-phase HO(2) + NO reaction was determined at 298 K and 200 Torr using a high-pressure turbulent flow reactor coupled with a chemical ionization mass spectrometer. The yield of HNO(3) was found to increase linearly with the increase of water concentration reaching an enhancement factor of about 8 at [H(2)O] = 4 x 10(17) molecules cm(-3) ( approximately 50% relative humidity). A rate constant value k(1bw) = 6 x 10(-13) cm(3) molecule(-1) s(-1) was derived for the reaction involving the HO(2)xH(2)O complex: HO(2)xH(2)O + NO --> HNO(3) (1bw), assuming that the water enhancement is due to this reaction. k(1bw) is approximately 40 times higher than the rate constant of the reaction HO(2) + NO --> HNO(3) (1b), at the same temperature and pressure. The experimental findings are corroborated by density functional theory (DFT) calculations performed on the H(2)O/HO(2)/NO system. The significance of this result for atmospheric chemistry and chemical amplifier instruments is briefly discussed. An appendix containing a detailed consideration of the possible contribution from the surface reactions in our previous studies of the title reaction and in the present one is included. PMID:19780600

  10. Vibrational state-resolved differential cross sections for the D + H sub 2 yields DH + H reaction

    SciTech Connect

    Continetti, R.E.

    1989-11-01

    In this thesis, crossed-molecular-beams studies of the reaction D + H{sub 2} {yields} DH + H at collision energies of 0.53 and 1.01 eV are reported. Chapter 1 provides a survey of important experimental and theoretical studies on the dynamics of the hydrogen exchange reaction. Chapter 2 discusses the development of the excimer-laser photolysis D atom beam source that was used in these studies and preliminary experiments on the D + H{sub 2} reaction. In Chapter 3, the differential cross section measurements are presented and compared to recent theoretical predictions. The measured differential cross sections for rotationally excited DH products showed significant deviations from recent quantum scattering calculations, in the first detailed comparison of experimental and theoretical differential cross sections. These results indicate that further work on the H{sub 3} potential energy surface, particularly the bending potential, is in order.

  11. Evaluation of Mungbean Genotypes Based on Yield Stability and Reaction to Mungbean Yellow Mosaic Virus Disease

    PubMed Central

    Alam, AKM Mahbubul; Somta, Prakit; Jompuk, Choosak; Chatwachirawong, Prasert; Srinives, Peerasak

    2014-01-01

    This work was conducted to identify mungbean genotypes showing yield stability and resistance to mungbean yellow mosaic virus (MYMV) disease. Sixteen genotypes were evaluated in a randomized complete block design with two replications for two years (2011 and 2012) at three locations (Gazipur, Ishurdi and Madaripur) of the Bangladesh Agricultural Research Institute. An analysis of variance exhibited significant effects of genotype (G), environment (E), and genotype × environment (G×E) on grain yield. Among eight agronomic characters, the principal component 1 (PC1) was always higher than the PC2. Considering G×E interaction, BM6 was the best genotype at all three locations in both years. Based on grain yield and stability performance, BM6 ranked first while the worst performing genotypes were BM1 and G10. Based on discrimination and representation, Gazipur was identified as an ideal environment for these mungbeans. Relationship between soil-plant analysis developments (SPAD) value was positive with yield but negative with MYMV severity. BM6, G1 and G2 were considered as promising sources of resistance for low disease score and stable response across the environments. The environment proved to have an influence on MYMV infection under natural infestation. A positive correlation was observed between disease score and the temperature under natural growing condition. PMID:25289012

  12. 1,3-Dipolar Cycloaddition Reactions of Azomethine Ylides with Carbonyl Dipolarophiles Yielding Oxazolidine Derivatives.

    PubMed

    Meyer, Adam G; Ryan, John H

    2016-01-01

    We provide a comprehensive account of the 1,3-dipolar cycloaddition reactions of azomethine ylides with carbonyl dipolarophiles. Many different azomethine ylides have been studied, including stabilized and non-stabilized ylides. Of the carbonyl dipolarophiles, aldehydes including formaldehyde are the most studied, although there are now examples of cycloadditions with ketones, ketenes and carboxyl systems, in particular isatoic anhydrides and phthalic anhydrides. Intramolecular cycloadditions with esters can also occur under certain circumstances. The oxazolidine cycloadducts undergo a range of reactions triggered by the ring-opening of the oxazolidine ring system. PMID:27455230

  13. Process for chemical reaction of amino acids and amides yielding selective conversion products

    DOEpatents

    Holladay, Jonathan E.

    2006-05-23

    The invention relates to processes for converting amino acids and amides to desirable conversion products including pyrrolidines, pyrrolidinones, and other N-substituted products. L-glutamic acid and L-pyroglutamic acid provide general reaction pathways to numerous and valuable selective conversion products with varied potential industrial uses.

  14. Yield of delayed neutrons in the thermal-neutron-induced reaction 245Cm( n, f)

    NASA Astrophysics Data System (ADS)

    Andrianov, V. R.; Vyachin, V. N.; Gundorin, N. A.; Druzhinin, A. A.; Zhdanova, K. V.; Lihachev, A. N.; Pikelner, L. B.; Rebrova, N. V.; Salamatin, I. M.; Furman, V. I.

    2008-10-01

    The yield of delayed neutrons, v d , from thermal-neutron-induced fission of 245Cm is measured. Experiments aimed at studying the properties of delayed neutrons from the fission of some reactor isotopes and initiated in 1997 were continued at the upgraded Isomer-M facility by a method according to which a periodic irradiation of a sample with a pulsed neutron beam from the IBR-2 reactor was accompanied by recording emitted neutrons in the intervals between the pulses. The accuracy of the resulting total delayed-neutron yield v d = (0.64 ± 0.02)% is two times higher than that in previous measurements. This work was performed at the Frank Laboratory of Neutron Physics at the Joint Institute for Nuclear Research (JINR, Dubna).

  15. Reduction of lunar basalt 70035: Oxygen yield and reaction product analysis

    NASA Technical Reports Server (NTRS)

    Gibson, Michael A.; Knudsen, Christian W.; Bruenemen, David J.; Allen, Carlton C.; Kanamori, Hiroshi; Mckay, David S.

    1994-01-01

    Oxygen production from a lunar rock has been experimentally demonstrated for the first time. A 10 g sample of high-Ti basalt 70035 was reduced with hydrogen in seven experiments at temperatures of 900-1050 C and pressures of 14.7-150 psia. In all experiments, water evolution began almost immediately and was essentially complete in tens of minutes. Oxygen yields ranged from 2.93 to 4.61% of the starting sample weight, and showed weak dependence on temperature and pressure. Analysis of the solid samples demonstrated total reduction of Fe(2+) in ilmenite and small degrees of reduction in olivine and pyroxene. Ti O2 was also partially reduced to one or more suboxides. Data from these experiments provide a basis for predicting the yield of oxygen from lunar basalt as well as new constraints on natural reduction in the lunar regolith.

  16. Kinetics of the reaction O + HO2 yields OH + O2 from 229 to 372 K

    NASA Technical Reports Server (NTRS)

    Keyser, L. F.

    1982-01-01

    The discharge-flow resonance fluorescence technique has been used to obtain absolute rate data for the O + HO2 reaction from 229 to 372 K at a total pressure of 1 torr. Pseudo-first-order conditions were used with HO2 concentrations in large excess over initial atomic oxygen in order to minimize interference from secondary reactions. The results are independent of the method used to generate HO2 and atomic oxygen. At 299 K, the result is (6.1 + or - 0.4) x 10 to the -11th cu cm/molecule s. The temperature dependence expressed in Arrhenius form is (3.1 + or - 0.3) x 10 to the -11th exp/(+200 + or - 28)/T/. The error limits given are twice the standard deviation; overall experimental error is estimated to be + or - 25%.

  17. Laboratory measurement of secondary pollutant yields from ozone reaction with HVAC filters.

    SciTech Connect

    Destaillats, Hugo; Chen, Wenhao; Apte, Michael; Li, Nuan; Spears, Michael; Almosni, Jérémie; Zhang, Jianshun; Fisk, William J.

    2009-09-09

    We used Proton Transfer Reaction - Mass Spectrometry (PTR-MS) and conventional sampling methods to monitor and identify trace level organic pollutants formed in heterogeneous reactions between ozone and HVAC filters in real time. Experiments were carried out using a bench-scale flow tube reactor operating with dry air and humidified air (50% RH), at realistically high ozone concentrations (150 ppbv). We explored different filter media (i.e., fiberglass and cotton/polyester blends) and different particle loadings (i.e., clean filter and filters loaded with particles for 3 months at the Lawrence Berkeley National Laboratory and the Port of Oakland, CA). Detailed emission dynamics of very low levels of certain organic pollutants from filter media upon ozone exposure in the presence of moisture have been obtained and analyzed.

  18. Determination of the Rate Coefficients of the SO2 plus O plus M yields SO3 plus M Reaction

    NASA Technical Reports Server (NTRS)

    Hwang, S. M.; Cooke, J. A.; De Witt, K. J.; Rabinowitz, M. J.

    2010-01-01

    Rate coefficients of the title reaction R(sub 31) (SO2 +O+M yields SO3 +M) and R(sub 56) (SO2 + HO2 yields SO3 +OH), important in the conversion of S(IV) to S(VI),were obtained at T =970-1150 K and rho (sub ave) = 16.2 micro mol/cubic cm behind reflected shock waves by a perturbation method. Shock-heated H2/ O2/Ar mixtures were perturbed by adding small amounts of SO2 (1%, 2%, and 3%) and the OH temporal profiles were then measured using laser absorption spectroscopy. Reaction rate coefficients were elucidated by matching the characteristic reaction times acquired from the individual experimental absorption profiles via simultaneous optimization of k(sub 31) and k(sub 56) values in the reaction modeling (for satisfactory matches to the observed characteristic times, it was necessary to take into account R(sub 56)). In the experimental conditions of this study, R(sub 31) is in the low-pressure limit. The rate coefficient expressions fitted using the combined data of this study and the previous experimental results are k(sub 31,0)/[Ar] = 2.9 10(exp 35) T(exp ?6.0) exp(?4780 K/T ) + 6.1 10(exp 24) T(exp ?3.0) exp(?1980 K/T ) cm(sup 6) mol(exp ?2)/ s at T = 300-2500 K; k(sub 56) = 1.36 10(exp 11) exp(?3420 K/T ) cm(exp 3)/mol/s at T = 970-1150 K. Computer simulations of typical aircraft engine environments, using the reaction mechanism with the above k(sub 31,0) and k(sub 56) expressions, gave the maximum S(IV) to S(VI) conversion yield of ca. 3.5% and 2.5% for the constant density and constant pressure flow condition, respectively. Moreover, maximum conversions occur at rather higher temperatures (?1200 K) than that where the maximum k(sub 31,0) value is located (approximately 800 K). This is because the conversion yield is dependent upon not only the k(sup 31,0) and k(sup 56) values (production flux) but also the availability of H, O, and HO2 in the system (consumption flux).

  19. Neutron Energy Spectra and Yields from the 7Li(p,n) Reaction for Nuclear Astrophysics

    NASA Astrophysics Data System (ADS)

    Tessler, M.; Friedman, M.; Schmidt, S.; Shor, A.; Berkovits, D.; Cohen, D.; Feinberg, G.; Fiebiger, S.; Krása, A.; Paul, M.; Plag, R.; Plompen, A.; Reifarth, R.

    2016-01-01

    Neutrons produced by the 7Li(p, n)7Be reaction close to threshold are widely used to measure the cross section of s-process nucleosynthesis reactions. While experiments have been performed so far with Van de Graaff accelerators, the use of RF accelerators with higher intensities is planned to enable investigations on radioactive isotopes. In parallel, high-power Li targets for the production of high-intensity neutrons at stellar energies are developed at Goethe University (Frankfurt, Germany) and SARAF (Soreq NRC, Israel). However, such setups pose severe challenges for the measurement of the proton beam intensity or the neutron fluence. In order to develop appropriate methods, we studied in detail the neutron energy distribution and intensity produced by the thick-target 7Li(p,n)7Be reaction and compared them to state-of- the-art simulation codes. Measurements were performed with the bunched and chopped proton beam at the Van de Graaff facility of the Institute for Reference Materials and Measurements (IRMM) using the time-of-flight (TOF) technique with thin (1/8") and thick (1") detectors. The importance of detailed simulations of the detector structure and geometry for the conversion of TOF to a neutron energy is stressed. The measured neutron spectra are consistent with those previously reported and agree well with Monte Carlo simulations that include experimentally determined 7Li(p,n) cross sections, two-body kinematics and proton energy loss in the Li-target.

  20. Full CI studies of the collinear transition state for the reaction F + H2 yields HF + H

    NASA Technical Reports Server (NTRS)

    Bauschlicher, Charles W., Jr.; Taylor, Peter R.

    1987-01-01

    Full CI calculations on the collinear transition state for the reaction F + H2 yields HF + H are reported. The full CI results are compared with those obtained from single-reference and multireference CI calculations and from single-reference CPF calculations. In general, only those methods which attempt to account for the effects of higher excitations, such as CPF or CI plus the Davidson correction, yield a transition-state location and barrier height in good agreement with the full CI. In an extended basis, the effect of higher excitations is estimated to lower the barrier by as much as 1.5 kcal/mol; such an effect would essentially eliminate the present discrepancy between theory and experiment.

  1. The T{sub z} = -1{yields}T{sub z} =0 beta decays and comparison with Charge Exchange reactions

    SciTech Connect

    Molina, F.; Rubio, B.; Fujita, Y.; Gelletly, W.; Collaboration: Santiago Collaboration

    2011-11-30

    Gamow-Teller (GT) transitions can be studied in both {beta} decay and charge exchange (CE) reactions. If isospin is a good quantum number, then the Tz = -1{yields}0 and Tz = +1{yields}0GT mirror transitions, are identical. Therefore, a comparison of the results from studies of {beta} decay and CE should shed light on this assumption. Accordingly we have studied the {beta} decay of the Tz = -1 fp-shell nuclei, {sup 54}Ni, {sup 50}Fe, {sup 46}Cr, and {sup 42}Ti, produced in fragmentation and we have compared our results with the spectra from ({sup 3}He, t) measurements on the mirror Tz = +1 target nuclei studied in high resolution at RCNP, Osaka. The {beta} decay experiments were performed as part of the STOPPED beam RISING campaign at GSI.

  2. A Study of the Nuclear Resonance Fluorescence Reaction Yield Dependence on the Target Thickness of 208PB

    NASA Astrophysics Data System (ADS)

    Negm, Hani; Daito, Izuru; Zen, Heishun; Kii, Toshiteru; Masuda, Kai; Hori, Toshitada; Ohgaki, Hideaki; Hajima, Ryoichi; Shizuma, Toshiyuki; Hayakawa, Takehito; Kikuzawa, Nobuhiro; Toyokawa, Hiroyuki

    2015-10-01

    We have been developing an active, non-destructive detection system based on nuclear resonance fluorescence (NRF) for inspecting special nuclear materials (SNMs) such as 235U in a container at a seaport. The study of the NRF yield dependence on the target thickness of SNMs is required to evaluate the performance of the inspection system. To this end, an NRF experiment has been performed using a laser Compton backscattering γ-ray beam line at New SUBARU in 208Pb. Cylindrical shaped natural lead targets with a 0.5 cm radius and varying thicknesses of 1.0, 1.44, and 3.05 cm were irradiated at a resonance energy of 7.332 MeV. The NRF yield was detected using two HPG detectors with relative efficiencies of 120% and 100% positioned at scattering angles of 90° and 130°, respectively, relative to the incident γ-ray beam. As a result, the NRF yield exhibited a saturation behavior for the thick lead target. An analytic treatment and Monte Carlo simulation using GEANT4 was performed to interpret the reaction yield (RY) of the NRF interaction. The simulation result is in good agreement with the experimental data for the target thickness dependence. The analytic treatment, the NRF RY model, is also in reasonable agreement.

  3. Upper limits for the rate constant for the reaction Br + H2O2 yields HB2 + HO2

    NASA Technical Reports Server (NTRS)

    Leu, M.-T.

    1980-01-01

    Upper limits for the rate constant for the reaction Br + H2O2 yields HBr + HO2 have been measured over the temperature range 298 to 417 K in a discharge flow system using a mass spectrometer as a detector. Results are k sub 1 less than 1.5 x 10 to the -15th power cu cm/s at 298 K and k sub 1 less than 3.0 x 10 to the -15th power cu cm/s at 417 K, respectively. The implication to stratospheric chemistry is discussed.

  4. Kinetics and product yields of the acetyl peroxy + HO2 radical reaction studied by photoionization mass spectrometry

    NASA Astrophysics Data System (ADS)

    Dodson, L. G.; Shen, L.; Savee, J. D.; Eddingsaas, N. C.; Welz, O.; Taatjes, C. A.; Osborn, D. L.; Sander, S. P.; Okumura, M.

    2013-12-01

    The acetyl peroxy radical (CH3C(O)O2) is a key intermediate in the oxidation of carbonyl-containing hydrocarbons in the troposphere. Reaction of acetyl peroxy radicals with HO2 has been suggested as a source of OH radicals in low-NOx environments. Previous work on this reaction observed only two product channels forming (1) peracetic acid and (2) acetic acid. Recent experiments have shown that there is a third channel that generates the radicals OH and acetoxy: CH3C(O)O2 + HO2 → (1) CH3C(O)OOH + O2 (2) CH3C(O)OH + O3 (3) CH3C(O)O + O2 + OH This last pathway to OH formation would then contribute to the apparent isoprene OH recycling suggested by discrepancies between atmospheric models and field observations of OH. There have, however, been significant disagreements among experiments on the yield of OH from reaction of acetyl peroxy radicals with HO2. We report our preliminary studies of acetyl peroxy self-reaction and its reaction with HO2 at 298 K and 8 Torr. Experiments were conducted at the Advanced Light Source synchrotron at the Lawerence Berkeley National Laboratory using tunable VUV ionizing radiation coupled to the Sandia National Laboratory pulsed-laser-photolysis multiplexed photoionization mass spectrometer to detect the time- and isomer-resolved formation of radical intermediates and products. From these results, we report new branching fractions of the three product channels in the acetyl peroxy + HO2 radical reaction.

  5. Effect of Coatings on the Uptake Rate and HONO Yield in Heterogeneous Reaction of Soot with NO2

    NASA Astrophysics Data System (ADS)

    Cruz-Quiñones, M.; Khalizov, A. F.; Zhang, R.

    2009-12-01

    Heterogeneous reaction of nitrogen dioxide on carbon soot aerosols has been suggested as a possible source of nighttime nitrous acid (HONO) in atmosphere boundary layer. Available laboratory data show significant variability in the measured reaction probabilities and HONO yields, making it difficult to asses the atmospheric significance of this process. Moreover, little is known of how aging of soot aerosol through internal mixing with other atmospheric trace constituents will affect the heterogeneous reactivity and HONO production. In this work, the heterogeneous reaction of NO2 on fresh and aged soot films leading to HONO formation was studied through a series of kinetic uptake experiments and HONO yield measurements. Soot samples were prepared by incomplete combustion of propane and kerosene fuels under lean and rich flame conditions. Experiments were performed in a low-pressure, fast-flow reactor coupled to a chemical ionization mass spectrometer (CIMS), using atmospheric-level NO2 concentrations. Heterogeneous uptake coefficients, γ(geom) and γ(BET), were calculated using geometric and internal BET soot surface areas, respectively. The uptake coefficient and the HONO yield depend on the type of fuel and combustion regime and are the highest for soot samples prepared using rich kerosene flame. Although, the internal surface area of soot measured by BET method is a factor of 50 to 500 larger than the geometric surface area, only the top soot layers are involved in heterogeneous reaction with NO2 as follows from the observed weak dependence of γ(geom) and decrease in γ(BET) with increasing sample mass. Heating the soot samples before exposure to NO2 increases the BET surface area, the HONO yield, and the NO2 uptake coefficient due to the removal of the organic fraction from the soot backbone that unblocks active sites and makes them accessible for physical adsorption and chemical reactions. Our results support the oxidation-reduction mechanism involving

  6. Laser Control of Photoassociation in Reaction O+H{yields}OH

    SciTech Connect

    Nishikawa, Kiyoshi; Nagao, Hidemi; Sugimori, Kimikazu

    2007-12-26

    In this work, we simulate the laser-induced photoassociation of the collision reaction O+H to generate the OH molecule. The photoassociation process involves the continuum-discrete transition, and the initial wavepacket corresponding to the collision pair is generally given by a superposition of continuum state. By numerically solving the Schroedinger equation with split-operator method, we can take into account implicitly but completely for the continuum state in the photoassociation process. In our simulation, we find interestingly the above threshold dissociation spectrum due to the continuum-continuum transition as well as the target bound states by the photoassociation. In order to analyze the continuum state involved, we show the effective method by means of the quasicontinuum state on the Morse potential obtained by numerically diagonalizing the total system.

  7. Fission Cross Sections and Fission-Fragment Mass Yields via the Surrogate Reaction Method

    SciTech Connect

    Jurado, B.; Kessedjian, G.; Aiche, M.; Barreau, G.; Bidaud, A.; Czajkowski, S.; Dassie, D.; Haas, B.; Mathieu, L.; Osmanov, B.; Ahmad, I.

    2008-04-17

    The surrogate reaction method is a powerful tool to infer neutron-induced data of short-lived nuclei. After a short overview of the experimental techniques employed in the present surrogate experiments, we will concentrate on a recent measurement to determine neutron-induced fission cross sections for the actinides {sup 242,243}Cm and {sup 241}Am. The latest direct neutron-induced measurement for the {sup 243}Cm fission cross section is questioned by our results, since there are differences of more than 60% in the 0.7 to 7 MeV neutron energy range. Our experimental set-up has also enabled us to measure for the first time the fission fragment ''pseudo-mass'' distributions of {sup 243,244,245}Cm and {sup 242}Am compound nuclei in the excitation energy range from a few MeV to about 25 MeV.

  8. Kinetics of the reaction OH + HO2 yields H2O + O2 at 296 K

    NASA Technical Reports Server (NTRS)

    Sridharan, U. C.; Kaufman, F.; Qiu, L. X.

    1981-01-01

    The rate constant of the title reaction was measured in a discharge-flow reactor by addition of excess HO2 from a movable double injector to a gas stream containing small concentrations of OH. The concentration of OH was measured by laser-induced fluorescence, HO2 by conversion to OH, and H and O by vacuum-UV resonance fluorescence. Five sets of experiments, each with different excess concentration of HO2, gave an average rate constant of (7.5 + or - 1.2) x 10 to the -11th cu cm/s where the error limits (single sigma) include uncertainties of all experimental parameters. This result is compared with other findings and is discussed in terms of its importance in stratospheric chemistry and in rate theory.

  9. An investigation of the role of water on retrograde/condensation reactions and enhanced liquefaction yields

    SciTech Connect

    Miknis, F.P.

    1993-01-01

    The overall objectives of this work are to conduct research that will provide the basis for an improved liquefaction process, and to facilitate our understanding of those processes that occur when coals are initially dissolved. Changes in coal structure that occur during coal drying and steam pretreatments will be measured in order to determine what effect water has on retrograde/condensation reactions, and to determine the mechanism by which water enhances coal reactivity toward liquefaction. Different methods for coal drying wig be investigated to determine if drying can be accomplished without destroying coal reactivity toward liquefaction, thereby making coal drying a relatively economical and efficient method for coal pretreatment. Coal drying methods will include conventional thermal drying, microwave drying, and chemical drying at low temperature. State-of-the-art solid-state nuclear magnetic resonance (NMR) techniques using combined rotation and multiple pulse spectroscopy (CRAMPS) and cross polarization with magic-angle spinning (CP/MAS) will be employed: (1) to measures changes in coal structure brought about by the different methods of drying and by low temperature oxidation, and (2) to obtain direct measurements of changes in the aromatic hydrogen-to-carbon ratio of the solid/semisolid material formed or remaining during pretreatment and the initial stages of liquefaction.

  10. Faster Synthesis of Beta-Diketonate Ternary Europium Complexes: Elapsed Times & Reaction Yields

    PubMed Central

    Lima, Nathalia B. D.; Silva, Anderson I. S.; Gerson, P. C.; Gonçalves, Simone M. C.; Simas, Alfredo M.

    2015-01-01

    β-diketonates are customary bidentate ligands in highly luminescent ternary europium complexes, such as Eu(β-diketonate)3(L)2, where L stands for a nonionic ligand. Usually, the syntheses of these complexes start by adding, to an europium salt such as EuCl3(H2O)6, three equivalents of β-diketonate ligands to form the complexes Eu(β-diketonate)3(H2O)2. The nonionic ligands are subsequently added to form the target complexes Eu(β-diketonate)3(L)2. However, the Eu(β-diketonate)3(H2O)2 intermediates are frequently both difficult and slow to purify by recrystallization, a step which usually takes a long time, varying from days to several weeks, depending on the chosen β-diketonate. In this article, we advance a novel synthetic technique which does not use Eu(β-diketonate)3(H2O)2 as an intermediate. Instead, we start by adding 4 equivalents of a monodentate nonionic ligand L straight to EuCl3(H2O)6 to form a new intermediate: EuCl3(L)4(H2O)n, with n being either 3 or 4. The advantage is that these intermediates can now be easily, quickly, and efficiently purified. The β-diketonates are then carefully added to this intermediate to form the target complexes Eu(β-diketonate)3(L)2. For the cases studied, the 20-day average elapsed time reduced to 10 days for the faster synthesis, together with an improvement in the overall yield from 42% to 69%. PMID:26710103

  11. Comparative reaction of popular high yielding spanish and virginia bunch groundnut varieties to Tobacco streak virus.

    PubMed

    Vemana, K; Jain, R K

    2013-09-01

    Reaction of five spanish (JL 24, TMV 2, Kadiri 6, Kadiri 9 and Anantha) and a virginia (Kadiri 7 Bold) groundnut cultivars was studied against Tobacco streak virus (TSV) by sap inoculation using different age group of plants [7-84 days after sowing (DAS)]. Among different cultivars, incubation period varied from 4 to 28 days and high incubation period recorded in Kadiri 7 Bold. The percent infection decreased with increase in the age of the plants in all the cultivars as it ranged up to 100 % in both pre-flowering (7-21 DAS) and flowering stage (28-63 DAS) plants followed by 50-100 % in maturity stage plants (70-84 DAS) except Kadiri 7 Bold. Similarly, 100 % wilting was observed in pre flowering stage plants against no wilting in maturity stage plants. However, cultivars differed in per cent wilting of flowering stage plants by recording maximum wilting (100 %) in JL24, Kadiri 6 and minimum (25.0 %) in Kadiri 7 Bold. Both localized (necrotic spots, veinal necrosis) and systemic (petiole necrosis, necrotic spots on young leaves, top growing bud and stem necrosis, axillary shoot proliferation, stunting, peg necrosis, pod necrosis, wilting of plant) symptoms induced by TSV were similar among all cultivars without any new symptoms. Prolonged stage of axillary shoot proliferation was observed for the first time in all the cultivars. In maturity stage plants of Kadiri 7 Bold, Kadiri 9 and Anantha, systemic symptoms restricted to leaf and petiole necrosis only. Virus titer varied significantly with the age of plants and inoculum harvest at days post inoculation and least virus titer recorded by Kadiri 7 Bold at all stages of infection. Among different cultivars, Kadiri 7 Bold was least susceptible/tolerant to TSV by registering higher incubation period with less per cent infection, wilt and titer. PMID:24426278

  12. Direct measurements of OH and other product yields from the HO2 + CH3C(O)O2 reaction

    NASA Astrophysics Data System (ADS)

    Winiberg, F. A. F.; Dillon, T. J.; Orr, S. C.; Groß, C. B. M.; Bejan, I.; Brumby, C. A.; Evans, M. J.; Smith, S. C.; Heard, D. E.; Seakins, P. W.

    2015-10-01

    The reaction CH3C(O)O2 + HO2 → CH3C(O)OOH + O2 (Reaction R5a), CH3C(O)OH + O3 (Reaction R5b), CH3 + CO2 + OH + O2 (Reaction R5c) was studied in a series of experiments conducted at 1000 mbar and (293 ± 2) K in the HIRAC simulation chamber. For the first time, products, (CH3C(O)OOH, CH3C(O)OH, O3 and OH) from all three branching pathways of the reaction have been detected directly and simultaneously. Measurements of radical precursors (CH3OH, CH3CHO), HO2 and some secondary products HCHO and HCOOH further constrained the system. Fitting a comprehensive model to the experimental data, obtained over a range of conditions, determined the branching ratios α(R5a) = 0.37 ± 0.10, α(R5b) = 0.12 ± 0.04 and α(R5c) = 0.51 ± 0.12 (errors at 2σ level). Improved measurement/model agreement was achieved using k(R5) = (2.4 ± 0.4) × 10-11 cm3 molecule-1 s-1, which is within the large uncertainty of the current IUPAC and JPL recommended rate coefficients for the title reaction. The rate coefficient and branching ratios are in good agreement with a recent study performed by Groß et al. (2014b); taken together, these two studies show that the rate of OH regeneration through Reaction (R5) is more rapid than previously thought. GEOS-Chem has been used to assess the implications of the revised rate coefficients and branching ratios; the modelling shows an enhancement of up to 5 % in OH concentrations in tropical rainforest areas and increases of up to 10 % at altitudes of 6-8 km above the equator, compared to calculations based on the IUPAC recommended rate coefficient and yield. The enhanced rate of acetylperoxy consumption significantly reduces PAN in remote regions (up to 30 %) with commensurate reductions in background NOx.

  13. Direct measurements of OH and other product yields from the HO2 + CH3C(O)O2 reaction

    NASA Astrophysics Data System (ADS)

    Winiberg, Frank A. F.; Dillon, Terry J.; Orr, Stephanie C.; Groß, Christoph B. M.; Bejan, Iustinian; Brumby, Charlotte A.; Evans, Matthew J.; Smith, Shona C.; Heard, Dwayne E.; Seakins, Paul W.

    2016-03-01

    The reaction CH3C(O)O2 + HO2 → CH3C(O)OOH + O2 (Reaction R5a), CH3C(O)OH + O3 (Reaction R5b), CH3 + CO2 + OH + O2 (Reaction R5c) was studied in a series of experiments conducted at 1000 mbar and (293 ± 2) K in the HIRAC simulation chamber. For the first time, products, (CH3C(O)OOH, CH3C(O)OH, O3 and OH) from all three branching pathways of the reaction have been detected directly and simultaneously. Measurements of radical precursors (CH3OH, CH3CHO), HO2 and some secondary products HCHO and HCOOH further constrained the system. Fitting a comprehensive model to the experimental data, obtained over a range of conditions, determined the branching ratios α(R5a) = 0.37 ± 0.10, α(R5b) = 0.12 ± 0.04 and α(R5c) = 0.51 ± 0.12 (errors at 2σ level). Improved measurement/model agreement was achieved using k(R5) = (2.4 ± 0.4) × 10-11 cm3 molecule-1 s-1, which is within the large uncertainty of the current IUPAC and JPL recommended rate coefficients for the title reaction. The rate coefficient and branching ratios are in good agreement with a recent study performed by Groß et al. (2014b); taken together, these two studies show that the rate of OH regeneration through Reaction (R5) is more rapid than previously thought. GEOS-Chem has been used to assess the implications of the revised rate coefficients and branching ratios; the modelling shows an enhancement of up to 5 % in OH concentrations in tropical rainforest areas and increases of up to 10 % at altitudes of 6-8 km above the equator, compared to calculations based on the IUPAC recommended rate coefficient and yield. The enhanced rate of acetylperoxy consumption significantly reduces PAN in remote regions (up to 30 %) with commensurate reductions in background NOx.

  14. Kinetics of the reactions of HBr with O3 and HO2: The yield of HBr from HO2 + BrO

    NASA Technical Reports Server (NTRS)

    Mellouki, Abdelwahid; Talukdar, Ranajit K.; Howard, Carleton J.

    1994-01-01

    An upper limit on the yield of HBr from reaction (R1) (HO2 + BrO yields products) has been determined by measuring an upper limit for the rate coefficient of the reverse reaction (R1') (HBr + O3 yields HO2 + BrO). The limits measured at 300 and 441 K were extrapolated to low temperatures to determine that the yield of HBr from reaction (R1) is negligible throughout the stratosphere (less than 0.01% of k(sub 1)). An upper limit for the rate coefficient of the reaction of HO2 with HBr was also determined to be very low less than or equal to 3 x 10(exp -17) cu cm/molecule/sec at 300 K and less than or equal to 3 x 10(exp -16) cu cm/molecule/sec at 400 K. The implications of these results to stratospheric chemistry are discussed.

  15. Radiation Safety Aspects for Pulsed Photonuclear Assessment Techniques in Outdoor Operations

    SciTech Connect

    Daren R. Norman; James L. Jones; Brandon W. Blackburn; Allen Fisher; Scott M. Watson; Kevin J. Haskell; Alan W. Hunt; Mark Balzer

    2007-08-01

    As many pulsed photonuclear assessment (PPA) technologies are being developed for contraband detection within cargo container configurations, the radiation safe operation of source linacs for outdoor operations needs to be addressed. Idaho National Laboratory along with Idaho Accelerator Center are conducting field operations with high energy linacs in open outdoor configurations. The relevant information pertaining to the radiation regulations and dosimetry studies for these configurations will be presented for a prototypical 10 MeV PPA nuclear material detection system.

  16. Analysis of polarization observables and radiative effects for the reaction p-bar+p{yields}e{sup +}+e{sup -}

    SciTech Connect

    Gakh, G. I.; Merenkov, N. P.; Tomasi-Gustafsson, E.

    2011-04-15

    The expressions for the differential cross section and polarization observables for the reaction p-bar+p{yields}e{sup +}+e{sup -} are given in terms of the nucleon electromagnetic form factors in the laboratory system, assuming the one-photon exchange. Radiative corrections due to the emission of virtual and real soft photons from the leptons are also calculated. Unlike in the center-of-mass system, they depend on the scattering angle. Polarization effects are derived in the case when the antiproton beam, the target, and the electron in the final state are polarized. Numerical estimations have been done for all observables, using models for the nucleon electromagnetic form factors in the time-like region. The radiative corrections to the differential cross section are calculated as functions of the beam energy and electron angle.

  17. Differential cross sections and spin density matrix elements for the reaction {gamma}p{yields}p{omega}

    SciTech Connect

    Williams, M.; Applegate, D.; Bellis, M.; Meyer, C. A.; Dey, B.; Dickson, R.; Krahn, Z.; McCracken, M. E.; Moriya, K.; Schumacher, R. A.; Adhikari, K. P.; Careccia, S. L.; Dodge, G. E.; Klein, A.; Mayer, M.; Nepali, C. S.; Niroula, M. R.; Seraydaryan, H.; Tkachenko, S.; Weinstein, L. B.

    2009-12-15

    High-statistics differential cross sections and spin-density matrix elements for the reaction {gamma}p{yields}p{omega} have been measured using the CEBAF large acceptance spectrometer (CLAS) at Jefferson Lab for center-of-mass (c.m.) energies from threshold up to 2.84 GeV. Results are reported in 112 10-MeV wide c.m. energy bins, each subdivided into cos{theta}{sub c.m.}{sup {omega}} bins of width 0.1. These are the most precise and extensive {omega} photoproduction measurements to date. A number of prominent structures are clearly present in the data. Many of these have not previously been observed due to limited statistics in earlier measurements.

  18. Partial wave analysis of the reaction {gamma}p{yields}p{omega} and the search for nucleon resonances

    SciTech Connect

    Williams, M.; Applegate, D.; Bellis, M.; Meyer, C. A.; Dey, B; Dickson, R.; Krahn, Z.; McCracken, M. E.; Moriya, K.; Schumacher, R. A.; Adhikari, K. P.; Careccia, S. L.; Dodge, G. E.; Guler, N.; Klein, A.; Mayer, M.; Nepali, C. S.; Niroula, M. R.; Seraydaryan, H.; Tkachenko, S.

    2009-12-15

    An event-based partial wave analysis (PWA) of the reaction {gamma}p{yields}p{omega} has been performed on a high-statistics dataset obtained using the CLAS at Jefferson Lab for center-of-mass energies from threshold up to 2.4 GeV. This analysis benefits from access to the world's first high-precision spin-density matrix element measurements, available to the event-based PWA through the decay distribution of {omega}{yields}{pi}{sup +}{pi}{sup -}{pi}{sup 0}. The data confirm the dominance of the t-channel {pi}{sup 0} exchange amplitude in the forward direction. The dominant resonance contributions are consistent with the previously identified states F{sub 15}(1680) and D{sub 13}(1700) near threshold, as well as the G{sub 17}(2190) at higher energies. Suggestive evidence for the presence of a J{sup P}=5/2{sup +} state around 2 GeV, a ''missing'' state, has also been found. Evidence for other states is inconclusive.

  19. Solar energy storage by the reversible reaction - N2O4 yields 2NO2 - Theoretical and experimental results

    NASA Astrophysics Data System (ADS)

    Ragaini, V.

    1982-01-01

    The suitability of the reversible reaction between N2O4 and 2NO2 for short term solar energy storage applications were examined theoretically and experimentally. N2O4 dissociates completely at 140 C, while NO2 seldom dissociates below 150 C. The heat storage capacity of the reaction 2NO2 yields N2O4 was calculated for the temperature intervals between 0-500 C, showing that a maximum of 195.7 kcal/l is available with liquified 2NO2, compared to 100 kcal/l with water. Nitrogen dioxide was tested in the gas phase in a solar collector. The results indicate a heat storage capacity from 3 to 1.7 times that of water, and its use for a domestic hot water energy source is described. Toxicity problems with 2nO2 and the formation of nitric acid are suggested to be solvable by use of nitrogen dioxide in anhydrous form and in stainless steel apparatus.

  20. Calculation of total free energy yield as an alternative approach for predicting the importance of potential chemolithotrophic reactions in geothermal springs.

    PubMed

    Dodsworth, Jeremy A; McDonald, Austin I; Hedlund, Brian P

    2012-08-01

    To inform hypotheses regarding the relative importance of chemolithotrophic metabolisms in geothermal environments, we calculated free energy yields of 26 chemical reactions potentially supporting chemolithotrophy in two US Great Basin hot springs, taking into account the effects of changing reactant and product activities on the Gibbs free energy as each reaction progressed. Results ranged from 1.2 × 10(-5) to 3.6 J kg(-1) spring water, or 3.7 × 10(-5) to 11.5 J s(-1) based on measured flow rates, with aerobic oxidation of CH(4) or NH4 + giving the highest average yields. Energy yields calculated without constraining pH were similar to those at constant pH except for reactions where H(+) was consumed, which often had significantly lower yields when pH was unconstrained. In contrast to the commonly used normalization of reaction chemical affinities per mole of electrons transferred, reaction energy yields for a given oxidant varied by several orders of magnitude and were more sensitive to differences in the activities of products and reactants. The high energy yield of aerobic ammonia oxidation is consistent with previous observations of significant ammonia oxidation rates and abundant ammonia-oxidizing archaea in sediments of these springs. This approach offers an additional lens through which to view the thermodynamic landscape of geothermal springs. PMID:22443686

  1. Reexamination of the astrophysical S factor for the {alpha}+d{yields}{sup 6}Li+{gamma} reaction

    SciTech Connect

    Mukhamedzhanov, A. M.; Blokhintsev, L. D.; Irgaziev, B. F.

    2011-05-15

    Recently, a new measurement of the {sup 6}Li (150 A MeV)dissociation in the field of {sup 208}Pb has been reported [Hammache et al., Phys. Rev. C 82, 065803 (2010)] to study the radiative capture {alpha}+d{yields}{sup 6}Li+{gamma} process. However, the dominance of the nuclear breakup over the Coulomb one prevented the information about the {alpha}+d{yields}{sup 6}Li+{gamma} process from being obtained from the breakup data. The astrophysical S{sub 24}(E) factor has been calculated within the {alpha}-d two-body potential model with potentials determined from the fits to the {alpha}-d elastic scattering phase shifts. However, the scattering phase shift, according to the theorem of the inverse scattering problem, does not provide a unique {alpha}-d bound-state potential, which is the most crucial input when calculating the S{sub 24}(E) astrophysical factor at astrophysical energies. In this work, we emphasize the important role of the asymptotic normalization coefficient (ANC) for {sup 6}Li{yields}{alpha}+d, which controls the overall normalization of the peripheral {alpha}+d{yields}{sup 6}Li+{gamma} process and is determined by the adopted {alpha}-d bound-state potential. Since the potential determined from the elastic scattering data fit is not unique, the same is true for the ANC generated by the adopted potential. However, a unique ANC can be found directly from the elastic scattering phase shift, without invoking intermediate potential, by extrapolation the scattering phase shift to the bound-state pole [Blokhintsev et al., Phys. Rev. C 48, 2390 (1993)]. We demonstrate that the ANC previously determined from the {alpha}-d elastic scattering s-wave phase shift [Blokhintsev et al., Phys. Rev. C 48, 2390 (1993)], confirmed by ab initio calculations, gives S{sub 24}(E), which at low energies is about 38% less than the other one reported [Hammache et al., Phys. Rev. C 82, 065803 (2010)]. We recalculate also the reaction rates, which are lower than those obtained in

  2. Singlet-oxygen generation at gas-liquid interfaces: A significant artifact in the measurement of singlet-oxygen yields from ozone-biomolecule reactions

    SciTech Connect

    Kanofsky, J.R.; Sima, P.D. )

    1993-09-01

    Several ozone-biomolecule reactions have previously been shown to generate singlet oxygen in high yields. For some of these ozone-biomolecule reactions, we now show that the apparent singlet-oxygen yields determined from measurements of 1270 nm chemiluminescence were artifactually elevated by production of gas-phase singlet oxygen. The gas-phase singlet oxygen results from the reaction of gas-phase ozone with biomolecules near the surface of the solution. Through the use of a flow system that excludes air from the reaction chamber, accurate singlet-oxygen yields can be obtained. The revised singlet-oxygen yields (mol 1O2 per mol O3) for the reactions of ozone with cysteine, reduced glutathione, NADH, NADPH, human albumin, methionine, uric acid and oxidized glutathione are 0.23 +/- 0.02, 0.26 +/- 0.2, 0.48 +/- 0.04, 0.41 +/- 0.01, 0.53 +/- 0.06, 1.11 +/- 0.04, 0.73 +/- 0.05 and 0.75 +/- 0.01, respectively. These revised singlet-oxygen yields are still substantial.

  3. Geometric scaling for a detonation wave governed by a pressure-dependent reaction rate and yielding confinement

    NASA Astrophysics Data System (ADS)

    Li, J.; Mi, X.; Higgins, A. J.

    2015-02-01

    The propagation of detonation waves in reactive media bounded by an inert, compressible layer is examined via computational simulations in two different geometries, axisymmetric cylinders, and two dimensional, planar slabs. For simplicity, an ideal gas equation of state is used with a pressure-dependent reaction rate that results in a detonation wave structure that does not exhibit cellular instability. The detonation is initiated as an ideal Chapman-Jouguet (CJ) detonation with a one-dimensional structure, and then allowed to propagate into a finite diameter or thickness layer of explosive surrounded by an inert layer. The yielding confinement of the inert layer results in the detonation wave decaying to a sub-CJ steady state velocity or failing entirely. Simulations are performed with different values of the reaction rate pressure exponent (n = 2 and 3) and different impedance confinement (greater than, less than, and equal to that of the explosive). The velocity decrement and critical dimension (critical diameter or thickness) are determined, and a 2:1 scaling between the cylinder diameter and slab thickness results is confirmed, in good agreement with curvature-based models of detonation propagation. The measured shock front curvature and detonation velocity relation (DN-κ) agrees with the classic model of Wood and Kirkwood. The computational simulations are compared to a simple, analytic model that treats the interaction of the confinement with the detonation products via Newtonian theory and a model that assumes a continuous variation in shock front curvature with the shock angle at the interface with the confinement matching the angle determined by shock polar analysis. The Newtonian model works very well for the case of high impedance confinement, while the shock front curvature model agrees with the simulations for the case of low impedance confinement.

  4. An assay to monitor the activity of DNA transposition complexes yields a general quality control measure for transpositional recombination reactions

    PubMed Central

    Pulkkinen, Elsi; Haapa-Paananen, Saija; Savilahti, Harri

    2014-01-01

    Transposon-based technologies have many applications in molecular biology and can be used for gene delivery into prokaryotic and eukaryotic cells. Common transpositional activity measurement assays suitable for many types of transposons would be beneficial, as diverse transposon systems could be compared for their performance attributes. Therefore, we developed a general-purpose assay to enable and standardize the activity measurement for DNA transposition complexes (transpososomes), using phage Mu transposition as a test platform. This assay quantifies transpositional recombination efficiency and is based on an in vitro transposition reaction with a target plasmid carrying a lethal ccdB gene. If transposition targets ccdB, this gene becomes inactivated, enabling plasmid-receiving Escherichia coli cells to survive and to be scored as colonies on selection plates. The assay was validated with 3 mini-Mu transposons varying in size and differing in their marker gene constitution. Tests with different amounts of transposon DNA provided a linear response and yielded a 10-fold operational range for the assay. The colony formation capacity was linearly correlated with the competence status of the E.coli cells, enabling normalization of experimental data obtained with different batches of recipient cells. The developed assay can now be used to directly compare transpososome activities with all types of mini-Mu transposons, regardless of their aimed use. Furthermore, the assay should be directly applicable to other transposition-based systems with a functional in vitro reaction, and it provides a dependable quality control measure that previously has been lacking but is highly important for the evaluation of current and emerging transposon-based applications. PMID:26442171

  5. APPLICATIONS OF THE PHOTONUCLEAR FRAGMENTATION MODEL TO RADIATION PROTECTION PROBLEMS

    SciTech Connect

    Pavel Degtiarenko

    1996-01-01

    In order to provide radiation protection systems for high energy electron accelerators it is necessary to define the yields of hadrons produced when the electron beam interacts with a fixed target. In practical terms this will occur when any beam or fraction of the beam is lost from the accelerator orbit or when any fraction of the beam is intercepted by a target inserted in the path of the beam or when the beam is totally absorbed by a beam dump. The electron and gamma yields from these interactions are well characterized and amenable to calculation utilizing Monte Carlo shower codes. However, the yield of hadrons has been less well defined. Neutron production has received most attention because of its importance to radiation shielding. Production mechanisms such as the giant dipole and the quasi-deuteron resonances have provided valuable information for total neutron yields for electron beams at energies less than about 400 MeV. For electron beams at energies extending to 10 GeV it is necessary to include the higher energy resonance structures and the various intranuclear production channels that are available for the production of higher energy neutrons. The production model described in this paper permits the calculation of laboratory angle and energy of all hadrons produced when an electron beam of energy between 100 MeV and 10 GeV interacts with a fixed target. This model can be used as an event generator for Monte Carlo codes used for many radiation protection purposes including calculation of radiation shielding.

  6. Kinetics of the reaction OH + HO2 yields H2O + O2 from 254 to 382 K

    NASA Technical Reports Server (NTRS)

    Keyser, Leon F.

    1988-01-01

    The discharge-flow resonance fluorescence technique has been used to determine the absolute rate constant for the reaction OH + HO2 yields H2O + O2 from 254 to 382 K at a total pressure of 1 Torr. Pseudo-=first-order conditions were used with HO2 in large excess over OH. The rate constant was obtained directly from observed decays of OH and measured concentrations of HO2. Since the observed rate constant was found to be very sensitive to small background concentrations of O and H atoms, NO2 was used to remove both atom species from the system. With added NO2 the result at 299 K is (1.1 + or - 0.3) x 10 to the -10th cu cm/molecule where the error limits are one standard deviation and include an estimate of overall experimental uncertainty. The temperature dependence expressed in Arrhenius form is (4.8 + or - 0.8) x 10 to the -11th exp (250 + or - 50)/T. The results are independent of the type of reactor surface and the precursor used to produce OH and HO2. The present results agree well with earlier measurements near 1-atm total pressure and suggest that this rate constant exhibits little or no pressure dependence between 1 and 1000 Torr.

  7. The reaction Cl + H2CO yields HCl + HCO: Decreased sensitivity of stratospheric ozone to chlorine perturbations

    NASA Technical Reports Server (NTRS)

    Stief, L. J.; Michael, J. V.; Payne, W. A.; Nava, D. F.; Butler, D. M.; Stolarski, R. S.

    1978-01-01

    The absolute rate constant for the reaction Cl + H2CO yields HCl + HCO was determined by the flash-photolysis resonance fluorescence method to be 7.5 plus or minus 0.9 (2 sigma) times 10 to the minus 11th power cu cm/molecule sec at 298 K and to have a negligible temperature dependence. This rate which is more than 2000 times faster than the rate of Cl + CH4 indicates that formaldehyde (H2CO) will compete significantly with methane (CH4) for the conversion of active chlorine in the stratosphere to the inactive reservoir HCl. Chlorine will thus be a less efficient destroyer of stratosphere ozone than previously believed. Ambient stratospheric ozone will depend less on the ambient chlorine amount and the predicted response to chlorine perturbations will be lessened. One-dimensional eddy-diffusion photochemical model calculations indicate a factor of 1.1 less sensitivity to chlorine than recently reported. For a steady-state CFM release at 1975 rates (750,000 tons/year) the eventual ozone depletion is now calculated to be 14%.

  8. The rate coefficient for the reaction NO2 + NO3 yielding NO + NO2 + O2 from 273 to 313 K

    NASA Technical Reports Server (NTRS)

    Cantrell, Chris A.; Shetter, Richard E.; Mcdaniel, Anthony H.; Calvert, Jack G.

    1990-01-01

    The ratio of rate constants for the reaction NO3 + NO yielding 2 NO2 (k3) and the reaction NO2 + NO3 yielding NO + NO2 + O2 (k4) were determined by measuring of NO and NO2 concentrations of NO and NO2 in an N2O5/NO2/N2 mixture over the temperature range 273-313 K. The measured ratio was found to be expressed by the equation k3/k4 = 387 exp(-1375/T). The results are consistent with those of Hammer et al. (1986).

  9. Photonuclear fission with quasimonoenergetic electron beams from laser wakefields

    SciTech Connect

    Reed, S. A.; Chvykov, V.; Kalintchenko, G.; Matsuoka, T.; Rousseau, P.; Yanovsky, V.; Vane, C. R.; Beene, J. R.; Stracener, D.; Schultz, D. R.; Maksimchuk, A.

    2006-12-04

    Recent advancements in laser wakefield accelerators have resulted in the generation of low divergence, hundred MeV, quasimonoenergetic electron beams. The bremsstrahlung produced by these highly energetic electrons in heavy converters includes a large number of MeV {gamma} rays that have been utilized to induce photofission in natural uranium. Analysis of the measured delayed {gamma} emission demonstrates production of greater than 3x10{sup 5} fission events per joule of laser energy, which is more than an order of magnitude greater than that previously achieved. Monte Carlo simulations model the generated bremsstrahlung spectrum and compare photofission yields as a function of target depth and incident electron energy.

  10. Effect of the Keto Group on Yields and Composition of Organic Aerosol Formed from OH Radical-Initiated Reactions of Ketones in the Presence of NOx.

    PubMed

    Algrim, Lucas B; Ziemann, Paul J

    2016-09-01

    Yields of secondary organic aerosol (SOA) were measured for OH radical-initiated reactions of the 2- through 6-dodecanone positional isomers and also n-dodecane and n-tetradecane in the presence of NOx. Yields decreased in the order n-tetradecane > dodecanone isomer average > n-dodecane, and the dodecanone isomer yields decreased as the keto group moved toward the center of the molecule, with 6-dodecanone being an exception. Trends in the yields can be explained by the effect of carbon number and keto group presence and position on product vapor pressures, and by the isomer-specific effects of the keto group on branching ratios for keto alkoxy radical isomerization, decomposition, and reaction with O2. Most importantly, results indicate that isomerization of keto alkoxy radicals via 1,5- and 1,6-H shifts are significantly hindered by the presence of a keto group whereas decomposition is enhanced. Analysis of particle composition indicates that the SOA products are similar for all isomers, and that compared to those formed from the corresponding reactions of alkanes the presence of a pre-existing keto group opens up additional heterogeneous/multiphase reaction pathways that can lead to the formation of new products. The results demonstrate that the presence of a keto group alters gas and particle phase chemistry and provide new insights into the potential effects of molecular structure on the products of the atmospheric oxidation of volatile organic compounds and subsequent formation of SOA. PMID:27508315

  11. Pressure and temperature dependence kinetics study of the NO + BrO yielding NO2 + Br reaction - Implications for stratospheric bromine photochemistry

    NASA Technical Reports Server (NTRS)

    Watson, R. T.; Sander, S. P.; Yung, Y. L.

    1979-01-01

    The reactivity of NO with BrO radicals over a wide range of pressure (100-700 torr) and temperature (224-398 K) is investigated using the flash photolysis-ultraviolet absorption technique. The flash photolysis system consists of a high-pressure xenon arc light source, a reaction cell/gas filter/flash lamp combination, and a 216.5 half-meter monochromator/polychromator/spectrography for wavelength selectivity. The details of the reaction and its corresponding Arrhenius expression are identified. The results are compared with previous measurements, and atmospheric implications of the reaction are discussed. The NO + BrO yielding NO2 + Br reaction is shown to be important in controlling the concentration ratios of BrO/Br and BrO/HBr in the stratosphere, but this reaction does not affect the catalytic efficiency of BrOx in ozone destruction.

  12. Formation mechanisms and yields of small imidazoles from reactions of glyoxal with NH4(+) in water at neutral pH.

    PubMed

    Maxut, A; Nozière, B; Fenet, B; Mechakra, H

    2015-08-21

    Imidazoles have numerous applications in pharmacology, chemistry, optics and electronics, making the development of their environmentally-friendly synthetic procedures worthwhile. In this work, the formation of imidazole, imidazole-2-carboxaldehyde, and 2,2-bis-1H-imidazole was investigated in the self-reaction of glyoxal and its cross-reactions with each of these compounds in aqueous solutions of inorganic ammonium salts at pH =7. Such conditions are relevant both as cheap and environmentally-friendly synthetic procedures and for the chemistry of natural environments where NH4(+) is abundant, such as in atmospheric aerosols. These reactions were investigated both by (1)H-NMR and UV-Vis absorption spectroscopy at room temperature with the objective to determine the formation pathways of the three imidazoles and the parameters affecting their yields, to identify the optimal conditions for their synthesis. The results show that only the simplest imidazole is produced by the self-reaction of glyoxal and that imidazole-2-carboxaldehyde and 2,2-bis-1H-imidazole are produced by cross-reactions of glyoxal with imidazole and imidazole-2-carboxaldehyde, respectively. The yields of imidazole-2-carboxaldehyde and 2,2-bis-1H-imidazole formed by the cross-reactions were close to unity, but the yield of imidazole formed by the self-reaction of glyoxal, YIm, was small and varied inversely with the initial glyoxal concentration, [G]0: YIm > 10% only for [G]0 < 0.1 M. The latter result was attributed to the kinetic competition between the imidazole-forming condensation pathway and the acetal/oligomer formation pathway of the glyoxal self-reaction and constitutes a bottleneck for the formation of higher imidazoles. Other parameters such as pH and the NH4(+) concentration did not affect the yields. Thus, by maintaining small glyoxal concentrations, high imidazole yields can be achieved in environmentally-friendly aqueous ammonium solutions at neutral pH. Under the same conditions

  13. Pulsed Photonuclear Assessment (PPA) Technique: CY 04 Year-end Progress Report

    SciTech Connect

    J.L. Jones; W.Y. Yoon; K.J. Haskell; D.R. Norman; J.M. Zabriskie; J.W. Sterbentz; S.M. Watson; J.T. Johnson; B.D. Bennett; R.W. Watson; K. L. Folkman

    2005-05-01

    Idaho National Laboratory (INL), along with Los Alamos National Laboratory (LANL) and Idaho State University’s Idaho Accelerator Center (IAC), are developing an electron accelerator-based, photonuclear inspection technology for the detection of smuggled nuclear material within air-, rail-, and especially, maritime-cargo transportation containers. This CY04 report describes the latest developments and progress with the development of the Pulsed, Photonuclear Assessment (PPA) nuclear material inspection ystem, such as: (1) the identification of an optimal range of electron beam energies for interrogation applications, (2) the development of a new “cabinet safe” electron accelerator (i.e., Varitron II) to assess “cabinet safe-type” operations, (3) the numerical and experimental validation responses of nuclear materials placed within selected cargo configurations, 4) the fabrication and utilization of Calibration Pallets for inspection technology performance verification, 5) the initial technology integration of basic radiographic “imaging/mapping” with induced neutron and gamma-ray detection, 6) the characterization of electron beam-generated photon sources for optimal performance, 7) the development of experimentallydetermined Receiver-Operator-Characterization curves, and 8) several other system component assessments. This project is supported by the Department of Homeland Security and is a technology component of the Science & Technology Active Interrogation Portfolio entitled “Photofission-based Nuclear Material Detection and Characterization.”

  14. Reaction rate sensitivity of 44Ti production in massive stars and implications of a thick target yield measurement of 40Ca(alpha,gamma)44Ti

    SciTech Connect

    Hoffman, R D; Sheets, S A; Burke, J T; Scielzo, N D; Rauscher, T; Norman, E B; Tumey, S; Brown, T A; Grant, P G; Hurst, A M; Phair, L; Stoyer, M A; Wooddy, T; Fisker, J L; Bleuel, D

    2010-02-16

    We evaluate two dominant nuclear reaction rates and their uncertainties that affect {sup 44}Ti production in explosive nucleosynthesis. Experimentally we develop thick-target yields for the {sup 40}Ca({alpha},{gamma}){sup 44}Ti reaction at E{sub {alpha}} = 4.13, 4.54, and 5.36 MeV using {gamma}-ray spectroscopy. At the highest beam energy, we also performed an activation measurement which agrees with the thick target result. From the measured yields a stellar reaction rate was developed that is smaller than current statistical-model calculations and recent experimental results, which would suggest lower {sup 44}Ti production in scenarios for the {alpha}-rich freeze out. Special attention has been paid to assessing realistic uncertainties of stellar reaction rates produced from a combination of experimental and theoretical cross sections. With such methods, we also develop a re-evaluation of the {sup 44}Ti({alpha},p){sup 47}V reaction rate. Using these two rates we carry out a sensitivity survey of {sup 44}Ti synthesis in eight expansions representing peak temperature and density conditions drawn from a suite of recent supernova explosion models. Our results suggest that the current uncertainty in these two reaction rates could lead to as large an uncertainty in {sup 44}Ti synthesis as that produced by different treatments of stellar physics.

  15. A flash photolysis resonance fluorescence investigation of the reaction OH + CH3CCl3 yields H2O + CH2CCl3. [in troposphere

    NASA Technical Reports Server (NTRS)

    Kurylo, M. J.; Anderson, P. C.; Klais, O.

    1979-01-01

    The absolute rate constant for the reaction OH + CH3CCl3 yields H2O + CH2CCl3 was determined by the flash photolysis resonance fluorescence method from 253 to 363K. The use of the Arrhenius equation with atmospheric observational data on methyl chloroform nearly doubles the predicted tropospheric OH reaction sink strength for the removal of atmospheric gases whose lifetimes are controlled by OH. The increased use of methyl chloroform instead of the restricted trichloroethylene focused attention to its role in stratospheric ozone depletion, producing modeling analyses to determine the amount of released methyl chloroform which reaches the stratosphere. Since the primary atmospheric loss of CH3CCl3 is considered by reaction with OH radicals, these data are used to compute an average tropospheric OH concentration and the strength of the 'global tropospheric OH reaction sink'.

  16. Heterogeneous reactions of HNO3(g) + NaCl(s) yields HCl(g) + NaNO3(s) and N2O5(g) + NaCl(s) yields ClNO2(g) + NaNO3(s)

    NASA Technical Reports Server (NTRS)

    Leu, Ming-Taun; Timonen, Raimo S.; Keyser, Leon F.; Yung, Yuk L.

    1995-01-01

    The heterogeneous reactions of HNO3(g) + NaCl(s) yields HCl(g) + NaNO3(s) (eq 1) and N2O5(g) + NaCl(s) yields ClNO2(g) + NaNO3(S) (eq 2) were investigated over the temperature range 223-296 K in a flow-tube reactor coupled to a quadrupole mass spectrometer. Either a chemical ionization mass spectrometer (CIMS) or an electron-impact ionization mass spectrometer (EIMS) was used to provide suitable detection sensitivity and selectivity. In order to mimic atmospheric conditions, partial pressures of HNO3 and N2O5 in the range 6 x 10(exp -8) - 2 x 10(exp -6) Torr were used. Granule sizes and surface roughness of the solid NaCl substrates were determined by using a scanning electron microscope. For dry NaCl substrates, decay rates of HNO3 were used to obtain gamma(1) = 0.013 +/- 0.004 (1sigma) at 296 K and > 0.008 at 223 K, respectively. The error quoted is the statistical error. After all corrections were made, the overall error, including systematic error, was estimated to be about a factor of 2. HCl was found to be the sole gas-phase product of reaction 1. The mechanism changed from heterogeneous reaction to predominantly physical adsorption when the reactor was cooled from 296 to 223 K. For reaction 2 using dry salts, gamma(2) was found to be less than 1.0 x 10(exp -4) at both 223 and 296 K. The gas-phase reaction product was identified as ClNO2 in previous studies using an infrared spectrometer. An enhancement in reaction probability was observed if water was not completely removed from salt surfaces, probably due to the reaction of N2O5(g) + H2O(s) yields 2HNO3(g). Our results are compared with previous literature values obtained using different experimental techniques and conditions. The implications of the present results for the enhancement of the hydrogen chloride column density in the lower stratosphere after the El Chichon volcanic eruption and for the chemistry of HCl and HNO3 in the marine troposphere are discussed.

  17. Experimental search for the radiative capture reaction d + d {yields} {sup 4}He + {gamma} from the dd{mu} muonic molecule state J = 1

    SciTech Connect

    Baluev, V. V.; Bogdanova, L. N.; Bom, V. R.; Demin, D. L.; Eijk, C. W. E. van; Filchenkov, V. V.; Grafov, N. N.; Grishechkin, S. K.; Gritsaj, K. I.; Konin, A. D.; Mikhailyukov, K. L.; Rudenko, A. I.; Vinogradov, Yu. I.; Volnykh, V. P.; Yukhimchuk, A. A.; Yukhimchuk, S. A.

    2011-07-15

    A search for the muon-catalyzed fusion reaction d + d {yields} {sup 4}He + {gamma} in the dd{mu} muonic molecule was performed using the experimental installation TRITON with BGO detectors for {gamma}-quanta. A high-pressure target filled with deuterium was exposed to the negative muon beam of the JINR Phasotron to detect {gamma}-quanta with the energy 23.8 MeV. An experimental estimation for the yield of radiative deuteron capture from the dd{mu} state J = 1 was obtained at the level of {eta}{sub {gamma}} {<=} 8 Multiplication-Sign 10{sup -7} per fusion.

  18. Polarization effects in the N-bar+N{yields}{pi}+l{sup +}+l{sup -} reaction: General analysis and numerical estimations

    SciTech Connect

    Gakh, G. I.; Rekalo, A. P.; Tomasi-Gustafsson, E.; Boucher, J.; Gakh, A. G.

    2011-02-15

    A general formalism is developed to calculate the cross section and the polarization observables for the reaction N-bar+N{yields}{pi}+l{sup +}+l{sup -}. The matrix element and the observables are expressed in terms of six scalar amplitudes (complex functions of three kinematical variables) that determine the reaction dynamics. The numerical predictions are given in the frame of a particular model in the kinematical range accessible in the antiproton annihilation at Darmstadt (PANDA) experiment at the Facility for Antiproton and Ion Research (FAIR).

  19. A laser flash photolysis kinetics study of the reaction OH + H2O2 yields HO2 + H2O

    NASA Technical Reports Server (NTRS)

    Wine, P. H.; Semmes, D. H.; Ravishankara, A. R.

    1981-01-01

    Absolute rate constants for the reaction are reported as a function of temperature over the range 273-410 K. OH radicals are produced by 266 nm laser photolysis of H2O2 and detected by resonance fluorescence. H2O2 concentrations are determined in situ in the slow flow system by UV photometry. The results confirm the findings of two recent discharge flow-resonance fluorescence studies that the title reaction is considerably faster, particularly at temperatures below 300 K, than all earlier studies had indicated. A table giving kinetic data from the reaction is included.

  20. Improved information on the 7Li+p{yields}{alpha}+{alpha} reaction via the Trojan Horse Method applied to the 3He break-up

    SciTech Connect

    Tumino, A.; Spitaleri, C.; Sergi, M. L.; Cherubini, S.; La Cognata, M.; Lamia, L.; Pizzone, R. G.; Romano, S.; Tudisco, S.; Kroha, V.; Burjan, V.; Novac, J.; Vincour, J.; Fulop, S.; Somorjai, E.

    2006-04-26

    The astrophysically relevant 7Li+p{yields}{alpha}+{alpha} reaction was investigated via the THM by selecting the quasi-free contribution to the measured 3He+7Li{yields}{alpha}+{alpha}+d three-body process. This investigation is mainly aimed at testing the validity of the pole approximation in the THM against the bound structure of the Trojan-horse nucleus. The three-body experiment was performed at 33 MeV, corresponding to a 7Li-p relative energy ranging from 0.2 to 7 MeV. The quasi-free 7Li+p cross-section was compared with the free reaction cross-section as well as with indirect data from a previous THM experiment. The good agreement between data sets throughout the energy range investigated provided a very important validity test of the pole approximation for the THM.

  1. High-yield cell-free synthesis of human EGFR by IRES-mediated protein translation in a continuous exchange cell-free reaction format

    PubMed Central

    Quast, Robert B.; Sonnabend, Andrei; Stech, Marlitt; Wüstenhagen, Doreen A.; Kubick, Stefan

    2016-01-01

    Cell-free protein synthesis systems derived from eukaryotic sources often provide comparatively low amounts of several μg per ml of de novo synthesized membrane protein. In order to overcome this, we herein demonstrate the high-yield cell-free synthesis of the human EGFR in a microsome-containing system derived from cultured Sf21 cells. Yields were increased more than 100-fold to more than 285 μg/ml by combination of IRES-mediated protein translation with a continuous exchange cell-free reaction format that allowed for prolonged reaction lifetimes exceeding 24 hours. In addition, an orthogonal cell-free translation system is presented that enabled the site-directed incorporation of p-Azido-L-phenylalanine by amber suppression. Functionality of cell-free synthesized receptor molecules is demonstrated by investigation of autophosphorylation activity in the absence of ligand and interaction with the cell-free synthesized adapter molecule Grb2. PMID:27456041

  2. Isobaric yield ratio difference between the 140 A MeV 58Ni + 9Be and 64Ni +9Be reactions studied by the antisymmetric molecular dynamics model

    NASA Astrophysics Data System (ADS)

    Qiao, C. Y.; Wei, H. L.; Ma, C. W.; Zhang, Y. L.; Wang, S. S.

    2015-07-01

    Background: The isobaric yield ratio difference (IBD) method is found to be sensitive to the density difference of neutron-rich nucleus induced reaction around the Fermi energy. Purpose: An investigation is performed to study the IBD results in the transport model. Methods: The antisymmetric molecular dynamics (AMD) model plus the sequential decay model gemini are adopted to simulate the 140 A MeV 58 ,64Ni +9Be reactions. A relative small coalescence radius Rc= 2.5 fm is used for the phase space at t = 500 fm/c to form the hot fragment. Two limitations on the impact parameter (b 1 =0 -2 fm and b 2 =0 -9 fm) are used to study the effect of central collisions in IBD. Results: The isobaric yield ratios (IYRs) for the large-A fragments are found to be suppressed in the symmetric reaction. The IBD results for fragments with neutron excess I = 0 and 1 are obtained. A small difference is found in the IBDs with the b 1 and b 2 limitations in the AMD simulated reactions. The IBD with b 1 and b 2 are quite similar in the AMD + GEMINI simulated reactions. Conclusions: The IBDs for the I =0 and 1 chains are mainly determined by the central collisions, which reflects the nuclear density in the core region of the reaction system. The increasing part of the IBD distribution is found due to the difference between the densities in the peripheral collisions of the reactions. The sequential decay process influences the IBD results. The AMD + GEMINI simulation can better reproduce the experimental IBDs than the AMD simulation.

  3. Results of an attempt to measure increased rates of the reaction D-2 + D-2 yields He-3 + n in a nonelectrochemical cold fusion experiment

    NASA Technical Reports Server (NTRS)

    Fralick, Gustave C.; Decker, Arthur J.; Blue, James W.

    1989-01-01

    An experiment was performed to look for evidence of deuterium fusion in palladium. The experiment, which involved introducing deuterium into the palladium filter of a hydrogen purifier, was designed to detect neutrons produced in the reaction D-2 + D-2 yields He-3 + n as well as heat production. The neutron counts for deuterium did not differ significantly from background or from the counts for a hydrogen control. Heat production was detected when deuterium, but not hydrogen, was pumped from the purifier.

  4. Effect of orbital and rotational angular momentum averaging on branching ratios of dynamical resonances in the reaction H + p-H2 yields o-H2 + H

    NASA Technical Reports Server (NTRS)

    Mladenovic, Mirjana; Zhao, Meishan; Truhlar, Donald G.; Schwenke, David W.; Sun, Yan

    1988-01-01

    The paper reports extensive quantum mechanical calculations of the product vibrational branching ratios in the reaction H + p-H2 yields o-H2 + H. The calculations involve total angular momentum up to 2 and excited as well as ground initial rotational states, and they are completely converged with up to 513 channels in individual total angular momentum/parity blocks. Comparisons are made with recent experiments by Nieh and Valentini.

  5. The carbon dioxide chaperon efficiency for the reaction H + O2 + M yields HO2 + M from ignition delay times behind reflected shock waves

    NASA Technical Reports Server (NTRS)

    Brabbs, Theodore A.; Robertson, Thomas F.

    1987-01-01

    Ignition delay times for stoichiometric hydrogen-oxygen in argon with and without carbon dioxide were measured behind reflected shock waves. A 20-reaction kinetic mechanism models the measured hydrogen-oxygen delay times over the temperature range 950 to 1300 K. The chaperon efficiency for carbon dioxide determined for the hydrogen-oxygen carbon dioxide mixture was 7.0. This value is in agreement with literature values but much less than a recent value obtained from flow tube experiments. Delay times measured behind a reflected shock wave were about 20% longer than those measured behind incident shock waves. The kinetic mechanism successfully modeled the high-pressure data of Skinner and the hydrogen-air data of Stack. It is suggested that the lowest temperature points for the hydrogen-air data of Slack are unreliable and that the 0.27-atm data may illustrate a case where vibrational relaxation of nitrogen is important. The reaction pathway HO2 yields H2O2 yields OH yields H was required to model the high-pressure data of Skinner. The successful modeling of the stoichiometric hydrogen-air data demonstrates the appropriateness of deriving kinetic models from data for gas mixtures highly diluted with argon. The technique of reducing a detailed kinetic mechanism to only the important reactions for a limited range of experimental data may render the mechanism useless for other test conditions.

  6. Theoretical characterization of the potential energy surface for the reversible reaction H + O2 yields HO2(asterisk) yields OH + O. III - Computed points to define a global potential energy surface

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.; Duchovic, Ronald J.

    1991-01-01

    Computed energies and geometries are reported which, combined with previously published calculations, permit a global representation of the potential energy surface for the reaction H + O2 yields HO2(asterisk) yields OH + O. These new calculations characterize the potential energy surface (PES) for all H atom angles of approach to O2 and for the region of the inner repulsive wall. The region of the T-shaped H-O2 exchange saddle point is connected with the constrained energy minimum (CEM) path, and a new collinear H-O2 exchange saddle point is characterized which lies only 9 kcal/mol above the H + O2 asymptote. A vibrational analysis which utilizes local cubic and quartic polynomial representations of the PES along the CEM path has been carried out. Optimal geometries, energies, and harmonic frequencies are reported along with anharmonic analyses for the O2 and OH asymptotes and for the HO2 minimum region of the PES.

  7. Neutron, Proton, and Photonuclear Cross Sections for Radiation Therapy and Radiation Protection

    SciTech Connect

    Chadwick, M.B.

    1998-09-10

    The authors review recent work at Los Alamos to evaluate neutron, proton, and photonuclear cross section up to 150 MeV (to 250 MeV for protons), based on experimental data and nuclear model calculations. These data are represented in the ENDF format and can be used in computer codes to simulate radiation transport. They permit calculations of absorbed dose in the body from therapy beams, and through use of kerma coefficients allow absorbed dose to be estimated for a given neutron energy distribution. For radiation protection, these data can be used to determine shielding requirements in accelerator environments, and to calculate neutron, proton, gamma-ray, and radionuclide production. Illustrative comparisons of the evaluated cross section and kerma coefficient data with measurements are given.

  8. Radiolysis of liquids with high static dielectric constant: An estimate of the total ionization yield, electron thermalization distance, and contribution of heterogeneous reactions

    SciTech Connect

    Ferradini, C.; Jay-Gerin, J.

    1988-12-01

    In a previous study, we found an exponential dependence of the free-ion yield (G/sub fi/) on the static dielectric constant (epsilon/sub s/) for a number of irradiated liquids with epsilon/sub s/>10. On the basis of this study, we develop here a simple model by which we quantitatively estimate the total ionization yield (G/sub tot/), the most probable electron thermalization distance (b), and the yield of solvated electrons that are removed by diffusion-controlled reactions during spur expansion (G/sub dif/). Using solvated electron yields available in the literature, we get G/sub tot/approx. =6.6 mol/100 eV (value nearly independent of the nature of the liquid) and bapprox. =29 A at 298 K. b is found not to depend appreciably on epsilon/sub s/ which indicates that the Coulomb attractive force between the ion and secondary electron is practically inefficient before electron thermalization occurs. The evaluation of G/sub dif/ teaches us that spur reactions have a profound influence in the fate of ion pairs formed during radiolysis of liquids of high epsilon/sub s/ values.

  9. Determination of O2(a1Delta g) and O2(b1Sigma + g) yields in the reaction O + ClO yields Cl + O2 - Implications for photochemistry in the atmosphere of Venus

    NASA Technical Reports Server (NTRS)

    Leu, Ming-Taun; Yung, Yuk L.

    1987-01-01

    A discharge flow apparatus with a chemiluminescence detector was used to investigate the reaction O + ClO yields Cl + O2(asterisk), where O2(asterisk) = O2(a1Delta g) or O2(b1Sigma + g). It is found that the observed O2(a1Delta g) airglow of Venus cannot be explained in the framework of standard photochemistry using the experimental results obtained here and those reported in the recent literature. The possibility of an alternative source of O atoms derived from SO2 photolysis in the Venus mesosphere is suggested.

  10. Direct kinetic study of radical transformation reaction Me sub 2 COH + Ph sub 2 CO yields Me sub 2 CO + Ph sub 2 COH

    SciTech Connect

    Demeter, A.; Berces, T. )

    1991-02-07

    Reaction Me{sub 2}COH + Ph{sub 2}CO {yields} Me{sub 2}CO + Ph{sub 2}COH (5) was studied by laser flash photolysis under such experimental conditions where the changes in the concentrations of ketyl radicals with reaction time were controlled by this radical transformation process. Diphenylketyl radical concentration profiles were obtained by monitoring transient absorption at 540 nm and the rate coefficient k{sub 5} was extracted from that part of the concentration trajectory which was determined solely by reaction 5. Thus, k{sub 5} = (3.6 {plus minus} 0.6) {times} 10{sup 5} dm{sup 3} mol{sup {minus}1} s{sup {minus}1} was determined at 298 K in acetonitrile, which is higher than the two recently reported values derived from quantum yields measured under steady-state conditions. A reaction mechanism for the radical transformation process (5) is proposed in which hydrogen-bonded species formed from ketyl radical and benzophenone participate.

  11. Time dependent quantum dynamics study of the Ne+H{sub 2}{sup +}(v=0-4){yields}NeH{sup +}+H proton transfer reaction

    SciTech Connect

    Mayneris, Jordi; Gonzalez, Miguel

    2008-05-21

    The Ne+H{sub 2}{sup +}{yields}NeH{sup +}+H proton transfer reaction was studied using the time dependent real wave packet quantum dynamics method at the helicity decoupling level, considering the H{sub 2}{sup +} molecular ion in the (v=0-4, j=0) vibrorotational states and a wide collision energy interval. The calculated reaction probabilities and reaction cross sections were in a rather good agreement with reanalyzed previous exact quantum dynamics results, where a much smaller collision energy interval was considered. Also, a quite good agreement with experimental data was found. These results suggested the adequacy of the approach used here to describe this and related systems.

  12. Rate constant and secondary organic aerosol yields for the gas-phase reaction of hydroxyl radicals with syringol (2,6-dimethoxyphenol)

    NASA Astrophysics Data System (ADS)

    Lauraguais, Amélie; Coeur-Tourneur, Cécile; Cassez, Andy; Seydi, Abdoulaie

    2012-08-01

    Syringol (2,6-dimethoxyphenol) is a potential marker compound for wood smoke emissions in the atmosphere. To investigate the atmospheric reactivity of this compound, the rate constant for its reaction with hydroxyl radicals (OH) has been determined in a simulation chamber (8 m3) at 294 ± 2 K, atmospheric pressure and low relative humidity (2-4%) using the relative rate method. The syringol and reference compound concentrations were followed by GC/FID (Gas chromatography/Flame Ionization Detection). The determined rate constant (in units of cm3 molecule-1 s-1) is ksyringol = (9.66 ± 1.11) × 10-11. The calculated atmospheric lifetime for syringol is 1.8 h, indicating that it is too reactive to be used as a tracer for wood smoke emissions. Secondary Organic Aerosol (SOA) formation from the OH reaction with syringol was also investigated. The initial mixing ratios for syringol were in the range 495-3557 μg m-3. The aerosol production was monitored using a SMPS (Scanning Mobility Particle Sizer). The SOA yields (Y) were determined as the ratio of the suspended aerosol mass corrected for wall losses (M0) to the total reacted syringol concentration assuming a particle density of 1.4 g cm-3. The aerosol formation yield increases as the initial syringol concentration increases, and leads to aerosol yields ranging from 0.10 to 0.36. Y is a strong function of M0 and the organic aerosol formation can be expressed by a one-product gas/particle partitioning absorption model. To our knowledge, this work represents the first investigation of the rate constant and SOA formation for the reaction of syringol with OH radicals. The atmospheric implications of this reaction are also discussed.

  13. New data on ({gamma}, n), ({gamma}, 2n), and ({gamma}, 3n) partial photoneutron reactions

    SciTech Connect

    Varlamov, V. V. Ishkhanov, B. S.; Orlin, V. N.; Peskov, N. N.; Stepanov, M. E.

    2013-11-15

    Systematic discrepancies between the results of various experiments devoted to determining cross sections for total and partial photoneutron reactions are analyzed by using objective criteria of reliability of data in terms of the transitional photoneutron-multiplicity function F{sub i} = {sigma}({gamma}, in)/{sigma}({gamma}, xn), whose values for i = 1, 2, 3, ... cannot exceed by definition 1.00, 0.50, 0.33, ..., respectively. It was found that the majority of experimental data on the cross sections obtained for ({gamma}, n), ({gamma}, 2n), and ({gamma}, 3n) reactions with the aid of methods of photoneutron multiplicity sorting do not meet objective criteria (in particular, F{sub 2} > 0.50 for a vast body of data). New data on the cross sections for partial reactions on {sup 181}Ta and {sup 208}Pb nuclei were obtained within a new experimental-theoretical method that was proposed for the evaluation of cross sections for partial reactions and in which the experimental neutron yield cross section {sigma}{sup expt}({gamma}, xn) = {sigma}({gamma}, n) + 2{sigma}({gamma}, 2n) + 3{sigma}({gamma}, 3n) + ..., which is free from problems associated with determining neutron multiplicities, is used simultaneously with the functions F{sub i}{sup theor} calculated within a combined model of photonuclear reactions.

  14. Recent Developments of the Nuclear Reaction Model Code EMPIRE

    SciTech Connect

    Herman, M.; Oblozinsky, P.; Capote, R.; Trkov, A.; Zerkin, V.; Sin, M.; Ventura, A.

    2005-05-24

    Recent extensions and improvements of the EMPIRE code system are outlined. They add to the code new capabilities such as fission of actinides, preequilibrium emission of clusters, photo-nuclear reactions, and reactions on excited targets. These features, along with improved ENDF formatting, exclusive spectra, and recoils make the forthcoming 2.19 release a complete tool for evaluation of nuclear data at incident energies above the resonance region.

  15. Bovine serum albumin further enhances the effects of organic solvents on increased yield of polymerase chain reaction of GC-rich templates

    PubMed Central

    2012-01-01

    Background While being a standard powerful molecular biology technique, applications of the PCR to the amplification of high GC-rich DNA samples still present challenges which include limited yield and poor specificity of the reaction. Organic solvents, including DMSO and formamide, have been often employed as additives to increase the efficiency of amplification of high GC content (GC > 60%) DNA sequences. Bovine serum albumin (BSA) has been used as an additive in several applications, including restriction enzyme digestions as well as in PCR amplification of templates from environmental samples that contain potential inhibitors such as phenolic compounds. Findings Significant increase in PCR amplification yields of GC-rich DNA targets ranging in sizes from 0.4 kb to 7.1 kb were achieved by using BSA as a co-additive along with DMSO and formamide. Notably, enhancing effects of BSA occurs in the initial PCR cycles with BSA additions having no detrimental impact on PCR yield or specificity. When a PCR was set up such that the cycling parameters paused after every ten cycles to allow for supplementation of BSA, combining BSA and organic solvent produced significantly higher yields relative to conditions using the solvent alone. The co-enhancing effects of BSA in presence of organic solvents were also obtained in other PCR applications, including site-directed mutagenesis and overlap extension PCR. Conclusions BSA significantly enhances PCR amplification yield when used in combination with organic solvents, DMSO or formamide. BSA enhancing effects were obtained in several PCR applications, with DNA templates of high GC content and spanning a broad size range. When added to the reaction buffer, promoting effects of BSA were seen in the first cycles of the PCR, regardless of the size of the DNA to amplify. The strategy outlined here provides a cost-effective alternative for increasing the efficiency of PCR amplification of GC-rich DNA targets over a broad size

  16. A laser flash photolysis-resonance fluorescence kinetics study of the reaction Cl/2P/ + CH4 yields CH3 + HCl

    NASA Technical Reports Server (NTRS)

    Ravishankara, A. R.; Wine, P. H.

    1980-01-01

    The technique of laser flash photolysis-resonance fluorescence is employed to study the kinetics of the reaction Cl(2P) + CH4 yields CH3 + HCl over the temperature range 221-375 K. At temperatures less than or equal to 241 K the apparent bimolecular rate constant is found to be dependent upon the identity of the chemically inert gases in the reaction mixture. For Cl2/CH4/He reaction mixtures (total pressure = 50 torr) different bimolecular rate constants are measured at low and high methane concentrations. For Cl2/CH4/CCl/He and Cl2/CH4/Ar reaction mixtures, the bimolecular rate constant is independent of methane concentration, being approximately equal to the rate constant measured at low methane concentrations for Cl2/CH4/He mixtures. These rate constants are in good agreement with previous results obtained using the discharge flow-resonance fluorescence and competitive chlorination techniques. At 298 K the measured bimolecular rate constant is independent of the identity of the chemically inert gases in the reaction mixture and in good agreement with all previous investigations. The low-temperature results obtained in this investigation and all previous investigations can be rationalized in terms of a model which assumes that the Cl(2P 1/2) state reacts with CH4 much faster than the Cl(2P 3/2) state. Extrapolation of this model to higher temperatures, however, is not straightforward.

  17. Kinetics study of the Cl/2P/ + Cl2O yields Cl2 + ClO reaction at 298 K

    NASA Technical Reports Server (NTRS)

    Ray, G. W.; Keyser, L. F.; Watson, R. T.

    1980-01-01

    The kinetics of the Cl + Cl2O reaction, a possible source of ClO(2 Pi) radicals for atmospheric photochemical studies, are investigated at 298 K. The discharge flow/mass spectrometry and discharge flow/resonance fluorescence techniques were used to monitor the decay of C12O in the presence of excess concentrations of atomic chlorine and chlorine monoxide, respectively. The pseudo-first order rate constants obtained from both experiments are found to be in excellent agreement, averaging 9.8 + or - 0.8 x 10 to the -11th cu cm/molecule per sec. Results are consistent with the lower limit obtained by Edgecombe et al. (1957) but differ by a factor of 150 from those of Basco and Dogra (1971). The present value is also noted to be consistent with a lower value for the rate constant of the reaction of oxygen atoms with Cl2O.

  18. Predicted neutron yield and radioactivity for laser-induced (p,n) reactions in LiF

    SciTech Connect

    Swift, D C; McNaney, J M

    2009-01-30

    Design calculations are presented for a pulsed neutron source comprising polychromatic protons accelerated from a metal foil by a short-pulse laser, and a LiF converter in which (p,n) reactions occur. Although the proton pulse is directional, neutrons are predicted to be emitted relatively isotropically. The neutron spectrum was predicted to be similar to the proton spectrum, but with more neutrons of low energy in the opposite direction to the incident protons. The angular dependence of spectrum and intensity was predicted. The (p,n) reactions generate unstable nuclei which decay predominantly by positron emission to the original {sup 7}Li and {sup 19}F isotopes. For the initial planned experiments using a converter 1mm thick, we predict that 0.1% of the protons will undergo a (p,n) reaction, producing 10{sup 9} neutrons. Ignoring the unreacted protons, neutrons, and prompt gamma emission as excited nuclear states decay, residual positron radioactivity (and production of pairs of 511 keV annihilation photons) is initially 4.2MBq decaying with a half-life of 17.22 s for 6 mins ({sup 19}Ne decays), then 135Bq decaying with a half-life of 53.22 days ({sup 7}Be decays).

  19. Primary isotope yields and characteristic properties of the fragmenting source in heavy-ion reactions near the Fermi energy

    NASA Astrophysics Data System (ADS)

    Liu, X.; Lin, W.; Wada, R.; Huang, M.; Chen, Z.; Xiao, G. Q.; Zhang, S.; Jin, X.; Han, R.; Liu, J.; Shi, F.; Zheng, H.; Natowitz, J. B.; Bonasera, A.

    2014-07-01

    For central collisions of Ca40+Ca40 at 35 MeV/nucleon, the density and temperature of a fragmenting source have been evaluated in a self-consistent manner using the ratio of the symmetry energy coefficient relative to the temperature, asym/T, extracted from the yields of primary isotopes produced in antisymmetrized molecular dynamics (AMD) simulations. The asym/T values are extracted from all isotope yields using an improved method based on the modified Fisher model (MFM). The values of asym/T obtained, using different interactions with different density dependencies of the symmetry energy term, are correlated with the values of the symmetry energies at the density of fragment formation. Using this correlation, the fragment formation density is found to be ρ /ρ0=0.67±0.02. Using the input symmetry energy value for each interaction temperature values are extracted as a function of isotope mass A. The extracted temperature values are compared with those evaluated from the fluctuation thermometer with a radial flow correction.

  20. pp{yields}p{Lambda}K{sup +} reaction in search for the K{sup -}pp state - quest for a kaonic nuclei

    SciTech Connect

    Suzuki, Ken; Kienle, Paul; Maggiora, Marco; Yamazaki, Toshimitsu

    2011-10-21

    The dibaryonic kaonic nuclear bound state, K{sup -}pp is searched by studying an exclusive p+p{yields}p+{Lambda}+K{sup +} process at several beam energies. A signature of the K{sup -}pp is explored in a p+p{yields}X({identical_to}K{sup -}pp)+K{sup +} reaction that follows a decay of the X into p+{Lambda}. We found in a missing-mass {Delta}M(K{sup +}) spectrum and a {Lambda}p invariant-mass M({Lambda}p) spectrum of DISTO data at 2.85 GeV a resonance with M = 2267 MeV/c{sup 2} and {Gamma} = 118 MeV. Those events are found to be associated with a mono energetic kaon. We investigate this resonance as a candidate of the K{sup -}pp further also with a different beam energies.

  1. Unitary model for the {gamma}p {yields} {gamma}{pi}{sup 0}p reaction and the magnetic dipole moment of the {Delta}{sup +}(1232)

    SciTech Connect

    W.T. Chiang; Marc Vanderhaeghen; S.N. Yang; D. Drechsel

    2004-09-01

    Radiative pion photoproduction in the {Delta}(1232) resonance region is studied with the aim to access the {Delta}{sup +}(1232) magnetic dipole moment. We present a unitary model of the {gamma}p {yields} {gamma}{pi}N ({pi}N) = ({pi}{sup 0}p, {pi}{sup +}n) reactions, where the {pi}N rescattering is included in an on-shell approximation. In this model, the low energy theorem which couples the {gamma}p {yields} {gamma}{pi}N process in the limit of a soft final photon to the {gamma}p {yields} {pi}N process is exactly satisfied. We study the sensitivity of the {gamma}p {yields} {gamma}{pi}{sup 0}p process at higher values of the final photon energy to the {Delta}{sup +}(1232) magnetic dipole moment. We compare our results with existing data and give predictions for forthcoming measurements of angular and energy distributions. It is found that the photon asymmetry and a helicity cross section are particularly sensitive to the {Delta}{sup +} magnetic dipole moment.

  2. Genome shuffling of Saccharomyces cerevisiae for enhanced glutathione yield and relative gene expression analysis using fluorescent quantitation reverse transcription polymerase chain reaction.

    PubMed

    Yin, Hua; Ma, Yanlin; Deng, Yang; Xu, Zhenbo; Liu, Junyan; Zhao, Junfeng; Dong, Jianjun; Yu, Junhong; Chang, Zongming

    2016-08-01

    Genome shuffling is an efficient and promising approach for the rapid improvement of microbial phenotypes. In this study, genome shuffling was applied to enhance the yield of glutathione produced by Saccharomyces cerevisiae YS86. Six isolates with subtle improvements in glutathione yield were obtained from populations generated by ultraviolet (UV) irradiation and nitrosoguanidine (NTG) mutagenesis. These yeast strains were then subjected to recursive pool-wise protoplast fusion. A strain library that was likely to yield positive colonies was created by fusing the lethal protoplasts obtained from both UV irradiation and heat treatments. After two rounds of genome shuffling, a high-yield recombinant YSF2-19 strain that exhibited 3.2- and 3.3-fold increases in glutathione production in shake flask and fermenter respectively was obtained. Comparative analysis of synthetase gene expression was conducted between the initial and shuffled strains using FQ (fluorescent quantitation) RT-PCR (reverse transcription polymerase chain reaction). Delta CT (threshold cycle) relative quantitation analysis revealed that glutathione synthetase gene (GSH-I) expression at the transcriptional level in the YSF2-19 strain was 9.9-fold greater than in the initial YS86. The shuffled yeast strain has a potential application in brewing, other food, and pharmaceutical industries. Simultaneously, the analysis of improved phenotypes will provide more valuable data for inverse metabolic engineering. PMID:27302037

  3. Investigation of the p+N {yields} [{Sigma}{sup 0}K{sup +}]+N reaction at the proton energy E{sub p} = 70 GeV

    SciTech Connect

    1994-08-01

    The p+N {yields} [{Sigma}{sup 0}K{sup +}]+N reaction was studied in experiments using the SPHINX detector placed in the 70-GeV proton beam of the IHEP accelerator. In the effective mass spectrum of the M({Sigma}{sup 0}K{sup +}) system produced in the coherent diffractive transition, a clear peak with mass M = 1999 {+-} 7 MeV and width {Gamma} = 91 {+-} 17 MeV was observed in addition to the near-threshold structure with mass M {approx_equal} 1800 MeV. 7 refs., 3 figs.

  4. Effects of methanol-to-oil ratio, catalyst amount and reaction time on the FAME yield by in situ transesterification of rubber seeds (Hevea brasiliensis)

    NASA Astrophysics Data System (ADS)

    Abdulkadir, Bashir Abubakar; Uemura, Yoshimitsu; Ramli, Anita; Osman, Noridah B.; Kusakabe, Katsuki; Kai, Takami

    2014-10-01

    In this research, biodiesel is produced by in situ transesterification (direct transesterification) method from the rubber seeds using KOH as a catalyst. The influence of methanol to seeds mass ratio, duration of reaction, and catalyst loading was investigated. The result shows that, the best ratio of seeds to methanol is 1:6 (10 g seeds with 60 g methanol), 120 minutes reaction time and catalyst loading of 3.0 g. The maximum FAME yield obtain was 70 %. This findings support FAME production from the seeds of rubber tree using direct transesterifcation method from the seeds of rubber tree as an alternative to diesel fuel. Also, significant properties of biodiesel such as cloud point, density, pour point, specific gravity, and viscosity were investigated.

  5. Measurements of acetone and other gas phase product yields from the OH-initiated oxidation of terpenes by proton-transfer-reaction mass spectrometry (PTR-MS)

    NASA Astrophysics Data System (ADS)

    Wisthaler, A.; Jensen, N. R.; Winterhalter, R.; Lindinger, W.; Hjorth, J.

    The atmospheric oxidation of several terpenes appears to be a potentially relevant source of acetone in the atmosphere. Proton-transfer-reaction mass spectrometry was used as an on-line analytical method in a chamber study to measure acetone and other gas phase products from the oxidation of α- and β-pinene initiated by OH radicals in air and in the presence of NO x. Acetone may be formed promptly, following attack by the OH radical on the terpene, via a series of highly unstable radical intermediates. It can also be formed by slower processes, via degradation of stable non-radical intermediates such as pinonaldehyde and nopinone. Primary acetone and pinonaldehyde molar yields of 11±2% (one σ) and 34±9% (one σ), respectively, were found from the reaction between α-pinene and the OH radical. After all α-pinene had been consumed, an additional formation of acetone due to the degradation of stable non-radical intermediates was observed. The total amount of acetone formed was 15±2% (one σ) of the reacted α-pinene. An upper limit of 12±3% (one σ) for the acetone molar yield from the oxidation of pinonaldehyde was established. From the reaction between β-pinene and the OH radicals, primary acetone and nopinone molar yields of 13±2% (one σ) and 25±3% (one σ), respectively, were observed. Additional amounts of acetone were formed by the further degradation of the primary product, such as the most abundant product nopinone. The total amount of acetone formed was 16±2% (one σ) of the reacted β-pinene. An upper limit of 12±2% (one σ) for the acetone molar yield from the oxidation of nopinone was established. The observed product yields from α- and β-pinene are in good agreement with other studies using mass-spectrometric and gas chromatographic analytical techniques, but differ significantly from previous studies using spectroscopic methods. Possible reasons for the discrepancies are discussed.

  6. Calculated rate constants for the reaction ClO + O yields Cl + O2 between 220 and 1000 deg K. [molecular trajectories and stratospheric ozone

    NASA Technical Reports Server (NTRS)

    Jaffee, R. L.

    1978-01-01

    Classical trajectory calculations are presented for the reaction ClO + O yields Cl + O2, a reaction which is an important step in the chlorine-catalyzed destruction of ozone which is thought to occur in the 220 and 1000 K. The calculated rate constant is 4.36 x 10 to the minus 11th power exp (-191/T)cu cm molecule (-1)s(-1) and its value at 300 K is 2.3 plus or minus 10 to the 11th power cu cm molecule (-1)s(-1), about a factor of 2 lower than recent experimental data. The empirical potential energy surface used in the calculations was constructed to fit experimental data for ClO, O2 and ClOO molecules. Other important features of this potential surface, such as the barrier to reaction, were varied systematically and calculations were performed for a range of conditions to determine the best theoretical rate constants. Results demonstrate the utility of classical trajectory methods for determining activation energies and other kinetic data for important atmospheric reactions.

  7. Reaction rates of the 113In(γ,n)112mIn and 115In(γ,n)114mIn

    NASA Astrophysics Data System (ADS)

    Skakun, Ye; Semisalov, I.; Kasilov, V.; Popov, V.; Kochetov, S.; Maslyuk, V.; Mazur, V.; Parlag, O.; Gajnish, I.

    2016-01-01

    The integral yields of the 113In(γ,n)112mIn (Jπ=9/2+→Jπ=4+) and 115In(γ,n)114mIn (Jπ=9/2+→Jπ=5+) photonuclear reactions were measured in the bremsstrahlung end-point energy range from the respective thresholds up to 14 MeV by a conventional activation/decay technique using the 197Au(γ,n)196Au reaction cross sections as the standard for the absolute photon intensity determination. The metallic indium samples of the natural and enriched compositions were irradiated by the bremsstrahlung beams from thin tantalum converters of the electron linear accelerator of NSC KIPT (Kharkiv) and the microtron of IEP (Ughhorod). The integral reaction yields were determined from the activities of the nuclei-products measured by the high resolution γ-ray spectrometry technique with Ge(Li)- and HPGe-detectors. The reaction rates for the Planck spectrum of a thermal photon bath were derived for the ground state target nuclei and compared to the predictions of the statistical model of nuclear reactions.

  8. Extended active space CASSCF/MRSD CI calculations of the barrier height for the reaction: O + H2 yields OH + H

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1986-01-01

    The convergence of the barrier height for the O + H2 yields OH + H reaction was studied as a function of the size of the active space and basis set completeness. The barrier height is rapidly convergent with respect to expansion of the active space. Addition of 2p yields 2p' correlation terms to the active space lowers the barrier to the O + H2 reaction by about 2.0 kcal/mole, but addition of 3d and other terms has little additional effect. Multireference singles and doubles contracted CI plus Davidson's correction calculations using a (5s5p3d2f1g/4s3p2d1f) basis set with a 5 sigma 2 pi active space lead to a barrier height of 12.7 kcal/mole. Including an estimate of the CI contraction error and basis set superposition error leads to 12.4 kcal/mole as the best estimate of the barrier height.

  9. Pulsed, Photonuclear-induced, Neutron Measurements of Nuclear Materials with Composite Shielding

    SciTech Connect

    James Jones; Kevin Haskell; Rich Waston; William Geist; Jonathan Thron; Corey Freeman; Martyn Swinhoe; Seth McConchie; Eric Sword; Lee Montierth; John Zabriskie

    2011-07-01

    Active measurements were performed using a 10-MeV electron accelerator with inspection objects containing various nuclear and nonnuclear materials available at the Idaho National Laboratory’s Zero Power Physics Reactor (ZPPR) facility. The inspection objects were assembled from ZPPR reactor plate materials to evaluate the measurement technologies for the characterization of plutonium, depleted uranium or highly enriched uranium shielded by both nuclear and non-nuclear materials. A series of pulsed photonuclear, time-correlated measurements were performed with unshielded calibration materials and then compared with the more complex composite shield configurations. The measurements used multiple 3He detectors that are designed to detect fission neutrons between pulses of an electron linear accelerator. The accelerator produced 10-MeV bremsstrahlung X-rays at a repetition rate of 125 Hz (8 ms between pulses) with a 4-us pulse width. All inspected objects were positioned on beam centerline and 100 cm from the X-ray source. The time-correlated data was collected in parallel using both a Los Alamos National Laboratory-designed list-mode acquisition system and a commercial multichannel scaler analyzer. A combination of different measurement configurations and data analysis methods enabled the identification of each object. This paper describes the experimental configuration, the ZPPR inspection objects used, and the various measurement and analysis results for each inspected object.

  10. Four-dimensional quantum study on exothermic complex-forming reactions: Cl{sup -}+CH{sub 3}Br{yields}ClCH{sub 3}+Br{sup -}

    SciTech Connect

    Hennig, Carsten; Schmatz, Stefan

    2005-06-15

    The exothermic gas-phase bimolecular nucleophilic substitution (S{sub N}2) reaction Cl{sup -}+CH{sub 3}Br ({upsilon}{sub 1}{sup '},{upsilon}{sub 2}{sup '},{upsilon}{sub 3}{sup '}){yields}ClCH{sub 3} ({upsilon}{sub 1},{upsilon}{sub 2},{upsilon}{sub 3})+Br{sup -} and the corresponding endothermic reverse reaction have been studied by time-independent quantum scattering calculations in hyperspherical coordinates on a coupled-cluster potential-energy surface. The dimensionality-reduced model takes four degrees of freedom into account [Cl-C and C-Br stretching modes (quantum numbers {upsilon}{sub 3}{sup '} and {upsilon}{sub 3}); totally symmetric modes of the methyl group, i.e., C-H stretching ({upsilon}{sub 1}{sup '} and {upsilon}{sub 1}) and umbrella bending vibrations ({upsilon}{sub 2}{sup '} and {upsilon}{sub 2})]. Diagonalization of the Hamiltonian was performed employing the Lanczos algorithm with a variation of partial reorthogonalization. A narrow grid in the total energy was employed so that long-living resonance states could be resolved and extracted. While excitation of the reactant umbrella bending mode already leads to a considerable enhancement of the reaction probability, its combination with vibrational excitation of the broken C-Br bond, (0, 1, 1), results in a strong synergic effect that can be rationalized by the similarity with the classical transitional normal mode. Exciting the C-H stretch has a non-negligible effect on the reaction probability, while for larger translational energies this mode follows the expected spectatorlike behavior. Combination of C-Br stretch and symmetric C-H, (1,0,1), stretch does not show a cooperative effect. Contrary to the spectator mode concept, energy originally stored in the C-H stretching mode is by no means conserved, but almost completely released in other modes of the reaction products. Products are most likely formed in states with a high degree of excitation in the new C-Cl bond, while the internal modes of

  11. Kinetic study of the reaction CH (X 2Pi) + H2 yields CH2 (X 3B1) + H in the temperature range 372 to 675 K

    NASA Technical Reports Server (NTRS)

    Zabarnick, S.; Fleming, J. W.; Lin, M. C.

    1986-01-01

    The kinetics of the reversible reaction CH (X 2Pi) + H2 yields CH2 (X 3B1) + H at 372-675 K and total pressure 100 torr (mainly Ar) is investigated experimentally. The ground-state CH radicals are produced by photolysis of CHBr3 using 10-mJ 266-nm laser pulses (repetition rate 10 Hz) and monitored by measuring the fluorescence induced by a 429.8-nm dye laser, in the apparatus described by Berman et al. (1982) and Berman and Lin (1984). The results are presented in tables and graphs and characterized. The absolute rate constants for the forward and reverse reactions are determined, and their temperature dependence is given by Arrhenius expressions and formulas obtained in transition-state-theory calculations. The heat of formation of CH2 at 0 K is estimated (assuming that the recombination reaction CH2 + H has zero activation energy) as 92.6 + or - 0.5 kcal/mol.

  12. Measurement of flux-weighted average cross sections for 197Au(γ, xn) reactions and isomeric yield ratios of 196m,gAu with bremsstrahlung

    NASA Astrophysics Data System (ADS)

    Naik, Haladhara; Kim, Guinyun; Kim, Kwangsoo; Zaman, Muhammad; Goswami, Ashok; Lee, Man Woo; Yang, Sung-Chul; Lee, Young-Ouk; Shin, Sung-Gyun; Cho, Moo-Hyun

    2016-04-01

    Photo-neutron cross sections of 197Au were experimentally determined for the bremsstrahlung end-point energies of 50, 60, and 70 MeV, by utilizing activation and off-line γ-ray spectrometric technique, using the 100 MeV electron linac at the Pohang Accelerator Laboratory (PAL), Pohang, Korea. The 197Au(γ, xn; x = 1- 6) reaction cross sections were calculated as a function of the bombarding photon energy by using the TALYS 1.6 computer code with default parameters. The flux-weighted average cross sections were obtained from the literature data and the theoretical values of TALYS 1.6 and TENDL-2014, for mono-energetic photons, and are found to be in good agreement with the present data. Isomeric yield ratios of 196m2,gAu from the 197Au(γ, n) reaction were also determined for the bremsstrahlung end-point energies of 50, 60, and 70 MeV, from the reaction cross sections of m2- and g-states, based on the present experimental data, and are found to be in good agreement with the theoretical values based on TALYS 1.6 and TENDL-2014.

  13. Modulation of the fluorescence yield in heliobacterial cells by induction of charge recombination in the photosynthetic reaction center.

    PubMed

    Redding, Kevin E; Sarrou, Iosifina; Rappaport, Fabrice; Santabarbara, Stefano; Lin, Su; Reifschneider, Kiera T

    2014-05-01

    Heliobacteria contain a very simple photosynthetic apparatus, consisting of a homodimeric type I reaction center (RC) without a peripheral antenna system and using the unique pigment bacteriochlorophyll (BChl) g. They are thought to use a light-driven cyclic electron transport pathway to pump protons, and thereby phosphorylate ADP, although some of the details of this cycle are yet to be worked out. We previously reported that the fluorescence emission from the heliobacterial RC in vivo was increased by exposure to actinic light, although this variable fluorescence phenomenon exhibited very different characteristics to that in oxygenic phototrophs (Collins et al. 2010). Here, we describe the underlying mechanism behind the variable fluorescence in heliobacterial cells. We find that the ability to stably photobleach P800, the primary donor of the RC, using brief flashes is inversely correlated to the variable fluorescence. Using pump-probe spectroscopy in the nanosecond timescale, we found that illumination of cells with bright light for a few seconds put them in a state in which a significant fraction of the RCs underwent charge recombination from P800 (+)A0 (-) with a time constant of ~20 ns. The fraction of RCs in the rapidly back-reacting state correlated very well with the variable fluorescence, indicating that nearly all of the increase in fluorescence could be explained by charge recombination of P800 (+)A0 (-), some of which regenerated the singlet excited state. This hypothesis was tested directly by time-resolved fluorescence studies in the ps and ns timescales. The major decay component in whole cells had a 20-ps decay time, representing trapping by the RC. Treatment of cells with dithionite resulted in the appearance of a ~18-ns decay component, which accounted for ~0.6 % of the decay, but was almost undetectable in the untreated cells. We conclude that strong illumination of heliobacterial cells can result in saturation of the electron acceptor pool

  14. Suppression of the Coulomb Interaction in the Off-Energy-Shell p-p Scattering from the p+d{yields}p+p+n Reaction

    SciTech Connect

    Tumino, A.; Spitaleri, C.; Rapisarda, G. G.; Cherubini, S.; Crucilla, V.; Gulino, M.; La Cognata, M.; Lamia, L.; Mudo, F.; Pizzone, R. G.; Romano, S.; Sergi, M. L.; Mukhamedzhanov, A.; Elekes, Z.; Fueloep, Z.; Gyuerky, G.; Kiss, G.; Somorjai, E.

    2007-06-22

    Off-energy-shell effects in p-p scattering have been investigated at p-p relative energies from 600 down to 80 keV applying the Trojan horse method (THM) to the p+d{yields}p+p+n reaction at 5 MeV. In contrast with the on-energy-shell case, no Coulomb-nuclear interference minimum has been found in the extracted THM p-p cross section, due to the suppression of the Coulomb amplitude as predicted by the half-off-energy shell calculations. This hypothesis is strengthened by the agreement between THM p-p data and calculated on-energy-shell n+n, n+p and nuclear p+p cross sections.

  15. Production of the {omega} meson in the pd{yields}{sup 3}He{omega} reaction at 1450 MeV and 1360 MeV

    SciTech Connect

    Schoenning, K.; Calen, H.; Fransson, K.; Gustafsson, L.; Hoeistad, B.; Jacewicz, M.; Johansson, T.; Keleta, S.; Kullander, S.; Kupsc, A.; Marciniewski, P.; Petren, H.; Ruber, R. J. M. Y.; Engblom, P. Thoerngren; Zlomanczuk, J.; Bargholtz, Chr.; Geren, L.; Lindberg, K.; Tegner, P.-E.; Zartova, I.

    2009-04-15

    The production of {omega} mesons in the pd{yields}{sup 3}He{omega} reaction has been studied at two energies near the kinematic threshold, T{sub p}=1450 MeV and T{sub p}=1360 MeV. The differential cross section was measured as a function of the {omega} c.m. angle at both energies over the whole angular range. Whereas the results at 1360 MeV are consistent with isotropy, strong rises are observed near both the forward and backward directions at 1450 MeV. Calculations made using a two-step model with an intermediate pion fail to reproduce the shapes of the measured angular distributions and also underestimate the total cross sections.

  16. State-to-state rates for the D + H2(v = 1, j = 1) yield HD(v-prime, j-prime) + H reaction - Predictions and measurements

    NASA Technical Reports Server (NTRS)

    Neuhauser, Daniel; Judson, Richard S.; Kouri, Donald J.; Adelman, David E.; Shafer, Neil E.; Kliner, Dahv A. V.; Zare, Richard N.

    1992-01-01

    A fully quantal wavepacket approach to reactive scattering in which the best available H3 potential energy surface was used enabled a comparison with experimentally determined rates for the D + H2(v = 1, j = 1) yield HD(v-prime = 0, 1, 2; j-prime) + H reaction at significantly higher total energies (1.4 to 2.25 electron volts) than previously possible. The theoretical results are obtained over a sufficient range of conditions that a detailed simulation of the experiment was possible, thus making this a definitive comparison of experiment and theory. Good to excellent agreement is found for the vibrational branching ratios and for the rotational distributions within each product vibrational level. However, the calculated rotational distributions are slightly hotter than the experimentally measured ones.

  17. Extended active space CASSCF/MRSD CI calculations of the barrier height for the reaction O + H2 yields OH + H

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1987-01-01

    The convergence of the barrier height for the O + H2 yields OH + H reaction is studied as a function of the size of the active space in the CASSCF calculation and the size of the basis set. The basis set employed in this study is described. The sources of the differences between the POL-CI and MRSD-CI calculations for barrier height are examined. It is observed that the barrier height is rapidly convergent with respect to the expansion of the active space. The effects of adding active orbitals on the barrier height are investigated. The barrier height estimated from corrected MRSD-CI data is 12.4 kcal/mol.

  18. The nature and role of quantized transition states in the accurate quantum dynamics of the reaction O + H2 yields OH + H

    NASA Technical Reports Server (NTRS)

    Chatfield, David C.; Friedman, Ronald S.; Lynch, Gillian C.; Truhlar, Donald G.; Schwenke, David W.

    1993-01-01

    Accurate quantum mechanical dynamics calculations are reported for the reaction probabilities of O(3P) + H2 yields OH + H with zero total angular momentum on a single potential energy surface. The results show that the reactive flux is gated by quantized transition states up to the highest energy studied, which corresponds to a total energy of 1.90 eV. The quantized transition states are assigned and compared to vibrationally adiabatic barrier maxima; their widths and transmission coefficients are determined; and they are classified as variational, supernumerary of the first kind, and supernumerary of the second kind. Their effects on state-selected and state-to-state reactivity are discussed in detail.

  19. Investigation of near-threshold eta-meson production in the reaction {pi}{sup -}p{yields} {eta}n

    SciTech Connect

    Bayadilov, D. E.; Beloglazov, Yu. A.; Gridnev, A. B.; Kozlenko, N. G.; Kruglov, S. P.; Kulbardis, A. A.; Lopatin, I. V.; Novinskiy, D. V.; Radkov, A. K.; Sumachev, V. V.; Filimonov, E. A.; Shvedchikov, A. V.

    2012-08-15

    Differential and total cross sections for eta-meson production in the reaction {pi}{sup -}p {yields} {eta}n were measured within the experimental program eta-meson physics implemented in the pion channel of the synchrocyclotron of the Petersburg Nuclear Physics Institute (PNPI, Gatchina). These measurements were performed at incident-pion momenta (700, 710, 720, and 730 MeV/c) in the vicinity of the threshold for the process under study by using the neutral-meson spectrometer designed and created at the Meson Physics Laboratory of PNPI. It is shown that, in the immediate vicinity of the threshold (685 MeV/c), the process of eta-meson production proceeds predominantly via S{sub 11}(1535)-resonance formation followed by the decay S{sub 11}(1535) {yields} {eta}n (the respective branching fraction is Br Almost-Equal-To 60%), but that, as the momentum of incident pions increases, the role of the D wave becomes ever more important. A detailed analysis of this effect indicates that it is due to the increasing contribution of the D{sub 13}(1520) resonance. Although the branching fraction of the decay of this resonance through the {eta}n channel is assumed to be very small (BR Almost-Equal-To 0.24%), the effect is enhanced owing to the interference between the D wave and the dominant resonance S{sub 11}(1535).

  20. Measurement of Quantum Yield, Quantum Requirement, and Energetic Efficiency of the O2-Evolving System of Photosynthesis by a Simple Dye Reaction

    NASA Astrophysics Data System (ADS)

    Ros Barcelò, A.; Zapata, J. M.

    1996-11-01

    Photosynthesis is the conversion of absorbed radiant energy from sunlight into various forms of chemical energy by the chloroplasts of higher green plants. The overall process of photosynthesis consists of the oxidation of water (with the release of O2 as a product) and the reduction of CO2 to form carbohydrates. In the test tube electrons produced by the photolytic cleavage of H2) may be deviated from their true acceptor by inserting a suitable dye in the electron chain; i.e.; 2,6-dichlorophenol indophenol (DCPIP) (E'o = + 0.217 V), which is blue in the oxidized quinone form and which becomes colorless when reduced to the phenolic form. This dye-electrom acceptor also has the advantage that it accepts electroms directly from the quinone (Qa) electron-acceptor of the photosystem II< the reaction center associated with the O2-evolving (or water-slplitting) system. Based in the bleaching of DCPIP by illuminated spinach leaf chloroplasts, a classroom laboratory protocol has been developed to determine the quantum yield (QY = micromol O2 s-1 / micromol photons s-1, the quantum requirement (1/QY) and the energetic efficiency (f = chemical energy stored / light energy supplied) of the O2-evolving system of photosynthesis. Although values for the quantum yield, the quantum requirement and the energetic efficiency calculated in the classroom laboratory differ widely from those expected theoretically, these calculations are useful for illustrating the transformation of light energy into chemical energy by the chloroplasts of green plants.

  1. The dependence of rate coefficients and product yields upon fluence, intensity, and time in unimolecular reactions induced by monochromatic infrared radiation

    NASA Astrophysics Data System (ADS)

    Quack, M.; Humbert, P.; van den Bergh, H.

    1980-07-01

    The influence of the three parameters (with two degrees of freedom) fluence, intensity, and time on rate coefficients and product yields in collisionless Unimolecular Reactions Induced by Monochromatic Infrared Radiation (URIMIR) is discussed in some detail in terms of the recently proposed logarithmic reactant fluence plots. Model calculations for several archetypes of such plots are presented, based on solutions of the Pauli master equation and solutions of the quantum mechanical equations of motion for spectra involving many states at each level of excitation. Linear diagrams, turnups, and turnovers are found and are discussed systematically. Experimental examples re-evaluated from the literature and new measurements on the laser induced decomposition of CF2HCl are reported which nicely illustrate the various theoretical possibilities. Steady state rate coefficients for six molecules are evaluated and summarized. In some situations the intrinsic nonlinear intensity dependence of the steady state rate coefficients and deviations from simple fluence dependence of the product yields both before and at steady state are shown to be important theoretically and experimentally. The role of the reducibility of the rate coefficient matrix is discussed in connection with turnovers and with the strong influence of initial temperature that is found in the laser induced decomposition of CF2HCl.

  2. Nonadiabatic dynamics in the CH{sub 3}+HCl{yields}CH{sub 4}+Cl({sup 2}P{sub J}) reaction

    SciTech Connect

    Retail, Bertrand; Pearce, Julie K.; Murray, Craig; Orr-Ewing, Andrew J.

    2005-03-08

    Nonadiabatic dynamics in the title reaction have been investigated by 2+1 REMPI detection of the Cl({sup 2}P{sub 3/2}) and Cl{sup *}({sup 2}P{sub 1/2}) products. Reaction was initiated by photodissociation of CH{sub 3}I at 266 nm within a single expansion of a dilute mixture of CH{sub 3}I and HCl in argon, giving a mean collision energy of 7800 cm{sup -1} in the center-of-mass frame. Significant production of Cl* was observed, with careful checks made to ensure that no additional photochemical or inelastic scattering sources of Cl* perturbed the measurements. The fraction of the total yield of Cl({sup 2}P{sub J}) atoms formed in the J=(1/2) level at this collision energy was 0.150{+-}0.024, and must arise from nonadiabatic dynamics because the ground potential energy surface correlates to CH{sub 4}+Cl({sup 2}P{sub 3/2}) products.

  3. Pentaquark {Theta}{sup +} production from the reaction {gamma}p {yields} {pi}{sup +} K{sup -} {Theta}{sup +}

    SciTech Connect

    W. Liu; C. M. Ko; V. Kubarovsky

    2004-02-01

    The cross section for {Theta}{sup +} production from the reaction {gamma}p {yields} {pi}{sup +} K{sup -} {Theta}{sup +}, which was observed in the CLAS experiment at the Jefferson National Laboratory, is evaluated in a hadronic model that includes couplings of {Theta}{sup +} to both KN and K*N. With their coupling constants determined from the empirical {pi} NN(1710) and {rho} NN(1710) coupling constants using the SU(3) symmetry, the cross section for this reaction has been evaluated by taking {Theta}{sup +} to have spin 1/2 and isospin 0 but either positive or negative parity. We find that the cross section is 10-15 nb if {Theta}{sup +} has positive parity as predicted by the chiral soliton model. The cross section is reduced by more than a factor of 10 if {Theta}{sup +} has negative parity as given by lattice QCD studies. For both parities, the differential distribution peaks at small negative four momentum transfer as expected from the dominating t-channel kaon-exchange diagram that involves only the coupling of {Theta}{sup +} to KN.

  4. Storage conditions of blood samples and primer selection affect the yield of cDNA polymerase chain reaction products of hepatitis C virus.

    PubMed Central

    Cuypers, H T; Bresters, D; Winkel, I N; Reesink, H W; Weiner, A J; Houghton, M; van der Poel, C L; Lelie, P N

    1992-01-01

    We have noticed that suboptimal specimen processing and storage conditions may cause false-negative results in the detection of hepatitis C virus (HCV) RNA in plasma or serum. To establish the influence of specimen handling in a serological laboratory on the rate of detection of HCV RNA by the cDNA polymerase chain reaction (cDNA-PCR), we tested routine serum samples and fresh-frozen plasma samples from the same bleeding from confirmed anti-HCV-positive blood donors. When primers from the NS3/NS4 region were used, HCV RNA was detected in fresh-frozen plasma from 67% of the donors, whereas positive results were obtained with only 50% of the serum samples that had been subjected to routine serological procedures. Analysis of the same samples with primers from the highly conserved 5'-terminal region (5'-TR) revealed an HCV RNA detection rate of 92% for both the routine and the fresh-frozen samples. However, the yield of the amplification product in routine samples was strongly reduced compared with that in fresh-frozen plasma. Comparison of both primer sets for cDNA-PCR showed that the 5'-TR primer set was 10- to 100-fold more effective in detecting HCV RNA. We also analyzed the effect of storage of whole EDTA-blood and serum at room temperature and at 4 degrees C on the yield of the amplification product. A rapid decline in detectable HCV RNA of 3 to 4 log units was observed within 14 days when whole blood and serum were stored at room temperature. By contrast, no perceptible reduction in the cDNA-PCR signal was found in freshly prepared serum stored at 4 degrees C. Images PMID:1333489

  5. Measurements of yields of fission products in the reaction of {sup 238}U with high-energy p, d and n beams

    SciTech Connect

    Nolen, J.A.; Ahmad, I.; Back, B.B.

    1995-08-01

    An experiment was performed at the Michigan State University cyclotron to determine the yields of neutron-rich fission products in the reaction of {sup 238}U with 100-MeV neutrons, 200-MeV deuterons and 200-MeV protons. Several 1-mm-thick {sup 238}U foils were irradiated for 100-second intervals sequentially for each configuration and the ten spectra were added for higher statistics. The three successive spectra, each for a 40 s period, were accumulated for each sample. Ten foils were irradiated. Successive spectra allowed us to determine approximate half-lives of the gamma peaks. Several arrangements, which were similar to the setup we plan to use in our radioactive beam proposal, were used for the production of fission products. For the high-energy neutron irradiation, U foils were placed after a 5-inch-long, 1-inch-diameter Be cylinder which stopped the 200-MeV deuteron beam generating 100-MeV neutrons. Arrangements for deuteron irradiation included direct irradiation of U foils, placing U foils after different lengths of (0.5 inch, 1.0 inch and 1.5 inch) 2-inch diameter U cylinder. Since the deuteron range in uranium is 17 mm, some of the irradiations were due to the secondary neutrons from the deuteron-induced fission of U. Similar arrangements were also used for the 200-MeV proton irradiation of the {sup 238}U foils. In all cases, several neutron-rich fission products were identified and their yields determined. In particular, we were able to observe Sn in all the runs and determine its yield. The data show that with our proposed radioactive device we will be able to produce more than 10{sup 12} {sup 132}Sn atoms per second in the target. Assuming an overall efficiency of 1 %, we will be able to deliver one particle nanoampere of {sup 132}Sn beam at a target location. Detailed analysis of the {gamma}-ray spectra is in progress.

  6. Conservation of angular momentum in polyatomic photochemical reactions: H2CO(v,J,Ka,Kc)yields+HCO(N,Ka,Kc,J)

    NASA Astrophysics Data System (ADS)

    Waugh, Siobhan E.; Terentis, Andrew C.; Metha, Gregory F.; Kable, Scott H.

    1998-05-01

    The photodissociation dynamics of the reaction H2CO + hv yields H + HCO have been investigated just above the reaction threshold. Formaldehyde was excited into specific J, Ka, Kc rotational states of three vibrational levels in the A(1A2) state. Molecules in these states undergo internal conversion back to the X (1A1) ground state on which the radical fragments are formed. The ensuring distribution of rotational energy in the HCO fragment was measured as a function of the N, Ka, Kc and J equals N +/- S quantum numbers of the fragment, and also the initial v, J, Ka, Kc quantum numbers of the parent. In a previous publication we investigated the dynamics of this reaction at low available energy and concluded that when only the N and Ka quantum numbers of both formaldehyde and the formyl radical are considered, the distributions are modeled well by phase space theory (PST). This is consistent with statistical dynamics on a bound, barrier less surface. Within approximately equals 10 cm-1 of the energetic threshold, a centrifugal barrier affected the populations by inhibiting product states that require large orbital angular momentum. Resolution of Kc in the parent and product gave large deviations from the PST model, however little data were available to quantify this observation. In this work we have extended then umber of initially excited H2CO levels to explore this 'Kc effect' further. We find that in the HCO Kc state or the lower energy state. This preference is consistent over all N for any particular initial H2CO state but may very for different initial states. Over the seven initial states probed here, four favored Kc and the other three Kc. A correlation between this Kc preference and the initial state was observed: odd Kc formaldehyde states produce Kc preference in HCO and vice versa for initially even Kc states. A comparison with one previous observation of this effect is presented, however no concrete explanation can be offered at this stage.

  7. Measurements of the reaction e/+/e/-/ yielding gamma-gamma at center-of-mass energies in the range 6.2-7.4 GeV

    NASA Technical Reports Server (NTRS)

    Hilger, E.; Beron, B. L.; Carrington, R. L.; Ford, R. L.; Hill, W. T.; Hofstadter, R.; Hughes, E. B.; Liberman, A. D.; Martin, T. W.; Oneill, L. H.

    1977-01-01

    The cross section for the pair-annihilation reaction e(+)e(-) yields gamma-gamma were measured at center-of-mass energies in the range 6.2-7.4 GeV and at production angles close to 90 deg. The experimental apparatus consisted of two identical spectrometers which were set to view the luminous region at SPEAR-II from opposite directions at an azimuthal angle of 45 deg. In each spectrometer there was a NaI(TI) crystal 20 radiation lengths thick and 30 in. in diameter to measure the gamma-ray energies. Annihilation events were detected by an electronic trigger which required only the observation in coincidence of more than 0.2 GeV in each NaI(TI) crystal within + or - 15 nsec of the crossing beams. The observed rates of pair-annihilation events were found to be in agreement with those expected from quantum electrodynamics (QED) at all the center-of-mass energies used.

  8. Crystal chemistry and photomechanical behavior of 3,4-dimethoxycinnamic acid: correlation between maximum yield in the solid-state topochemical reaction and cooperative molecular motion

    PubMed Central

    Mishra, Manish Kumar; Mukherjee, Arijit; Ramamurty, Upadrasta; Desiraju, Gautam R.

    2015-01-01

    A new monoclinic polymorph, form II (P21/c, Z = 4), has been isolated for 3,4-dimethoxycinnamic acid (DMCA). Its solid-state 2 + 2 photoreaction to the corresponding α-truxillic acid is different from that of the first polymorph, the triclinic form I (, Z = 4) that was reported in 1984. The crystal structures of the two forms are rather different. The two polymorphs also exhibit different photomechanical properties. Form I exhibits photosalient behavior but this effect is absent in form II. These properties can be explained on the basis of the crystal packing in the two forms. The nanoindentation technique is used to shed further insights into these structure−property relationships. A faster photoreaction in form I and a higher yield in form II are rationalized on the basis of the mechanical properties of the individual crystal forms. It is suggested that both Schmidt-type and Kaupp-type topochemistry are applicable for the solid-state trans-cinnamic acid photodimerization reaction. Form I of DMCA is more plastic and seems to react under Kaupp-type conditions with maximum molecular movements. Form II is more brittle, and its interlocked structure seems to favor Schmidt-type topochemistry with minimum molecular movement. PMID:26594373

  9. Observation of exotic meson production in the reaction {pi}{sup -} p {yields} {eta}{prime} {pi}{sup -} p at 18 GeV/c

    SciTech Connect

    Z. Bar-Yam; Amiran Tomaradze; A.A. Yershov; Alexander Ostrovidov; A.V. Popov; C. Olchanski; David Joffe; D.B. White; D.I. Ryabchikov; Doran Stienike; D.S. Brown; Dennis Weygand; E. King; Gary Adams; Hans Willutzki; I.A. Kachaev; I.N. Vardanian; J.A. Smith; James Bishop; John LoSecco; John P. Dowd; James Napolitano; Joachim Kuhn; Joseph Manak; John Cummings; K. Danyo; Kamal Seth; Ludmilla Sarycheva; M. Hayek; M.A. Kostin; Michael Witkowski; Mina Nozar; N. Shenhav; N.B. Sinev; Neal Cason; O.L. Kodolova; Paul Eugenio; R.W. Hackenburg; Sydney Taegar; Sergey Denisov; Suh-Urk Chung; Todd Adams; Todd Pedlar; V.A. Bodyagin; V.A. Dorofeev; V.L. Korotkikh; V.V. Lipaev; W. Kern; William Shephard; Xiao Shen; X.L. Fan

    2001-04-01

    An amplitude analysis of an exclusive sample of 5765 events from the reaction {pi}{sup -} p {yields} {eta}{prime}{pi}{sup -} p at 18 GeV/c is described. The {eta}{prime}{pi}{sup -} production is dominated by natural parity exchange and by three partial waves: those with J{sup PC} = 1{sup -+}, 2{sup ++}, and 4{sup ++}. A mass-dependent analysis of the partial-wave amplitudes indicates the production of the a{sub 2}(1320) meson as well as the a{sub 4}(2040) meson, observed for the first time decaying to {eta}{prime}{pi}{sup -}. The dominant, exotic (non-q{bar q}) 1{sup -+} partial wave is shown to be resonant with a mass of 1.597 {+-} 0.010{sub -0.010}{sup +0.045} GeV/c{sup 2} and a width of 0.340 {+-} 0.040 {+-} 0.050 GeV/c{sup 2}. This exotic state, the {pi}{sub 1}(1600), is produced with a t dependence which is different from that of the a{sub 2}(1320) meson, indicating differences between the production mechanisms for the two states.

  10. Forward-Angle Yields Of {sup 6,8}He and {sup 9}Li Isotopes in {sup 11}B(33 AMeV)+{sup 9}Be Reaction

    SciTech Connect

    Artukh, A. G.; Klygin, S. A.; Kononenko, G. A.; Teterev, Yu. G.; Sereda, Yu. M.; Vorontsov, A. N.; Erdemchimeg, B.; Kaminski, G.; Vishnevski, I. N.; Ostashko, V. V.; Pavlenko, Yu. N.; Kovtun, V. E.; Koshchiy, E. I.; Foshchan, A. G.

    2010-04-30

    Using fragment-separator COMBAS [1] in forward-angle measurements the velocity, isotopic and element distributions of products with Z<7 in {sup 11}B(33 AMeV)+{sup 9}Be reaction have been studied. The yields of {sup 6,8}He and {sup 9}Li isotopes on the {sup 9}Be thick target (332.6 mg/cm{sup 2}) as a function of momentum acceptance of fragment -separator COMBAS have been measured. The production rates per 1pmuA of the primary beam of exotic nuclei of {sup 6}He(6.9centre dot10{sup 5} pps), {sup 8}He(2centre dot10{sup 4} pps) and {sup 9}Li(4.3centre dot10 {sup 5}pps) which can be used as secondary radioactive beams of halo -like nuclei have been determined. The two-neutron halo nuclei {sup 6,8}He and {sup 9}Li are of great current interest both as very neutron-rich nuclei with a significant neutron skin and in understanding the interactions of very neutron-rich nuclei. The {sup 9}Li beam may be helpful in understanding of sub barrier fusion enhancement independent of the presence of the halo nucleons in used neutron--rich projectiles.

  11. Photodissociation dynamics of the reaction H{sub 2}CO{yields}H+HCO via the singlet (S{sub 0}) and triplet (T{sub 1}) surfaces

    SciTech Connect

    Yin, Hong-Ming; Rowling, Steven J.; Buell, Alexander; Kable, Scott H.

    2007-08-14

    We have explored the photodissociation dynamics of the reaction H{sub 2}CO+h{nu}{yields}H+HCO in the range of 810-2600 cm{sup -1} above the reaction threshold. Supersonically cooled formaldehyde was excited into selected J{sub Ka,Kc} rotational states of six vibrational levels (1{sup 1}4{sup 1}, 5{sup 1}, 2{sup 2}6{sup 1}, 2{sup 2}4{sup 3}, 2{sup 3}4{sup 1}, and 2{sup 4}4{sup 1}) in the A(tilde sign)({sup 1}A{sub 2}) state. The laser induced fluorescence spectra of the nascent HCO fragment provided detailed product state distributions. When formaldehyde was excited into the low-lying levels 1{sup 1}4{sup 1}, 5{sup 1}, and 2{sup 2}6{sup 1}, at E{sub avail}<1120 cm{sup -1}, the product state distribution can be modeled qualitatively by phase space theory. These dynamics are interpreted as arising from a reaction path on the barrierless S{sub 0} surface. When the initial states 2{sup 2}4{sup 3} and 2{sup 3}4{sup 1} were excited (E{sub avail}=1120-1500 cm{sup -1}), a second type of product state distribution appeared. This second distribution peaked sharply at low N, K{sub a} and was severely truncated in comparison with those obtained from the lower lying states. At the even higher energy of 2{sup 4}4{sup 1} (E{sub avail}{approx_equal}2600 cm{sup -1}) the sharply peaked distribution appears to be dominant. We attribute this change in dynamics to the opening up of the triplet channel to produce HCO. The theoretical height of the barrier on the T{sub 1} surface lies between 1700 and 2100 cm{sup -1} and so we consider the triplet reaction to proceed via tunneling at the intermediate energies and proceed over the barrier at the higher energies. Considerable population was observed in the excited (0,0,1) state for all initial H{sub 2}CO states that lie above the appearance energy. Rotational populations in the (0,0,1) state dropped more rapidly with (N,K{sub a}) than did the equivalent populations in (0,0,0). This indicates that, although individual rotational states are

  12. Time-dependent wave-packet quantum scattering study of the reactions D{sup -}+H{sub 2}{yields}H{sup -}+HD and H{sup -}+D{sub 2}{yields}D{sup -}+HD

    SciTech Connect

    Yao Li; Ju Liping; Han Keli; Chu Tianshu

    2006-12-15

    The cross sections of the title reactions were calculated as functions of collision energy in the range 0.2-2.4 eV on a potential energy surface of Panda and Sathyamurthy [J. Chem. Phys. 121, 9343 (2004)]. The calculated results with the Coriolis coupled method were found to be more consistent with the experimental ones than the centrifugal sudden approximation, thus suggesting that Coriolis coupling plays an important role in those reactions. A pronounced isotopic effect was also revealed and attributed to the significant difference of the effective potential barrier height in both reactions.

  13. New approach to analyzing and evaluating cross sections for partial photoneutron reactions

    SciTech Connect

    Varlamov, V. V. Ishkhanov, B. S.; Orlin, V. N.

    2012-11-15

    The presence of substantial systematic discrepancies between the results of different experiments devoted to determining cross sections for partial photoneutron reactions-first of all, ({gamma}, n), ({gamma}, 2n), and ({gamma}, 3n) reactions-is a strong motivation for studying the reliability and authenticity of these data and for developing methods for taking into account and removing the discrepancies in question. In order to solve the first problem, we introduce objective absolute criteria involving transitional photoneutron-multiplicity functions F{sub 1}, F{sub 2}, F{sub 3}, Horizontal-Ellipsis ; by definition, their values cannot exceed 1.0, 0.5, 0.33, Horizontal-Ellipsis , respectively. With the aim of solving the second problem, we propose a new experimental-theoretical approach. In this approach, reaction cross sections are evaluated by simultaneously employing experimental data on the cross section for the total photoneutron yield, {sigma}{sup expt}({gamma}, xn) = {sigma}{sup expt}({gamma}, n) + 2{sigma}{sup expt}({gamma}, 2n) + 3{sigma}{sup expt}({gamma}, 3n) + Horizontal-Ellipsis , which are free from drawbacks plaguing experimental methods for sorting neutrons in multiplicity, and the results obtained by calculating the functions F{sub theor}{sup 1}, F{sub theor}{sup 2}, F{sub theor}{sup 3}, Horizontal-Ellipsis on the basis of the modern model of photonuclear reactions. The reliability and authenticity of data on the cross sections for ({gamma}, n), ({gamma}, 2n), and ({gamma}, 3n) partial reactions-{sigma}{sup eval}({gamma}, in) = F{sub i}{sup theor}{sigma}{sup expt}({gamma}, xn)-were evaluated for the {sup 90}Zr, {sup 115}In, {sup 112,114,116,117,118,119,120,122,124}Sn, {sup 159}Tb, and {sup 197}Au nuclei.

  14. Cross sections of the O{sup +}+H{sub 2}{yields}OH{sup +}+H ion-molecule reaction and isotopic variants (D{sub 2}, HD): Quasiclassical trajectory study and comparison with experiments

    SciTech Connect

    Martinez, Rodrigo; Sierra, Jose Daniel; Gonzalez, Miguel

    2005-11-01

    A dynamics study [cross section and microscopic mechanism versus collision energy (E{sub T})] of the reaction O{sup +}+H{sub 2}{yields}OH{sup +}+H, which plays an important role in Earth's ionosphere and interstellar chemistry, was conducted using the quasiclassical trajectory method, employing an analytical potential energy surface (PES) recently derived by our group [R. Martinez et al., J. Chem. Phys. 120, 4705 (2004)]. Experimental excitation functions for the title reaction, as well as its isotopic variants with D{sub 2} and HD, were near-quantitatively reproduced in the calculations in the very broad collision energy range explored (E{sub T}=0.01-6.0 eV). Intramolecular and intermolecular isotopic effects were also examined, yielding data in good agreement with experimental results. The reaction occurs via two microscopic mechanisms (direct and nondirect abstraction). The results were satisfactorily interpreted based on the reaction probability and the maximum impact parameter dependences with E{sub T}, and considering the influence of the collinear [OHH]{sup +} absolute minimum of the PES on the evolution from reactants to products. The agreement between theory and experiment suggests that the reaction mainly occurs through the lowest energy PES and nonadiabatic processes are not very important in the wide collision energy range analyzed. Hence, the PES used to describe this reaction is suitable for both kinetics and dynamics studies.

  15. Measurement of flux-weighted average cross-sections and isomeric yield ratios for 103Rh(γ,xn) reactions in the bremsstrahlung end-point energies of 55 and 60 MeV

    NASA Astrophysics Data System (ADS)

    Shakilur Rahman, Md.; Kim, Kwangsoo; Kim, Guinyun; Naik, Haladhara; Nadeem, Muhammad; Thi Hien, Nguyen; Shahid, Muhammad; Yang, Sung-Chul; Cho, Young-Sik; Lee, Young-Ouk; Shin, Sung-Gyun; Cho, Moo-Hyun; Woo Lee, Man; Kang, Yeong-Rok; Yang, Gwang-Mo; Ro, Tae-Ik

    2016-07-01

    We measured the flux-weighted average cross-sections and the isomeric yield ratios of 99m, g, 100m, g, 101m, g, 102m, gRh in the 103Rh( γ, xn) reactions with the bremsstrahlung end-point energies of 55 and 60MeV by the activation and the off-line γ-ray spectrometric technique, using the 100MeV electron linac at the Pohang Accelerator Laboratory (PAL), Korea. The flux-weighted average cross-sections were calculated by using the computer code TALYS 1.6 based on mono-energetic photons, and compared with the present experimental data. The flux-weighted average cross-sections of 103Rh( γ, xn) reactions in intermediate bremsstrahlung energies are the first time measurement and are found to increase from their threshold value to a particular value, where the other reaction channels open up. Thereafter, it decreases with bremsstrahlung energy due to its partition in different reaction channels. The isomeric yield ratios (IR) of 99m, g, 100m, g, 101m, g, 102m, gRh in the 103Rh( γ, xn) reactions from the present work were compared with the literature data in the 103Rh(d, x), 102-99Ru(p, x) , 103Rh( α, αn) , 103Rh( α, 2p3n) , 102Ru(3He, x), and 103Rh( γ, xn) reactions. It was found that the IR values of 102, 101, 100, 99Rh in all these reactions increase with the projectile energy, which indicates the role of excitation energy. At the same excitation energy, the IR values of 102, 101, 100, 99Rh are higher in the charged particle-induced reactions than in the photon-induced reaction, which indicates the role of input angular momentum.

  16. Energy dependence of state-to-state reaction probabilities forH{sub 2} + OH {yields} H + H{sub 2}O in six dimensions

    SciTech Connect

    Dai, J.; Zhu, W.; Zhang, J.Z.H.

    1996-08-15

    We report benchmark time-dependent quantum calculation ofstate-to-state reaction probabilities for the title reaction in fulldimensions (6D) using the widely used Schatz-Elgersma potential energysurface (PES). The time-dependent wave function is propagated using thediatom-diatom Jacobi coordinates and the energy-specific state-to-statereaction probabilities are obtained by using the correlation functionmethod. All results reported here are for reaction resulting from theground state of H{sub 2} + OH to various product states H + H{sub 2}Ofor total angular momentum J = 0. The present calculation shows thatalthough the total reaction probability is a smooth function of energy,the final state-specific reaction probabilities show oscillatorystructures as a function of collision energy for the title reaction. 19refs., 4 figs.

  17. Hermes III endpoint energy calculation from photonuclear activation of 197Au and 58Ni foils

    SciTech Connect

    Parzyck, Christopher Thomas

    2014-09-01

    A new process has been developed to characterize the endpoint energy of HERMES III on a shot-to-shot basis using standard dosimetry tools from the Sandia Radiation Measurements Laboratory. Photonuclear activation readings from nickel and gold foils are used in conjunction with calcium fluoride thermoluminescent dosimeters to derive estimated electron endpoint energies for a series of HERMES shots. The results are reasonably consistent with the expected endpoint voltages on those shots.

  18. Upper bound and probable value of the rate constant of the reaction OH + HO2 yields H2O + O2

    NASA Technical Reports Server (NTRS)

    Chang, J. S.; Kaufman, F.

    1978-01-01

    Discharge-flow experiments at 295 K of the OH + HO2 reaction are described in which excess O3 is added to OH through a movable injector; OH concentration is measured downstream by resonance fluorescence with and without addition of excess NO just upstream of the detector so that both OH concentration and OH concentration + HO2 concentration are determined independently. The data are compared with a computer model involving 12 reaction steps. A simple sensitivity analysis is carried out to establish how errors in the other 'known' rate constants affect the data fit. Best agreement is obtained between computer calculations and experiments when k1 for the OH + HO2 reaction is in the range 2-3 x 10 to the -11th cu cm/s. Values above about 5 x 10 to the -11th are very unlikely whereas those below about 1 x 10 to the -11th are less strongly excluded.

  19. Measurements of the mass and isotopic yields of the {sup 233}U(n{sub th},f) reaction at the Lohengrin spectrometer

    SciTech Connect

    Martin, F.; Sage, C.; Kessedjian, G.; Doligez, X.; Letourneau, A.; Materna, T.; Meplan, O.

    2011-07-01

    Over the last 10 years, a vast campaign of measurements has been initiated to improve the precision of neutron data for the involved key nuclei ({sup 232}Th, {sup 233}Pa and {sup 233}U) of the innovative Th -{sup 233}U cycle. This latter might indeed provide cleaner nuclear energy than the present U-Pu one. New measurements of charge and mass distributions of the fission products have been achieved at the Lohengrin spectrometer of the Inst. Laue-Langevin (ILL) during fall 2010 to complete the experimental data of {sup 233}U(n,f) that exist mainly for light fission fragments. That is why we performed measurements of mass and isotopic yields with a special focus on the heavy fission fragment part. Mass yields were measured by ion counting with an ionization chamber after separation by the Lohengrin spectrometer. Isotopic yields were derived from gamma spectrometry of mass-separated beams using HPGe clover detectors. This paper will present the results of these fission yield measurements along with details on the experimental set-up and the chosen analysis method. (authors)

  20. The e{sup +}e{sup -}{yields}J/{psi}DD-bar, J/{psi}DD-bar* reactions with dynamically generated resonances

    SciTech Connect

    Gamermann, D.; Oset, E.

    2008-08-31

    In two recent reactions by Belle producing DD-bar and DD-bar* meson pairs, peaks above threshold have been measured in the differential cross sections, possibly indicating new resonances in these channels. We want to study such reactions from the point of view that the D meson pairs are produced from already known or predicted resonances below threshold. Our study shows that the peak in the DD-bar* production is not likely to be caused by the X(3872) resonance, but the peak seen in DD-bar invariant mass can be well described if the DD-bar pair comes from the already predicted scalar X(3700) resonance.

  1. Benchmark validation comparisons of measured and calculated delayed neutron detector responses for a pulsed photonuclear assessment technique

    NASA Astrophysics Data System (ADS)

    Sterbentz, J. W.; Jones, J. L.; Yoon, W. Y.; Norman, D. R.; Haskell, K. J.

    2007-08-01

    An MCNPX-based calculational methodology has been developed to numerically simulate the complex electron-photon-neutron transport problem for the active interrogation system known as the pulsed photonuclear assessment (PPA) technique. The PPA technique uses a pulsed electron accelerator to generate bremsstrahlung photons in order to fission nuclear materials. Delayed neutron radiation is then detected with helium-3 neutron detectors as evidence of the nuclear material presence. Two experimental tests were designed, setup and run to generate experimental data for benchmarking purposes. The first test irradiated depleted uranium in air, and the second test, depleted uranium in a simulated cargo container (plywood pallet), using 10 MeV electron pulses. Time-integrated, post-flash, delayed neutron counts were measured and compared to calculated count predictions in order to benchmark the calculational methodology and computer models. Comparisons between the experimental measurements and numerical predictions of the delayed neutron detector responses resulted in reasonable experiment/calculated ratios of 1.42 and 1.06 for the two tests. High-enriched uranium (HEU) predictions were also made with the benchmarked models.

  2. Benchmark validation comparisons of measured and calculated delayed neutron detector responses for a pulsed photonuclear assessment technique

    SciTech Connect

    J. W. Sterbentz; J. L. Jones; W. Y. Yoon; D. R. Norman; K. J. Haskell

    2007-08-01

    An MCNPX-based calculational methodology has been developed to numerically simulate the complex electron–photon–neutron transport problem for the active interrogation system known as the pulsed photonuclear assessment (PPA) technique. The PPA technique uses a pulsed electron accelerator to generate bremsstrahlung photons in order to fission nuclear materials. Delayed neutron radiation is then detected with helium-3 neutron detectors as evidence of the nuclear material presence. Two experimental tests were designed, setup and run to generate experimental data for benchmarking purposes. The first test irradiated depleted uranium in air, and the second test, depleted uranium in a simulated cargo container (plywood pallet), using 10 MeV electron pulses. Time-integrated, post-flash, delayed neutron counts were measured and compared to calculated count predictions in order to benchmark the calculational methodology and computer models. Comparisons between the experimental measurements and numerical predictions of the delayed neutron detector responses resulted in reasonable experiment/calculated ratios of 1.42 and 1.06 for the two tests. High-enriched uranium (HEU) predictions were also made with the benchmarked models.

  3. Predicted yields of new neutron-rich isotopes of nuclei with Z=64-80 in the multinucleon transfer reaction {sup 48}Ca+{sup 238}U

    SciTech Connect

    Adamian, G. G.; Antonenko, N. V.; Sargsyan, V. V.; Scheid, W.

    2010-05-15

    The production cross sections of new neutron-rich isotopes of nuclei with charge numbers Z=64-80 are estimated for future experiments in the multinucleon transfer reaction {sup 48}Ca+{sup 238}U at bombarding energy E{sub c.m.}=189 MeV close to the Coulomb barrier.

  4. Complete characterization of the constrained geometry bimolecular reaction O({sup 1}D)+N{sub 2}O{yields}NO+NO by three-dimensional velocity map imaging

    SciTech Connect

    Goedecke, Niels; Maul, Christof; Kauczok, Sebastian; Gericke, Karl-Heinz; Chichinin, Alexey I.

    2009-08-07

    The bimolecular reaction O({sup 1}D)+N{sub 2}O{yields}NO+NO was photoinitiated in the (N{sub 2}O){sub 2} dimer at a wavelength of 193 nm and was investigated by three-dimensional (3D) velocity map imaging. State selective 3D momentum vector distributions were monitored and analyzed. For the first time, kinetic energy resolution and stereodynamic information about the reaction under constrained geometry conditions is available. Directly observable NO products exhibit moderate vibrational excitation and are rotationally and translationally cold. Speed and spatial distributions suggest a pronounced backward scattering of the observed products with respect to the direction of motion of the O({sup 1}D) atom. Forward scattered partner products, which are not directly detectable are also translationally cold, but carry very large internal energy as vibration or rotation. The results confirm and extend previous studies on the complex initiated reaction system. The restricted geometry of the van der Waals complex seems to favor an abstraction reaction of the terminal nitrogen atom by the O({sup 1}D) atom, which is in striking contrast to the behavior observed for the unrestricted gas phase reaction under bulk conditions.

  5. Estimating Reaction Cross Sections from Measured (Gamma)-Ray Yields: The 238U(n,2n) and 239Pu(n,2n) Cross Sections

    SciTech Connect

    Younes, W

    2002-11-18

    A procedure is presented to deduce the reaction-channel cross section from measured partial {gamma}-ray cross sections. In its simplest form, the procedure consists in adding complementary measured and calculated contributions to produce the channel cross section. A matrix formalism is introduced to provide a rigorous framework for this approach. The formalism is illustrated using a fictitious product nucleus with a simple level scheme, and a general algorithm is presented to process any level scheme. In order to circumvent the cumbersome algebra that can arise in the matrix formalism, a more intuitive graphical procedure is introduced to obtain the same reaction cross-section estimate. The features and limitations of the method are discussed, and the technique is applied to extract the {sup 235}U (n,2n) and {sup 239}Pu(n,2n) cross sections from experimental partial {gamma}-ray cross sections, coupled with (enhanced) Hauser-Feshbach calculations.

  6. Identification and yields of 1,4-hydroxynitrates formed from the reactions of C8-C16 n-alkanes with OH radicals in the presence of NO(x).

    PubMed

    Yeh, Geoffrey K; Ziemann, Paul J

    2014-09-25

    A series of C8-C16 n-alkanes were reacted with OH radicals in the presence of NOx in an environmental chamber and particulate 1,4-hydroxynitrate reaction products were collected by filtration, extracted, and analyzed by high-performance liquid chromatography with UV absorption and electron ionization mass spectrometry (HPLC/UV/MS). Observed mass spectral patterns can be explained by using proposed ion fragmentation mechanisms, permitting the identification of each hydroxynitrate isomer. Reversed-phase retention of these compounds was dictated by the length of the longer of two alkyl chains attached to the 1,4-hydroxynitrate subunit. 1,4-Hydroxynitrates were quantified in particles using an authentic analytical standard for calibration, and the results were combined with gas chromatography measurements of the n-alkanes to determine the molar yields. Yields based on analyses of particles increased with increasing carbon number from 0.00 for C8 to an average plateau value of 0.130 ± 0.008 for C14-C16, due primarily to corresponding increases in gas-to-particle partitioning. The value at the plateau, where essentially all 1,4-hydroxynitrates were in particles, was equal to the average total yield of C14-C16 1,4-hydroxynitrates. The average branching ratio for the formation of C14-C16 1,4-hydroxynitrates from the reaction of NO with the corresponding 1,4-hydroxyperoxy radicals was 0.184 ± 0.011. This value is ∼20% higher than the plateau value of 0.15 for reactions of secondary 1,2-hydroxyperoxy radicals and ∼40% lower than the plateau value of 0.29 for reactions of secondary alkyl peroxy radicals, both of which were reported previously. The branching ratios determined here were used with values reported previously to calculate the yields of C7-C18 alkyl nitrates, 1,4-hydroxynitrates, and 1,4-hydroxycarbonyls, the three products formed from the reactions of these n-alkanes. PMID:25144881

  7. Photoneutron reactions in astrophysics

    SciTech Connect

    Varlamov, V. V. Ishkhanov, B. S.; Orlin, V. N.; Peskov, N. N.; Stopani, K. A.

    2014-12-15

    Among key problems in nuclear astrophysics, that of obtaining deeper insight into the mechanism of synthesis of chemical elements is of paramount importance. The majority of heavy elements existing in nature are produced in stars via radiative neutron capture in so-called s- and r processes, which are, respectively, slow and fast, in relation to competing β{sup −}-decay processes. At the same time, we know 35 neutron-deficient so-called bypassed p-nuclei that lie between {sup 74}Se and {sup 196}Hg and which cannot originate from the aforementioned s- and r-processes. Their production is possible in (γ, n), (γ, p), or (γ, α) photonuclear reactions. In view of this, data on photoneutron reactions play an important role in predicting and describing processes leading to the production of p-nuclei. Interest in determining cross sections for photoneutron reactions in the threshold energy region, which is of particular importance for astrophysics, has grown substantially in recent years. The use of modern sources of quasimonoenergetic photons obtained in processes of inverse Compton laser-radiation scattering on relativistic electronsmakes it possible to reveal rather interesting special features of respective cross sections, manifestations of pygmy E1 and M1 resonances, or the production of nuclei in isomeric states, on one hand, and to revisit the problem of systematic discrepancies between data on reaction cross sections from experiments of different types, on the other hand. Data obtained on the basis of our new experimental-theoretical approach to evaluating cross sections for partial photoneutron reactions are invoked in considering these problems.

  8. Expression of a higher plant psbA gene in Synechocystis 6803 yields a functional hybrid photosystem II reaction center complex.

    PubMed Central

    Nixon, P J; Rögner, M; Diner, B A

    1991-01-01

    The psbA gene codes for the D1 polypeptide of the photosystem II reaction center complex and is found in all photosynthetic organisms that carry out oxygenic photosynthesis. Here we describe the construction and characterization of a strain of the cyanobacterium Synechocystis sp PCC 6803 in which the three endogenous psbA genes are replaced by a single psbA gene from the chloroplast genome of the higher plant Poa annua. The resulting chimeric strain, KWPAS, grows photoautotrophically with a doubling time of 26 hours compared with 20 hours for wild-type Synechocystis 6803. The mutant oxidizes water to oxygen at light-saturated rates comparable with wild type, despite differences in 15% of the primary structure of D1 between these species. RNA gel blot analysis indicates the presence in KWPAS of a psbA transcript of approximately 1.25 kilobases, consistent with the chloroplast promoter also acting as a promoter in Synechocystis. By using antibodies specific for the carboxyl-terminal extension of the D1 polypeptide of higher plants, we showed that the D1 polypeptide synthesized by KWPAS is post-translationally modified at the carboxyl terminus, probably through processing. A detailed biophysical analysis of the chimeric photosystem II complex indicated that the rates of forward electron transfer are similar to wild type. The rates of charge recombination between the donor and acceptor sides of the reaction center are, however, accelerated by as much as a factor of nine (QA- to S2) and are the most likely explanation for the lower rate of photoautotrophic growth in the mutant. We conclude that the psbA gene from a higher plant can be expressed in cyanobacteria and its product processed and assembled into a functional chimeric photosystem II reaction center. PMID:1840918

  9. Threshold energies for the reactions Oh- + Ch3X yields Ch30H + X- (X = Cl, Br) measured by tandem mass spectrometry: Deprotonation energies (acidities) of Ch3Cl and Ch3Br. (Reannouncement with new availability information)

    SciTech Connect

    Hierl, P.M.; Henchman, M.J.; Paulson, J.F.

    1992-12-31

    In a tandem mass spectrometer, a beam of OH{sup {minus}} ions was reacted with methyl chloride and methyl bromide at collision energies in the range 0.2 < ET < 5 eV. For both of the methyl halides, excitation functions, sigma (ET), were measured for the two competing channels, endoergic proton transfer and exoergic nucleophilic displacement: OH{sup {minus}} + CH3X yields H20 + CH2X yields CH3OH + X{sup {minus}}. The threshold energies estimated for the proton transfer reactions are used to derive energies of deprotonation for CH3Cl and CH3Br of 1672 + or - 10 and 1660 + or - lO kJmol{sup {minus}1} respectively.

  10. Alkyl nitrate formation from the reactions of C8-C14 n-alkanes with OH radicals in the presence of NO(x): measured yields with essential corrections for gas-wall partitioning.

    PubMed

    Yeh, Geoffrey K; Ziemann, Paul J

    2014-09-18

    In this study, C8-C14 n-alkanes were reacted with OH radicals in the presence of NO(x) in a Teflon film environmental chamber and isomer-specific yields of alkyl nitrates were determined using gas chromatography. Because results indicated significant losses of alkyl nitrates to chamber walls, gas-wall partitioning was investigated by monitoring the concentrations of a suite of synthesized alkyl nitrates added to the chamber. Gas-to-wall partitioning increased with increasing carbon number and with proximity of the nitrooxy group to the terminal carbon, with losses as high as 86%. The results were used to develop a structure-activity model to predict the effects of carbon number and isomer structure on gas-wall partitioning, which was used to correct the measured yields of alkyl nitrate isomers formed in chamber reactions. The resulting branching ratios for formation of secondary alkyl nitrates were similar for all isomers of a particular carbon number, and average values, which were almost identical to alkyl nitrate yields, were 0.219, 0.206, 0.254, 0.291, and 0.315 for reactions of n-octane, n-decane, n-dodecane, n-tridecane, and n-tetradecane, respectively. The increase in average branching ratios and alkyl nitrate yields with increasing carbon number to a plateau value of ∼0.30 at about C13-C14 is consistent with predictions of a previously developed model, indicating that the model is valid for alkane carbon numbers ≥C3. PMID:24654572

  11. The photonuclear neutron and gamma-ray backgrounds in the fast ignition experiment

    SciTech Connect

    Arikawa, Y.; Nagai, T.; Hosoda, H.; Abe, Y.; Kojima, S.; Fujioka, S.; Sarukura, N.; Nakai, M.; Shiraga, H.; Azechi, H.; Ozaki, T.

    2012-10-15

    In the fast-ignition scheme, very hard x-rays (hereinafter referred to as {gamma}-rays) are generated by Bremsstrahlung radiation from fast electrons. Significant backgrounds were observed around the deuterium-deuterium fusion neutron signals in the experiment in 2010. In this paper the backgrounds were studied in detail, based on Monte Carlo simulations, and they were confirmed to be {gamma}-rays from the target, scattered {gamma}-rays from the experimental bay walls ({gamma}{sup Prime }-rays), and neutrons generated by ({gamma}, n) reactions in either the target vacuum chamber or the diagnostic instruments ({gamma}-n neutrons).

  12. Determination of O2(a1 delta g) and O2(b1 sigma+ g) yields in the reaction O + ClO --> Cl + O2: implications for photochemistry in the atmosphere of Venus

    NASA Technical Reports Server (NTRS)

    Leu, M. T.; Yung, Y. L.

    1987-01-01

    A discharge flow apparatus with chemiluminescence detector has been used to study the reaction O + ClO --> Cl + O2, where O2 = O2(a1 delta g) or O2(b1 sigma+ g). The measured quantum yields for producing O2(a1 delta g) and O2(b1 sigma+ g) in the above reaction are less than 2.5 x 10(-2) and equal to (4.4 +/- 1.1) x 10(-4), respectively. The observed O2(a1 delta g) airglow of Venus cannot be explained in the context of standard photochemistry using our experimental results and those reported in recent literature. The possibility of an alternative source of O atoms derived from SO2 photolysis in the mesosphere of Venus is suggested.

  13. Aerosol-chamber study of the α-pinene/O 3 reaction: influence of particle acidity on aerosol yields and products

    NASA Astrophysics Data System (ADS)

    Iinuma, Yoshiteru; Böge, Olaf; Gnauk, Thomas; Herrmann, Hartmut

    α-Pinene ozonolysis was carried out in the presence of ammonium sulfate or sulfuric acid seed particles in a 9 m 3 Teflon chamber at the mixing ratios of 100 ppbv for α-pinene and about 70 ppbv for ozone. The evolution of size distribution was measured by means of a differential mobility particle sizer (DMPS). The resulting secondary organic aerosol (SOA) was sampled by a denuder/quartz fiber filter combination for the determination of the total organic carbon concentration (TOC) in the particle phase, using a thermographic method and by a denuder/PTFE filter combination for the analysis of individual chemical species in the particle phase using capillary electrophoresis-electrospray ionization-mass spectrometry (CE-ESI-MS). cis-Pinic acid ( m/ z 185) and another species tentatively identified at m/ z 171 and 199 were the major particle phase species for both seed particles although the product yields were different, indicating the influence of seed particle acidity. A thermographic method for the determination of TOC showed an increase of particle phase organics by 40% for the experiments with higher acidity. CE-ESI-MS analysis showed a large increase in the concentration of compounds with Mw>300 from the experiments with sulfuric acid seed particles. These results suggest that the seed particle acidity enhances the yield of SOA and plays an important role in the formation of larger molecules in the particle phase. Our results from direct particle phase chemical analysis suggest for the first time that condensation of smaller organics takes place by polymerization or aldol condensation following the formation of aldehydes, such as pinonaldehyde from the terpene ozonolysis.

  14. Effects of the rotational excitation of D{sub 2} and of the potential energy surface on the H{sup +}+D{sub 2}{yields}HD+D{sup +} reaction

    SciTech Connect

    Gonzalez-Lezana, T.; Honvault, P.; Jambrina, P. G.; Aoiz, F. J.; Launay, J.-M.

    2009-07-28

    The H{sup +}+D{sub 2}{yields}HD+D{sup +} reaction has been theoretically investigated by means of an exact quantum mechanical approach, a quasiclassical trajectory method, and two statistical methods based in the propagation of either wave functions or trajectories. The study addresses the possible changes on the overall dynamics of the title reaction when the D{sub 2} diatom is rotationally excited to its v=0, j=1 state. In addition, the reactivity for the ground rotational state on two different potential energy surfaces (PESs), namely, the surface by Aguado et al. [J. Chem. Phys. 112, 1240 (2000)] and the PES by Kamisaka et al. [J. Chem. Phys. 116, 654 (2002)], is examined. Reaction probabilities and cross sections at 0.524 and 0.1 eV collision energies are calculated. The major differences with respect to the reaction initiated with D{sub 2} in its ground rovibrational state are observed for the lowest collision energy E{sub c}=0.1 eV. Differential cross sections have been found to depend to some extend on the PES employed. In addition, at E{sub c}=0.1 eV further discrepancies in the total and rotational cross sections are noticeable.

  15. Photo-nuclear astrophysics in NewSUBARU {gamma}-ray source

    SciTech Connect

    Hayakawa, Takehito

    2010-08-12

    A laser Compton scattering (LCS){gamma}-ray source has been installed at an electron storage ring NewSUBARU at SPring-8. We have studied the nuclear physics using this LCS g-ray source. The half-lives of unstable isotopes, {sup 184}Re and {sup 164}Ho{sup m}, produced by photo-induced reactions have been measured. These half-lives are shorter than previous recommended values by 7% and 3%, respectively. These changes of the half-lives affects to evaluation of cross-sections using the activation method. We have discussed a problem of the residual ratio of an isomer in {sup 180}Ta in supernova explosions. The unstable ground state and the metastable isomer are linked by ({gamma}, {gamma}') reactions. We have developed a new time-dependent model to calculate the isomer ratio in supernovae. The solar abundance of {sup 180}Ta is reproduced by the supernova neutrino process with the present calculated isomer ratio.

  16. Absolute rate constant of the reaction OH + H2O2 yields HO2 + H2O from 245 to 423 K

    NASA Technical Reports Server (NTRS)

    Keyser, L. F.

    1980-01-01

    The absolute rate constant of the reaction between the hydroxyl radical and hydrogen peroxide was measured by using the discharge-flow resonance fluorescence technique at total pressure between 1 and 4 torr. At 298 K the result is (1.64 + or - 0.32) x 10 to the -12th cu cm/molecule s. The observed rate constant is independent of pressure, surface-to-volume ratio, the addition of vibrational quenchers, and the source of OH. The temperature dependence has also been determined between 245 and 423 K; the resulting Arrhenius expression is k cu cm/molecule s is equal to (2.51 + or - 0.6) x 10 to the -12th exp(-126 + or - 76/T).

  17. Evaporation Residue Yields in Reactions of Heavy Neutron-Rich Radioactive Ion Beams with 64Ni and 96Zr Targets

    SciTech Connect

    Shapira, Dan; Liang, J Felix; Gross, Carl J; Varner Jr, Robert L; Beene, James R; Stracener, Daniel W; Mueller, Paul Edward; Kolata, Jim J; Roberts, Amy; Loveland, Walter; Vinodkumar, A. M.; Prisbrey, Landon; Sprunger, Peter H; Grzywacz-Jones, Kate L; Caraley, Anne L

    2009-01-01

    As hindrance sets in for the fusion of heavier systems, the effect of large neutron excess in the colliding nuclei on their probability to fuse is still an open question. The detection of evaporation residues (ERs), however, provides indisputable evidence for the fusion (complete and incomplete) in the reaction. We therefore devised a system with which we could measure ERs using low intensity neutron-rich radioactive ion beams with an efficiency close to 100%. We report on measurements of the production of ERs in collisions of {sup 132,134}Sn, {sup 134}Te and {sup 134}Sb ion beams with medium mass, neutron-rich targets. The data taken with {sup 132,134}Sn bombarding a {sup 64}Ni target are compared to available data (ERs and fusion) taken with stable Sn isotopes. Preliminary data on the fusion of {sup 132}Sn with {sup 96}Zr target are also presented.

  18. Evaporation residue yields in reactions of heavy neutron-rich radioactive ion beams with {sup 64}Ni and {sup 96}Zr targets

    SciTech Connect

    Shapira, D.; Liang, J. F.; Gross, C. J.; Varner, R. L.; Beene, J. R.; Stracener, D. W.; Mueller, P. E.; Kolata, J. J.; Roberts, A.; Loveland, W.; Vinodkumar, A. M.; Prisbrey, L.; Sprunger, P.; Jones, K. L.; Caraley, A. L.

    2009-03-04

    As hindrance sets in for the fusion of heavier systems, the effect of large neutron excess in the colliding nuclei on their probability to fuse is still an open question. The detection of evaporation residues (ERs), however, provides indisputable evidence for the fusion (complete and incomplete) in the reaction. We therefore devised a system with which we could measure ERs using low intensity neutron-rich radioactive ion beams with an efficiency close to 100%. We report on measurements of the production of ERs in collisions of {sup 132,134}Sn, {sup 134}Te and {sup 134}Sb ion beams with medium mass, neutron-rich targets. The data taken with {sup 132,134}Sn bombarding a {sup 64}Ni target are compared to available data (ERs and fusion) taken with stable Sn isotopes. Preliminary data on the fusion of {sup 132}Sn with {sup 96}Zr target are also presented.

  19. Atmospheric chemistry of CF3CF═CH2 and (Z)-CF3CF═CHF: Cl and NO3 rate coefficients, Cl reaction product yields, and thermochemical calculations.

    PubMed

    Papadimitriou, Vassileios C; Lazarou, Yannis G; Talukdar, Ranajit K; Burkholder, James B

    2011-01-20

    Rate coefficients, k, for the gas-phase reactions of Cl atoms and NO(3) radicals with 2,3,3,3-tetrafluoropropene, CF(3)CF═CH(2) (HFO-1234yf), and 1,2,3,3,3-pentafluoropropene, (Z)-CF(3)CF═CHF (HFO-1225ye), are reported. Cl-atom rate coefficients were measured in the fall-off region as a function of temperature (220-380 K) and pressure (50-630 Torr; N(2), O(2), and synthetic air) using a relative rate method. The measured rate coefficients are well represented by the fall-off parameters k(0)(T) = 6.5 × 10(-28) (T/300)(-6.9) cm(6) molecule(-2) s(-1) and k(∞)(T) = 7.7 × 10(-11) (T/300)(-0.65) cm(3) molecule(-1) s(-1) for CF(3)CF═CH(2) and k(0)(T) = 3 × 10(-27) (T/300)(-6.5) cm(6) molecule(-2) s(-1) and k(∞)(T) = 4.15 × 10(-11) (T/300)(-0.5) cm(3) molecule(-1) s(-1) for (Z)-CF(3)C═CHF with F(c) = 0.6. Reaction product yields were measured in the presence of O(2) to be (98 ± 7)% for CF(3)C(O)F and (61 ± 4)% for HC(O)Cl in the CF(3)CF═CH(2) reaction and (108 ± 8)% for CF(3)C(O)F and (112 ± 8)% for HC(O)F in the (Z)-CF(3)CF═CHF reaction, where the quoted uncertainties are 2σ (95% confidence level) and include estimated systematic errors. NO(3) reaction rate coefficients were determined using absolute and relative rate methods. Absolute measurements yielded upper limits for both reactions between 233 and 353 K, while the relative rate measurements yielded k(3)(295 K) = (2.6 ± 0.25) × 10(-17) cm(3) molecule(-1) s(-1) and k(4)(295 K) = (4.2 ± 0.5) × 10(-18) cm(3) molecule(-1) s(-1) for CF(3)CF═CH(2) and (Z)-CF(3)CF═CHF, respectively. The Cl-atom reaction with CF(3)CF═CH(2) and (Z)-CF(3)CF═CHF leads to decreases in their atmospheric lifetimes and global warming potentials and formation of a chlorine-containing product, HC(O)Cl, for CF(3)CF═CH(2). The NO(3) reaction has been shown to have a negligible impact on the atmospheric lifetimes of CF(3)CF═CH(2) and (Z)-CF(3)CF═CHF. The energetics for the reaction of Cl, NO(3), and OH with CF

  20. NADPH-cytochrome P450 reductase-mediated denitration reaction of 2,4,6-trinitrotoluene to yield nitrite in mammals.

    PubMed

    Shinkai, Yasuhiro; Nishihara, Yuya; Amamiya, Masahiro; Wakayama, Toshihiko; Li, Song; Kikuchi, Tomohiro; Nakai, Yumi; Shimojo, Nobuhiro; Kumagai, Yoshito

    2016-02-01

    While the biodegradation of 2,4,6-trinitrotoluene (TNT) via the release of nitrite is well established, mechanistic details of the reaction in mammals are unknown. To address this issue, we attempted to identify the enzyme from rat liver responsible for the production of nitrite from TNT. A NADPH-cytochrome P450 reductase (P450R) was isolated and identified from rat liver microsomes as the enzyme responsible for not only the release of nitrite from TNT but also formation of superoxide and 4-hydroxyamino-2,6-dinitrotoluene (4-HADNT) under aerobic conditions. In this context, reactive oxygen species generated during P450R-catalyzed TNT reduction were found to be, at least in part, a mediator for the production of 4-HADNT from TNT via formation of 4-nitroso-2,6-dinitrotoluene. P450R did not catalyze the formation of the hydride-Meisenheimer complex (H(-)-TNT) that is thought to be an intermediate for nitrite release from TNT. Furthermore, in a time-course experiment, 4-HADNT formation reached a plateau level and then declined during the reaction between TNT and P450R with NADPH, while the release of nitrite was subjected to a lag period. Notably, the produced 4-HADNT can react with the parent compound TNT to produce nitrite and dimerized products via formation of a Janovsky complex. Our results demonstrate for the first time that P450R-mediated release of nitrite from TNT results from the process of chemical interaction of TNT and its 4-electron reduction metabolite 4-HADNT. PMID:26454083

  1. Observation of the {chi}{sub c2}(2P) meson in the reaction {gamma}{gamma}{yields}DD at BABAR

    SciTech Connect

    Aubert, B.; Karyotakis, Y.; Lees, J. P.; Poireau, V.; Prencipe, E.; Prudent, X.; Tisserand, V.; Martinelli, M.; Palano, A.; Pappagallo, M.; Eigen, G.; Stugu, B.; Sun, L.; Battaglia, M.; Brown, D. N.; Hooberman, B.; Kerth, L. T.; Kolomensky, Yu. G.

    2010-05-01

    A search for the Z(3930) resonance in {gamma}{gamma} production of the DD system has been performed using a data sample corresponding to an integrated luminosity of 384 fb{sup -1} recorded by the BABAR experiment at the PEP-II asymmetric-energy electron-positron collider. The DD invariant mass distribution shows clear evidence of the Z(3930) state with a significance of 5.8{sigma}. We determine mass and width values of (3926.7{+-}2.7{+-}1.1) MeV/c{sup 2} and (21.3{+-}6.8{+-}3.6) MeV, respectively. A decay angular analysis provides evidence that the Z(3930) is a tensor state with positive parity and C parity (J{sup PC}=2{sup ++}); therefore we identify the Z(3930) state as the {chi}{sub c2}(2P) meson. The value of the partial width {Gamma}{sub {gamma}{gamma}x}B(Z(3930){yields}DD) is found to be (0.24{+-}0.05{+-}0.04) keV.

  2. Search for the {theta}{sup +} Pentaquark in the Reaction {gamma}d{yields}pK{sup 0}K{sup -}(p) with CLAS

    SciTech Connect

    Baltzell, Nathan A.

    2007-10-26

    A search for photo-production of the {theta}{sup +}(1540) pentaquark and its decay to pK{sup 0} was performed with the CLAS detector system at Jefferson Lab. In the exclusive channel {gamma}d{yields}pK{sup 0}{sub s}K{sup -}(p), about twenty-thousand events with a slow missing proton, {pi}{sup +}{pi}{sup -} decay of the neutral kaon, and photon energy between 1.6 and 3.6 GeV are fully reconstructed. Included are numerous hyperon and meson resonances, with their decays to pK{sup -} and K{sup 0}K{sup -} respectively. To understand the possibility of a pentaquark signal amidst the backgrounds, a phenomenological isobar-inspired model of complex Breit-Wigner amplitudes and decay angular distributions for the resonances is fit to the data with a maximum likelihood method. No pentaquark signal is found above the background. The upper limit on the total production cross section is measured to be consistent with other channels published by the collaboration, but systematic studies are still in progress.

  3. Effect of in-medium parameters of ρ meson in its photoproduction reactions on nuclei

    SciTech Connect

    Das, Swapan

    2015-03-15

    There exist model calculations showing the modification of the hadronic parameters of ρ meson in the nuclear environment. From these parameters, we extract the ρ-meson-nucleus optical potential and show the medium effect due to this potential on the ρ-meson mass distribution spectra in the photonuclear reactions. The calculated results reproduced reasonably the measured e{sup +}e{sup −} invariant mass, i.e., ρ-meson mass, distribution spectra in γ, ρ{sup 0} → e{sup +}e{sup −} reactions on nuclei.

  4. An investigation of the role of water on retrograde/condensation reactions and enhanced liquefaction yields. Quarterly progress report, October 1, 1992--December 31, 1992

    SciTech Connect

    Miknis, F.P.

    1993-01-01

    The overall objectives of this work are to conduct research that will provide the basis for an improved liquefaction process, and to facilitate our understanding of those processes that occur when coals are initially dissolved. Changes in coal structure that occur during coal drying and steam pretreatments will be measured in order to determine what effect water has on retrograde/condensation reactions, and to determine the mechanism by which water enhances coal reactivity toward liquefaction. Different methods for coal drying wig be investigated to determine if drying can be accomplished without destroying coal reactivity toward liquefaction, thereby making coal drying a relatively economical and efficient method for coal pretreatment. Coal drying methods will include conventional thermal drying, microwave drying, and chemical drying at low temperature. State-of-the-art solid-state nuclear magnetic resonance (NMR) techniques using combined rotation and multiple pulse spectroscopy (CRAMPS) and cross polarization with magic-angle spinning (CP/MAS) will be employed: (1) to measures changes in coal structure brought about by the different methods of drying and by low temperature oxidation, and (2) to obtain direct measurements of changes in the aromatic hydrogen-to-carbon ratio of the solid/semisolid material formed or remaining during pretreatment and the initial stages of liquefaction.

  5. The total yields of K*(892){sup +}, {sigma}{sup +}(1385), and {sigma}{sup 0} in neutrino-induced reactions at {approx} 10 GeV

    SciTech Connect

    Agababyan, N. M.; Ammosov, V. V.; Atayan, M.; Grigoryan, N.; Gulkanyan, H.; Ivanilov, A. A. Karamyan, Zh.; Korotkov, V. A.

    2007-10-15

    Using the data obtained with the SKAT bubble chamber, the total yields of K*(892){sup +}, {sigma}{sup +}(1385), and {sigma}{sup 0} are estimated for the first time in neutrino-induced reactions at moderate energy = 10.4 GeV. It is shown that the recently observed enhancement of the K{sup 0} and {lambda} yields in vA interactions as compared to vN interactions is contributed only slightly by the K*(892){sup +} and {sigma}{sup +}(1385) production. The contribution of resonances to the K{sup 0} and {lambda} yields is found to be in qualitative agreement with higher energy ( {>=} 40 GeV) data. It is shown that the energy dependence of the K*(892){sup +} mean multiplicity in vN interactions is approximately linear in the range of {approx} 10-60 GeV, while that for {sigma}{sup 0} in vA interactions (A = 20-21) is approximately logarithmic in the range of {approx} = 10-150 GeV.

  6. An investigation of the role of water on retrograde/condensation reactions and enhanced liquefaction yields. Quarterly progress report, January 1, 1994--March 31, 1994

    SciTech Connect

    Miknis, F.P.; Netzel, D.A.

    1994-04-01

    The results of coal swelling measurements using 1,4-dioxane as the swelling reagent for premoisturized coals (raw) and coal dried thermally, chemically, and with microwave radiation are presented. An increase in the swelling ratio relative to raw coal indicates a decrease in the amount of cross-linking in the coal. Conversely, a decrease in the ratio indicates an increase in cross-linking. The extent of cross-linking (as measured by 1,4-dioxane) for Texas, Black Thunder, and Eagle Butte Coals are about the same. Illinois {number_sign}6 coal appears to have less cross-linking relative to the other three coals. These results are expected on the basis of coal rank. The increase in cross linking is most pronounced for coals dried thermally and with microwave radiation. A decrease in the swelling ratios for all four coals suggests that cross-linking had occurred possibly due to partial devolatilization process. However, low temperature, chemical dehydration of the coals causes only a small or no change in the internal structure for Texas and Illinois {number_sign}6 coals whereas a significant decrease in the cross-linking structure for the Black Thunder and Eagle Butte coals is observed. It is possible that the solvent (CH{sub 3}OH) and products resulting from the chemical dehydrating (acetone and methanol) occupy the surface sites that water had before the reaction and thus preventing cross-linking to occur. These reagents can also promote swelling of coals and may account for some of the decrease in the cross-linking of the coal structure observed for the chemically dried coals.

  7. Communication: Probing the entrance channels of the X + CH{sub 4}{yields} HX + CH{sub 3} (X = F, Cl, Br, I) reactions via photodetachment of X{sup -}-CH{sub 4}

    SciTech Connect

    Cheng Min; Feng Yuan; Du Yikui; Zhu Qihe; Zheng Weijun; Czako, Gabor; Bowman, Joel M.

    2011-05-21

    The entrance channel potentials of the prototypical polyatomic reaction family X + CH{sub 4}{yields} HX + CH{sub 3} (X = F, Cl, Br, I) are investigated using anion photoelectron spectroscopy and high-level ab initio electronic structure computations. The pre-reactive van der Waals (vdW) wells of these reactions are probed for X = Cl, Br, I by photodetachment spectra of the corresponding X{sup -}-CH{sub 4} anion complex. For F-CH{sub 4}, a spin-orbit splitting ({approx}1310 cm{sup -1}) much larger than that of the F atom (404 cm{sup -1}) was observed, in good agreement with theory. This showed that in the case of the F-CH{sub 4} system the vertical transition from the anion ground state to the neutral potentials accesses a region between the vdW valley and transition state of the early-barrier F + CH{sub 4} reaction. The doublet splittings observed in the other halogen complexes are close to the isolated atomic spin-orbit splittings, also in agreement with theory.

  8. Time-dependent quantum wave packet study of the Ar+H{sub 2}{sup +}{yields}ArH{sup +}+H reaction on a new ab initio potential energy surface for the ground electronic state (1{sup 2}A Prime )

    SciTech Connect

    Hu Mei; Liu Xinguo; Tan Ruishan; Li Hongzheng; Xu Wenwu

    2013-05-07

    A new global potential energy surface for the ground electronic state (1{sup 2}A Prime ) of the Ar+H{sub 2}{sup +}{yields}ArH{sup +}+H reaction has been constructed by multi-reference configuration interaction method with Davidson correction and a basis set of aug-cc-pVQZ. Using 6080 ab initio single-point energies of all the regions for the dynamics, a many-body expansion function form has been used to fit these points. The quantum reactive scattering dynamics calculations taking into account the Coriolis coupling (CC) were carried out on the new potential energy surface over a range of collision energies (0.03-1.0 eV). The reaction probabilities and integral cross sections for the title reaction were calculated. The significance of including the CC quantum scattering calculation has been revealed by the comparison between the CC and the centrifugal sudden approximation calculation. The calculated cross section is in agreement with the experimental result at collision energy 1.0 eV.

  9. Nuclear excitations and reaction mechanisms. Progress report

    SciTech Connect

    Fallieros, S.; Levin, F.S.

    1986-08-01

    Theoretical research is being conducted on the following topics: photon scattering, gauge invariance and the extension of Siefert's Theorem; retardation effects in photonuclear absorption and the Cabibbo Radicati Sum Rule; isovector transition densities, currents and response functions; the electric polarizability, the magnetic susceptibility and the distribution of oscillator strengths in some elementary systems; relativistic models and processes; properties of skyrmions; multiquark compound bags and the charge form factor of the A = 3 nuclei; nuclear reaction theory; three-particle scattering theory; deuteron-nucleus model calculations; asymptotia in three-particle scattering systems; and time-dependent approach to few-nucleon collisions. Progress in each of these areas is reviewed briefly. A list of invited talks and of publications for the fiscal year 1986 is included. 27 refs. (DWL)

  10. Alpha particle induced reactions on natCr up to 39 MeV: Experimental cross-sections, comparison with theoretical calculations and thick target yields for medically relevant 52gFe production

    NASA Astrophysics Data System (ADS)

    Hermanne, A.; Adam Rebeles, R.; Tárkányi, F.; Takács, S.

    2015-08-01

    Thin natCr targets were obtained by electroplating, using 23.75 μm Cu foils as backings. In five stacked foil irradiations, followed by high resolution gamma spectroscopy, the cross sections for production of 52gFe, 49,51cumCr, 52cum,54,56cumMn and 48cumV in Cr and 61Cu,68Ga in Cu were measured up to 39 MeV incident α-particle energy. Reduced uncertainty is obtained by simultaneous remeasurement of the natCu(α,x)67,66Ga monitor reactions over the whole energy range. Comparisons with the scarce literature values and results from the TENDL-2013 on-line library, based on the theoretical code family TALYS-1.6, were made. A discussion of the production routes for 52gFe with achievable yields and contamination rates was made.

  11. Time dependent quantum dynamics study of the O{sup +}+H{sub 2}(v=0,j=0){yields}OH{sup +}+H ion-molecule reaction and isotopic variants (D{sub 2},HD)

    SciTech Connect

    Martinez, Rodrigo; Sierra, Jose Daniel; Gray, Stephen K.; Gonzalez, Miguel

    2006-10-28

    The time dependent real wave packet method using the helicity decoupling approximation was used to calculate the cross section evolution with collision energy (excitation function) of the O{sup +}+H{sub 2}(v=0,j=0){yields}OH{sup +}+H reaction and its isotopic variants with D{sub 2} and HD, using the best available ab initio analytical potential energy surface. The comparison of the calculated excitation functions with exact quantum results and experimental data showed that the present quantum dynamics approach is a very useful tool for the study of the selected and related systems, in a quite wide collision energy interval (approximately 0.0-1.1 eV), involving a much lower computational cost than the quantum exact methods and without a significant loss of accuracy in the cross sections.

  12. Temperature-Dependent Kinetics Studies of the Reactions Br((sup 2)P3/2) + H2S yields SH + HBr and Br((sup 2)P3/2) + CH3SH yields CH3S + HBr. Heats of Formation of SH and CH3S Radicals

    NASA Technical Reports Server (NTRS)

    Nicovich, J. M.; Kreutter, K. D.; vanDijk, C. A.; Wine, P. H.

    1997-01-01

    Time resolved resonance fluorescence detection of Br(sup 2)P3/2) atom disappearance or appearance following 266-nm laser flash photolysis of CF2Br2/H2S/H2/N2, CF2Br2/CH3SH/H2/N2, Cl2CO/H2S/HBr/N2, and CH3SSCH3/HBr/H2/N2 mixtures has been employed to study the kinetics of the reactions Br((sup 2)P3/2) + H2S = SH + HBr (1,-1) and Br((sup2)P3/2) + CH3SH = CH3S + HBr (2, -2) as a function of temperature over the range 273-431K. Arrhenius expressions in units of 10(exp -12) cu cm/molecule/s which describe the results are k1 = (14.2 +/- 3.4) exp[(-2752 +/- 90)/T],(k-1) = (4.40 +/- 0.92) exp[(-971 +/- 73)/T],k(2) = (9.24 +/- 1.15) exp[(-386 +/- 41)/T], and k(-2) = (1.46 +/-0.21) exp[(-399 +/-41)/T; errors are 2 sigma and represent precision only. By examining Br((sup 2)P3/2) equilibrium kinetics following 355nm laser flash photolysis of Br2/CH3SH/H2/N2 mixtures, a 298 K rate coefficient of (1.7 +/- 0.5) x 10(exp -10) cu cm/molecule/s has been obtained for the reaction CH3S + Br2 yields CH3SBr + Br. To our knowledge, these are the first kinetic data reported for each of the reactions studied. Measured rate coefficients, along with known rate coefficients for similar radical + H2S, CH3SH, HBr,Br2 reactions are considered in terms of possible correlations of reactivity with reaction thermochemistry and with IP - EA, the difference between the ionization potential of the electron donor and the electron affinity of the electron acceptor. Both thermochemical and charge-transfer effects appear to be important in controlling observed reactivities. Second and third law analyses of the equilibrium data for reactions 1 and 2 have been employed to obtain the following enthalpies of reaction in units of kcal/mol: for reaction 1, Delta-H(298) = 3.64 +/- 0.43 and Delta-H(0) = 3.26 +/-0.45; for reaction 2, Delta-H(298) = -0.14 +/- 0.28 and Delta-H(0) = -0.65 +/- 0.36. Combining the above enthalpies of reaction with the well-known heats of formation of Br, HBr, H2S, and CH3SH gives the

  13. Growth of Thin, Anisotropic, π-Conjugated Molecular Films by Stepwise "Click" Assembly of Molecular Building Blocks: Characterizing Reaction Yield, Surface Coverage, and Film Thickness versus Addition Step Number.

    PubMed

    Demissie, Abel T; Haugstad, Greg; Frisbie, C Daniel

    2015-07-15

    We report the systematic characterization of anisotropic, π-conjugated oligophenyleneimine (OPI) films synthesized using stepwise imine condensation, or "click" chemistry. Film synthesis began with a self-assembled monolayer (SAM) of 4-formylthiophenol or 4-aminothiophenol on Au, followed by repetitive, alternate addition of terephthalaldehyde (benzene-1,4-dicarbaldehyde) or 1,4-benzenediamine to form π-conjugated films ranging from 0.6-5.5 nm in thickness. By systematically capping the OPI films with a redox or halogen label, we were able to measure the relative surface coverage after each monomer addition via Rutherford backscattering spectrometry, X-ray photoelectron spectroscopy, spectroscopic ellipsometry, reflection-absorption infrared spectroscopy, and cyclic voltammetry. Nuclear reaction analysis was also employed for the first time on a SAM to calculate the surface coverage of carbon atoms after each stepwise addition. These six different analysis methods indicate that the average extent of reaction is 99% for each addition step. The high yield and molecular surface coverage confirm the efficacy of Schiff base chemistry, at least with the terephthalaldehyde and 1,4-benzenediamine monomers, for preparing high-quality molecular films with π conjugation normal to the substrate. PMID:26098519

  14. New measurements of the astrophysical S factor for {sup 12}C(p,{gamma}){sup 13}N reaction at low energies and the asymptotic normalization coefficient (nuclear vertex constant) for the p+{sup 12}C{yields}{sup 13}N reaction

    SciTech Connect

    Burtebaev, N.; Zazulin, D. M.; Igamov, S. B.; Yarmukhamedov, R.; Peterson, R. J.

    2008-09-15

    New measurements of differential and total cross sections for the {sup 12}C(p,{gamma}){sup 13}N reaction have been made at beam energies of E{sub p}=354,390,460,463,565,750, and 1061 keV. Analysis of the astrophysical S factor S(E) for the {sup 12}C(p,{gamma}){sup 13}N reaction at low energies and of the reaction rates has been carried out within the R-matrix approach by using the previously measured nuclear vertex constant (or the respective asymptotic normalization coefficient) for the virtual decay {sup 13}N{yields}p+{sup 12}C to fix the direct capture part of the amplitude in S(E). It is demonstrated that the R-matrix approach, using the measured asymptotic normalization coefficient, can be employed as an ideal tool, minimizing the uncertainties associated with a calculation of the direct capture cross section of the {sup 12}C(p,{gamma}){sup 13}N reaction at extremely low energies. New information on the proton and {gamma} width for the first excited state of {sup 13}N is obtained.

  15. Measurement of Isomeric Yield Ratio of 143m,gSm from natSm(γ,xn) Reaction with End-Point Bremsstrahlung Energies of 40-60 MeV

    NASA Astrophysics Data System (ADS)

    Yang, S. C.; Kim, K.; Kim, G. N.; Kim, H. I.; Lee, Y. O.; Lee, M. W.; Pham, D. K.; Nguyen, V. D.; Shin, S. G.; Cho, M. H.

    2014-05-01

    The isomeric yield ratios (IR) of 143m,gSm from the natSm(γ, xn) reaction with the end-point bremsstrahlung energies of 40, 50 and 60 MeV were measured by the activation method and using the 100 MeV electron linac of the Pohang Accelerator Laboratory (PAL), Korea. A high-purity natSm foil in disc shape was used for the irradiation and the induced photo-peak activity of the γ-rays of 143m,gSm in the irradiated sample was measured with a HPGe detector. The experimental data were analyzed through the Gamma Vision program and IR was obtained using a decay equation. The present results are compared with the literature data at other energies. It was found that the IR of 143m,gSm increases sharply from 12 to 20 MeV due to the GDR effect and thereafter remains nearly constant or increases slowly with the end-point bremsstrahlung energy.

  16. Fission yield measurements at IGISOL

    NASA Astrophysics Data System (ADS)

    Lantz, M.; Al-Adili, A.; Gorelov, D.; Jokinen, A.; Kolhinen, V. S.; Mattera, A.; Moore, I.; Penttilä, H.; Pomp, S.; Prokofiev, A. V.; Rakopoulos, V.; Rinta-Antila, S.; Simutkin, V.; Solders, A.

    2016-06-01

    The fission product yields are an important characteristic of the fission process. In fundamental physics, knowledge of the yield distributions is needed to better understand the fission process. For nuclear energy applications good knowledge of neutroninduced fission-product yields is important for the safe and efficient operation of nuclear power plants. With the Ion Guide Isotope Separator On-Line (IGISOL) technique, products of nuclear reactions are stopped in a buffer gas and then extracted and separated by mass. Thanks to the high resolving power of the JYFLTRAP Penning trap, at University of Jyväskylä, fission products can be isobarically separated, making it possible to measure relative independent fission yields. In some cases it is even possible to resolve isomeric states from the ground state, permitting measurements of isomeric yield ratios. So far the reactions U(p,f) and Th(p,f) have been studied using the IGISOL-JYFLTRAP facility. Recently, a neutron converter target has been developed utilizing the Be(p,xn) reaction. We here present the IGISOL-technique for fission yield measurements and some of the results from the measurements on proton induced fission. We also present the development of the neutron converter target, the characterization of the neutron field and the first tests with neutron-induced fission.

  17. Photo- and neutrino-induced reactions for SNe nucleosynthesis

    NASA Astrophysics Data System (ADS)

    Shima, Tatsushi

    2014-09-01

    Neutrino-induced nuclear reactions are considered to play important roles in the dynamics of supernova explosions and in supernova nucleosynthesis. For example, neutrino-inelastic scattering off light nuclei are supposed to assist the explosion by supplying the kinetic energy to the outgoing matters. The neutrino-nucleus reactions via the neutral and charged current of the weak interaction are the key reactions in the r-process nucleosynthesis in neutrino-driven wind. To quantitatively understand those phenomena, precise data of the neutrino-nucleus reaction rates are indispensable. Recently developed secondary particle beams provide good experimental opportunities for determining the neutrino-nucleus reaction rates. A quasi-monochromatic laser Compton-scattered (LCS) photon beam is useful for studying the photonuclear reactions which are the direct analogue of the neutrino inelastic scatterings caused by the weak neutral current. On the other hand, real neutrino beams are ideal tools to directly measure the absolute neutrino-nucleus reaction rates. Another interesting probe will be the nuclear muon-capture reaction, because it can be applied for measurement of the targets with very small quantities thanks to its large capture probability. In this talk recent progress in ongoing experiments with LCS gamma-rays and muon beams will be presented. A new plan for direct measurement of the neutrino-nucleus reactions with an accelerator-driven neutrino beam will be also discussed.

  18. Neutrino nuclear responses for double beta decays and astro neutrinos by charge exchange reactions

    NASA Astrophysics Data System (ADS)

    Ejiri, Hiroyasu

    2014-09-01

    Neutrino nuclear responses are crucial for neutrino studies in nuclei. Charge exchange reactions (CER) are shown to be used to study charged current neutrino nuclear responses associated with double beta decays(DBD)and astro neutrino interactions. CERs to be used are high energy-resolution (He3 ,t) reactions at RCNP, photonuclear reactions via IAR at NewSUBARU and muon capture reactions at MUSIC RCNP and MLF J-PARC. The Gamow Teller (GT) strengths studied by CERs reproduce the observed 2 neutrino DBD matrix elements. The GT and spin dipole (SD) matrix elements are found to be reduced much due to the nucleon spin isospin correlations and the non-nucleonic (delta isobar) nuclear medium effects. Impacts of the reductions on the DBD matrix elements and astro neutrino interactions are discussed.

  19. Microscopic calculations to predict the temperature dependence of the electron transfer rate in the outer sphere reaction Fe/sup 3+/ yields Fe/sup 2+/ at a gold electrode

    SciTech Connect

    Halley, J.W.; Hautman, J.; Rahman, A.; Curtiss, L.

    1987-01-01

    The study of electron transfer processes has always been known to be central to the understanding of electrochemical processes. This work develops a model to calculate the temperature dependence of a well known electron transfer reaction from first principles. The reaction is the ferrous-ferric electron transfer reaction in HClO/sub 4/ at a gold electrode. In this reaction, the iron is aquo-coordinated, which simplifies the modeling problem.

  20. DMSO Increases Radioiodination Yield of Radiopharmaceuticals

    PubMed Central

    Wang, Ketai; Adelstein, S. James; Kassis, Amin I.

    2007-01-01

    A high-yield radioiodination method for various types of molecules is described. The approach employs DMSO as precursor solvent, a reaction ratio of 2–5 precursor molecules per iodine atom, 5–10 μg oxidant, and a 10–25-μl reaction volume. The solution is vortexed at room temperature for 1–5 min and progress of the reaction is assessed by HPLC. Radioiodinated products are obtained in ≥95% yield and meet the requirements for radiotracer imaging, biodistribution studies, and molecular and cellular biology research. PMID:17931872

  1. Investigation of temperature dependence of neutron yield and electron screening potential for the d(d, n){sup 3}He reaction proceeding in deuterides ZrD{sub 2} and TiD{sub 2}

    SciTech Connect

    Bystritsky, V. M.; Bystritskii, Vit. M.; Dudkin, G. N.; Filipowicz, M.; Gazi, S.; Huran, J.; Kobzev, A. P.; Mesyats, G. A.; Nechaev, B. A.; Padalko, V. N.; Parzhitskii, S. S.; Pen'kov, F. M.; Philippov, A. V.; Kaminskii, V. L.; Tuleushev, Yu. Zh.; Wozniak, J.

    2012-08-15

    The temperature dependence of the enhancement factor for the dd reaction proceeding in TiD{sub 2} and ZrD{sub 2} is investigated. The experiments were carried out at the Hall pulsed ion accelerator (INP, Polytechnic University, Tomsk, Russia) in the deuteron energy interval 7.0-12.0 keV and at temperatures ranging from 20 to 200 Degree-Sign C. The values obtained for the electron screening potentials indicate that the dd reaction enhancement factor does not depend on the target temperature in the range 20-200 Degree-Sign C. This result contradicts the conclusions drawn by the LUNA Collaboration from their work.

  2. Free radical hydrogen atom abstraction from saturated hydrocarbons: A crossed-molecular-beams study of the reaction Cl + C{sub 3}H{sub 8} {yields} HCl + C{sub 3}H{sub 7}

    SciTech Connect

    Blank, D.A.; Hemmi, N.; Suits, A.G.; Lee, Y.T.

    1997-04-01

    The abstraction of hydrogen atoms from saturated hydrocarbons are reactions of fundamental importance in combustion as well as often being the rate limiting step in free radical substitution reactions. The authors have begun studying these reactions under single collision conditions using the crossed molecular beam technique on beamline 9.0.2.1, utilizing VUV undulator radiation to selectively ionize the scattered hydrocarbon free radical products (C{sub x}H{sub 2x+1}). The crossed molecular beam technique involves two reactant molecular beams fixed at 90{degrees}. The molecular beam sources are rotatable in the plane defined by the two beams. The scattered neutral products travel 12.0 cm where they are photoionized using the VUV undulator radiation, mass selected, and counted as a function of time. In the authors initial investigations they are using halogen atoms as protypical free radicals to abstract hydrogen atoms from small alkanes. Their first study has been looking at the reaction of Cl + propane {r_arrow} HCl + propyl radical. In their preliminary efforts the authors have measured the laboratory scattering angular distribution and time of flight spectra for the propyl radical products at collision energies of 9.6 kcal/mol and 14.9 kcal/mol.

  3. The CRISP Code for Nuclear Reactions

    SciTech Connect

    Anefalos, S.; Deppman, A.; Silva, Gilson da; Arruda-Neto, J.D. T.; Garcia, F.

    2005-05-24

    The CRISP package performs the intranuclear cascade process and the evaporation/fission competition resulting in a code that represents a good tool to describe complexes characteristics of the nuclear reactions, and opens the opportunity for applications in different fields, such as medical physics, photonuclear reactions, spallation or fission process initiated by different probes and in Accelerator Driven Systems, where precise description of energetic and angular neutron distribution, neutron multiplicity and spallation products information are needed. In the CRISP model, was included the time-sequence characteristics of the MCMC code and the evaporation/fission competition process model of the MCEF. Also, includes improvements in the code, as the excitation of nucleonic resonances heavier than Delta; the initial nuclear ground state construction according to the Fermi model and Pauli principle; and a more realistic Pauli blocking mechanism. Some consequences of the improvements performed in the code will be discussed, as, e.g., the absence of Pauli Principle violations observed in the occupation number for single-particle bound states, and the absence the lack of the unphysical nuclear boiling. At the present two other reaction channels are being includes, namely, the quasi-deuteron mechanism at energies between 40 MeV and 140 MeV, and the photon hadronization process, which gives rise to the shadowing effect. With these modifications it will be possible to use the CRISP code for energies above 40 MeV up to a few GeV not only for reactions initiated by protons and neutrons, but also by photons. We will describe some of the consequences resulting of these modifications and present some results in order to illustrate the possible applications, for which this package can be used, mainly those related to spallation process involving high-energy protons.

  4. Experimental and theoretical investigations of the reactions NH(X {sup 3}{sigma}{sup -})+D({sup 2}S){yields}ND(X {sup 3}{sigma}{sup -})+H({sup 2}S) and NH(X {sup 3}{sigma}{sup -})+D({sup 2}S){yields}N({sup 4}S)+HD(X {sup 1}{sigma}{sub g}{sup +})

    SciTech Connect

    Qu, Z.-W.; Zhu, H.; Schinke, R.; Adam, L.; Hack, W.

    2005-05-22

    The rate coefficient of the reaction NH(X {sup 3}{sigma}{sup -})+D({sup 2}S){yields}{sup k{sub 1}}products (1) is determined in a quasistatic laser-flash photolysis, laser-induced fluorescence system at low pressures. The NH(X) radicals are produced by quenching of NH(a {sup 1}{delta}) (obtained in the photolysis of HN{sub 3}) with Xe and the D atoms are generated in a D{sub 2}/He microwave discharge. The NH(X) concentration profile is measured in the presence of a large excess of D atoms. The room-temperature rate coefficient is determined to be k{sub 1}=(3.9{+-}1.5)x10{sup 13} cm{sup 3} mol{sup -1} s{sup -1}. The rate coefficient k{sub 1} is the sum of the two rate coefficients, k{sub 1a} and k{sub 1b}, which correspond to the reactions NH(X {sup 3}{sigma}{sup -})+D({sup 2}S){yields}{sup k{sub 1a}}ND(X {sup 3}{sigma}{sup -})+H({sup 2}S) (1a) and NH(X {sup 3}{sigma}{sup -})+D({sup 2}S){yields}{sup k{sub 1b}}N({sup 4}S)+HD(X {sup 1}{sigma}{sub g}{sup +}) (1b), respectively. The first reaction proceeds via the {sup 2}A{sup ''} ground state of NH{sub 2} whereas the second one proceeds in the {sup 4}A{sup ''} state. A global potential energy surface is constructed for the {sup 2}A{sup ''} state using the internally contracted multireference configuration interaction method and the augmented correlation consistent polarized valence quadrupte zeta atomic basis. This potential energy surface is used in classical trajectory calculations to determine k{sub 1a}. Similar trajectory calculations are performed for reaction (1b) employing a previously calculated potential for the {sup 4}A{sup ''} state. The calculated room-temperature rate coefficient is k{sub 1}=4.1x10{sup 13} cm{sup 3} mol{sup -1} s{sup -1} with k{sub 1a}=4.0x10{sup 13} cm{sup 3} mol{sup -1} s{sup -1} and k{sub 1b}=9.1x10{sup 11} cm{sup 3} mol{sup -1} s{sup -1}. The theoretically determined k{sub 1} shows a very weak positive temperature dependence in the range 250{<=}T/K{<=}1000. Despite the deep potential

  5. Efficient prediction of (p,n) yields

    SciTech Connect

    Swift, D C; McNaney, J M; Higginson, D P; Beg, F

    2009-09-09

    In the continuous deceleration approximation, charged particles decelerate without any spread in energy as they traverse matter. This approximation simplifies the calculation of the yield of nuclear reactions, for which the cross-section depends on the particle energy. We calculated (p,n) yields for a LiF target, using the Bethe-Bloch relation for proton deceleration, and predicted that the maximum yield would be around 0.25% neutrons per incident proton, for an initial proton energy of 70 MeV or higher. Yield-energy relations calculated in this way can readily be used to optimize source and (p,n) converter characteristics.

  6. Comparison of secondary organic aerosol formed with an aerosol flow reactor and environmental reaction chambers: effect of oxidant concentration, exposure time and seed particles on chemical composition and yield

    DOE PAGESBeta

    Lambe, A. T.; Chhabra, P. S.; Onasch, T. B.; Brune, W. H.; Hunter, J. F.; Kroll, J. H.; Cummings, M. J.; Brogan, J. F.; Parmar, Y.; Worsnop, D. R.; et al

    2014-12-02

    We performed a systematic intercomparison study of the chemistry and yields of SOA generated from OH oxidation of a common set of gas-phase precursors in a Potential Aerosol Mass (PAM) continuous flow reactor and several environmental chambers. In the flow reactor, SOA precursors were oxidized using OH concentrations ranging from 2.0×108 to 2.2×1010 molec cm-3 over exposure times of 100 s. In the environmental chambers, precursors were oxidized using OH concentrations ranging from 2×106 to 2×107 molec cm-3 over exposure times of several hours. The OH concentration in the chamber experiments is close to that found in the atmosphere, butmore » the integrated OH exposure in the flow reactor can simulate atmospheric exposure times of multiple days compared to chamber exposure times of only a day or so. A linear correlation analysis of the mass spectra (m=0.91–0.92, r2=0.93–0.94) and carbon oxidation state (m=1.1, r2=0.58) of SOA produced in the flow reactor and environmental chambers for OH exposures of approximately 1011 molec cm-3 s suggests that the composition of SOA produced in the flow reactor and chambers is the same within experimental accuracy as measured with an aerosol mass spectrometer. This similarity in turn suggests that both in the flow reactor and in chambers, SOA chemical composition at low OH exposure is governed primarily by gas-phase OH oxidation of the precursors, rather than heterogeneous oxidation of the condensed particles. In general, SOA yields measured in the flow reactor are lower than measured in chambers for the range of equivalent OH exposures that can be measured in both the flow reactor and chambers. The influence of sulfate seed particles on isoprene SOA yield measurements was examined in the flow reactor. The studies show that seed particles increase the yield of SOA produced in flow reactors by a factor of 3 to 5 and may also account in part for higher SOA yields obtained in the chambers, where seed particles are

  7. The photoneutron yield predictions by PICA and comparison with the measurements

    SciTech Connect

    Job, P.K.; Gabriel, T.A.

    1995-12-31

    The photoneutron yields at higher photon energies have become very important since the advent of high energy electron accelerators. Bremsstrahlung is produced when the particle beam interacts with the storage-ring components or residual-gas molecules in the storage-ring vacuum. Bremsstrahlung thus produced interacts with the high-Z materials in the beamline like the beam dumps and collimators to produce photoneutrons. There are three modes of neutron production by bremsstrahlung. At low energies ({>=}525 MeV), photons are absorbed by the dipole interaction and the compound nucleus thus formed decays emitting protons and neutrons and other heavier particles. At higher energies ({>=}25 MeV), photon interacts with the nucleus through absorption on a quasi-deuteron, which subsequently decays producing a neutron and proton pair which can interact with the rest of the nucleus. At still higher energies the photopion production becomes possible and competes with the quasi-deuteron process. In this paper we have calculated the photoneutron yield from a thick copper target using the photonuclear interaction code PICA. Using this as the neutron source, we have calculated the dose rates through heavy concrete and compared it with the measurements made at the Advanced Photon Source at Argonne National Lab.

  8. More on Chemical Reaction Balancing.

    ERIC Educational Resources Information Center

    Swinehart, D. F.

    1985-01-01

    A previous article stated that only the matrix method was powerful enough to balance a particular chemical equation. Shows how this equation can be balanced without using the matrix method. The approach taken involves writing partial mathematical reactions and redox half-reactions, and combining them to yield the final balanced reaction. (JN)

  9. Systematics of Fission-Product Yields

    SciTech Connect

    A.C. Wahl

    2002-05-01

    Empirical equations representing systematics of fission-product yields have been derived from experimental data. The systematics give some insight into nuclear-structure effects on yields, and the equations allow estimation of yields from fission of any nuclide with atomic number Z{sub F} = 90 thru 98, mass number A{sub F} = 230 thru 252, and precursor excitation energy (projectile kinetic plus binding energies) PE = 0 thru {approx}200 MeV--the ranges of these quantities for the fissioning nuclei investigated. Calculations can be made with the computer program CYFP. Estimates of uncertainties in the yield estimates are given by equations, also in CYFP, and range from {approx} 15% for the highest yield values to several orders of magnitude for very small yield values. A summation method is used to calculate weighted average parameter values for fast-neutron ({approx} fission spectrum) induced fission reactions.

  10. The CCONE Code System and its Application to Nuclear Data Evaluation for Fission and Other Reactions

    NASA Astrophysics Data System (ADS)

    Iwamoto, O.; Iwamoto, N.; Kunieda, S.; Minato, F.; Shibata, K.

    2016-01-01

    A computer code system, CCONE, was developed for nuclear data evaluation within the JENDL project. The CCONE code system integrates various nuclear reaction models needed to describe nucleon, light charged nuclei up to alpha-particle and photon induced reactions. The code is written in the C++ programming language using an object-oriented technology. At first, it was applied to neutron-induced reaction data on actinides, which were compiled into JENDL Actinide File 2008 and JENDL-4.0. It has been extensively used in various nuclear data evaluations for both actinide and non-actinide nuclei. The CCONE code has been upgraded to nuclear data evaluation at higher incident energies for neutron-, proton-, and photon-induced reactions. It was also used for estimating β-delayed neutron emission. This paper describes the CCONE code system indicating the concept and design of coding and inputs. Details of the formulation for modelings of the direct, pre-equilibrium and compound reactions are presented. Applications to the nuclear data evaluations such as neutron-induced reactions on actinides and medium-heavy nuclei, high-energy nucleon-induced reactions, photonuclear reaction and β-delayed neutron emission are mentioned.

  11. The reaction NH2 + PH3 yields NH3 + PH2: Absolute rate constant measurement and implication for NH3 and PH3 photochemistry in the atmosphere of Jupiter

    NASA Technical Reports Server (NTRS)

    Bosco, S. R.; Brobst, W. D.; Nava, D. F.; Stief, L. J.

    1983-01-01

    The rate constant is measured over the temperature interval 218-456 K using the technique of flash photolysis-laser-induced fluorescence. NH2 radicals are produced by the flash photolysis of ammonia highly diluted in argon, and the decay of fluorescent NH2 photons is measured by multiscaling techniques. For each of the five temperatures employed in the study, the results are shown to be independent of variations in PH3 concentration, total pressure (argon), and flash intensity. It is found that the rate constant results are best represented for T between 218 and 456 K by the expression k = (1.52 + or - 0.16) x 10 to the -12th exp(-928 + or - 56/T) cu cm per molecule per sec; the error quoted is 1 standard deviation. This is the first determination of the rate constant for the reaction NH2 + PH3. The data are compared with an estimate made in order to explain results of the radiolysis of NH3-PH3 mixtures. The Arrhenius parameters determined here for NH2 + PH3 are then constrasted with those for the corresponding reactions of H and OH with PH3.

  12. Exact quantum dynamics study of the O{sup +}+H{sub 2}(v=0,j=0){yields}OH{sup +}+H ion-molecule reaction and comparison with quasiclassical trajectory calculations

    SciTech Connect

    Martinez, Rodrigo; Lucas, Josep M.; Gimenez, Xavier; Aguilar, Antonio; Gonzalez, Miguel

    2006-04-14

    The close-coupling hyperspherical (CCH) exact quantum method was used to study the title barrierless reaction up to a collision energy (E{sub T}) of 0.75 eV, and the results compared with quasiclassical trajectory (QCT) calculations to determine the importance of quantum effects. The CCH integral cross section decreased with E{sub T} and, although the QCT results were in general quite similar to the CCH ones, they presented a significant deviation from the CCH data within the 0.2-0.6 eV collision energy range, where the QCT method did not correctly describe the reaction probability. A very good accord between both methods was obtained for the OH{sup +} vibrational distribution, where no inversion of population was found. For the OH{sup +} rotational distributions, the agreement between the CCH and QCT results was not as good as in the vibrational case, but it was satisfactory in many conditions. The kk{sup '} angular distribution showed a preferential forward character, and the CCH method produced higher forward peaks than the QCT one. All the results were interpreted considering the potential energy surface and plots of a representative sampling of reactive trajectories.

  13. Measurement of isomeric yield ratios of 197m,gPt and 190m2,g+m1Ir from the 198Pt(γ,n) and natPt(γ,xn1p) reactions induced by 55-, 60-, and 65-MeV bremsstrahlung

    NASA Astrophysics Data System (ADS)

    Kye, Yong-Uk; Shin, Sung-Gyun; Cho, Moo-Hyun; Kim, Kyung Sook; Namkung, Won; Kim, Guinyun; Kim, Kwangsoo; Kang, Yeong-Rok; Lee, Man-Woo; Yang, Sung-Chul; Nguyen, Van Do; Pham, Duc Khue; Kim, Tien Thanh; Naik, Haladhara

    2015-05-01

    We have measured the isomeric yield ratios of 197m,gPt from the 198Pt(γ,n) reaction and 190m2,g+m1Ir from the natPt(γ,xn1p) reaction, induced with the bremsstrahlung end-point energies of 55-, 60-, and 65-MeV. The measurements were carried out by the activation method in combination with the direct γ-spectrometry. The experiments were performed at the 100 MeV electron linac of the Pohang Accelerator Laboratory (PAL). The obtained results at 55-, 60- and 65-MeV for the 197m,gPt from the 198Pt(γ,n) reaction are 0.166 ± 0.012, 0.174 ± 0.011, and 0.175 ± 0.011, whereas for the 190m2,g+m1Ir from the natPt(γ,xn1p) reaction are 0.072 ± 0.006, 0.084 ± 0.006 and 0.087 ± 0.006, respectively. The present results are measured for the first time over the investigated energy range. The present data are compared with the similar literature data at lower energy to examine the role of excitation energy.

  14. Yield Improvement in Steel Casting (Yield II)

    SciTech Connect

    Richard A. Hardin; Christoph Beckermann; Tim Hays

    2002-02-18

    This report presents work conducted on the following main projects tasks undertaken in the Yield Improvement in Steel Casting research program: Improvement of Conventional Feeding and Risering Methods, Use of Unconventional Yield Improvement Techniques, and Case Studies in Yield Improvement. Casting trials were conducted and then simulated using the precise casting conditions as recorded by the participating SFSA foundries. These results present a statistically meaningful set of experimental data on soundness versus feeding length. Comparisons between these casting trials and casting trials performed more than forty years ago by Pellini and the SFSA are quite good and appear reasonable. Comparisons between the current SFSA feeding rules and feeding rules based on the minimum Niyama criterion reveal that the Niyama-based rules are generally less conservative. The niyama-based rules also agree better with both the trials presented here, and the casting trails performed by Pellini an d the SFSA years ago. Furthermore, the use of the Niyama criterion to predict centerline shrinkage for horizontally fed plate sections has a theoretical basis according to the casting literature reviewed here. These results strongly support the use of improved feeding rules for horizontal plate sections based on the Niyama criterion, which can be tailored to the casting conditions for a given alloy and to a desired level of soundness. The reliability and repeatability of ASTM shrinkage x-ray ratings was investigated in a statistical study performed on 128 x-rays, each of which were rated seven different times. A manual ''Feeding and Risering Guidelines for Steel Castings' is given in this final report. Results of casting trials performed to test unconventional techniques for improving casting yield are presented. These use a stacked arrangement of castings and riser pressurization to increase the casting yield. Riser pressurization was demonstrated to feed a casting up to four time s the

  15. Rate Constant for the Reaction CH3 + CH3 Yields C2H6 at T = 155 K and Model Calculation of the CH3 Abundance in the Atmospheres of Saturn and Neptune

    NASA Technical Reports Server (NTRS)

    Cody, Regina J.; Romani, Paul N.; Nesbitt, Fred L.; Iannone, Mark A.; Tardy, Dwight C.; Stief, Louis J.

    2003-01-01

    The column abundances of CH3 observed by the Infrared Space Observatory (ISO) satellite on Saturn and Neptune were lower than predicted by atmospheric photochemical models, especially for Saturn. It has been suggested that the models underestimated the loss of CH3 due to poor knowledge of the rate constant k of the CH3 + CH3 self-reaction at the low temperatures and pressures of these atmospheres. Motivated by this suggestion, we undertook a combined experimental and photochemical modeling study of the CH3 + CH3 reaction and its role in determining planetary CH3 abundances. In a discharge flow-mass spectrometer system, k was measured at T = 155 K and three pressures of He. The results in units of cu cm/molecule/s are k(0.6 Torr) = 6.82 x 10(exp -11), k(1.0 Torr) = 6.98 x 10(exp -11), and k(1.5 Torr) = 6.91 x 10(exp -11). Analytical expressions for k were derived that (1) are consistent with the present laboratory data at T = 155 K, our previous data at T = 202 K and 298 K, and those of other studies in He at T = 296-298 K and (2) have some theoretical basis to provide justification for extrapolation. The derived analytical expressions were then used in atmospheric photochemical models for both Saturn and Neptune. These model results reduced the disparity with observations of Saturn, but not with observations of Neptune. However, the disparity for Neptune is much smaller. The solution to the remaining excess CH3 prediction in the models relative to the ISO observations lies, to a large extent, elsewhere in the CH3 photochemistry or transport, not in the CH3 + CH3 rate.

  16. Dynamical cluster-decay model for hot and rotating light-mass nuclear systems applied to the low-energy {sup 32}S+{sup 24}Mg{yields}{sup 56}Ni{sup *} reaction

    SciTech Connect

    Gupta, Raj K.; Kumar, Rajesh; Singh, Dalip; Balasubramaniam, M.; Beck, C.

    2005-01-01

    The dynamical cluster-decay model (DCM) is developed further for the decay of hot and rotating compound nuclei (China) formed in light heavy-ion reactions. The model is worked out in terms of only one parameter, namely the neck-length parameter, which is related to the total kinetic energy TKE(T) or effective Q value Q{sub eff}(T) at temperature T of the hot CN and is defined in terms of the CN binding energy and ground-state binding energies of the emitted fragments. The emission of both the light particles (LP), with A{<=}4,Z{<=}2, as well as the complex intermediate mass fragments (IMF), with 42, is considered as the dynamical collective mass motion of preformed clusters through the barrier. Within the same dynamical model treatment, the LPs are shown to have different characteristics compared to those of the IMFs. The systematic variations of the LP emission cross section {sigma}{sub LP} and IMF emission cross section {sigma}{sub IMF} calculated from the present DCM match exactly the statistical fission model predictions. A nonstatistical dynamical description is developed for the first time for emission of light particles from hot and rotating CN. The model is applied to the decay of {sup 56}Ni* formed in the {sup 32}S+{sup 24}Mg reaction at two incident energies E{sub c.m.}=51.6 and 60.5 MeV. Both the IMFs and average TKE{sup lowbar} spectra are found to compare resonably well with the experimental data, favoring asymmetric mass distributions. The LPs' emission cross section is shown to depend strongly on the type of emitted particles and their multiplicities.

  17. Reckoning wheat yield trends

    NASA Astrophysics Data System (ADS)

    Lin, M.; Huybers, P.

    2012-06-01

    Wheat yields have increased approximately linearly since the mid-twentieth century across the globe, but stagnation of these trends has now been suggested for several nations. We present a new statistical test for whether a yield time series has leveled off and apply it to wheat yield data from 47 different regions to show that nearly half of the production within our sample has transitioned to level trajectories. With the major exception of India, the majority of leveling in wheat yields occurs within developed nations—including the United Kingdom, France and Germany—whose policies appear to have disincentivized yield increases relative to other objectives. The effects of climate change and of yields nearing their maximum potential may also be important.

  18. Atmospheric Nitrogen Fluorescence Yield

    NASA Technical Reports Server (NTRS)

    Adams, J. H., Jr.; Christl, M. J.; Fountain, W. F.; Gregory, J. C.; Martens, K. U.; Sokolsky, Pierre; Whitaker, Ann F. (Technical Monitor)

    2001-01-01

    Several existing and planned experiments estimate the energies of ultra-high energy cosmic rays from air showers using the atmospheric nitrogen fluorescence. The nitrogen fluorescence yield from air shower electrons depends on the atmospheric composition. We will discuss the uncertainties in the fluorescence yield form electrons in the real atmosphere and describe a concept for a small balloon payload to measure the atmospheric fluorescence yield as a function of attitude.

  19. Reed canarygrass yield improvement

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Reed canarygrass is well adapted to the northern USA. Eight cultivars and 72 accessions collected in rural landscapes from Iowa to New Hampshire were evaluated for yield. Accessions produced on average 7% higher biomass yield compared to existing cultivars. Naturalized populations of reed canarygras...

  20. Thin-target excitation functions, cross-sections and optimised thick-target yields for natMo(p,xn)(94g ,95m,95g,96(m + g))Tc nuclear reactions induced by protons from threshold up to 44 MeV. No Carrier Added radiochemical separation and quality control.

    PubMed

    Bonardi, Mauro; Birattari, Claudio; Groppi, Flavia; Sabbioni, Enrico

    2002-11-01

    This work describes the method adopted in our laboratories, to produce 94gTc, 95gTc, 95mTc and 96gTc radionuclides via proton-cyclotron irradiation on molybdenum targets of natural isotopic composition. A new set of experimental thin-target excitation functions and "effective" cross-sections for direct natMo(p,xn)(A)Tc [with A = 94, 95, 95, 96] nuclear reactions, with incident proton energy in the range from threshold up to 44 MeV is presented. Some definitions of the equations used and nuclear data traceability are reported. Thick-target yield values were calculated and optimised, by numerical fitting and integration of the measured excitation functions. These values allow optimisation of production yield of one radionuclide, minimising at the same time the yield of the others. Radiochemical separation on NCA technetium radionuclides from both molybdenum target and niobium, zirconium and yttrium radioactive by-products is reported. Quality control tests of the radiotracers were developed for the applications envisaged in environmental metallo-biochemical toxicology. PMID:12433035

  1. A flash photolysis-shock tube kinetic study of the H atom reaction with O sub 2 : H + O sub 2 rightleftharpoons OH + O (962 K le T le 1705 K) and H + O sub 2 + Ar yields HO sub 2 + Ar (746 K le T le 987 K)

    SciTech Connect

    Pirraglia, A.N.; Michael, J.V.; Sutherland, J.W.; Klemm, R.B. )

    1989-01-12

    Rate constants for the reactions H + O{sub 2} {yields} OH + O (1) and H + O{sub 2} + M {yields} HO{sub 2} + M (2) were measured under pseudo-first-order conditions by the flash photolysis-shock tube technique that employs the atomic resonance absorption detection method to monitor (H){sub t}. Rate data for reaction 1 were obtained over the temperature range from 962 to 1705 K, and the results are well represented by the Arrhenius expression k{sub 1}(T) = (2.79 {plus minus} 0.32) {times} 10{sup {minus}10} exp(-16132 {plus minus} 276 cal mol{sup {minus}1}/RT) cm{sup 3} molecule{sup {minus}1} s{sup {minus}1}. The mean deviation of the experimentally measured rate constants from those calculated by using this expression is {plus minus}16% over the stated temperature range. The recent shock tube data of Frank and Just (1693-2577 K) were combined with the present results for k{sub 1}(T) to obtain the following Arrhenius expression for the overall temperature span (962-2577 K); k{sub 1}(T) = (3.18 {plus minus} 0.24) {times} 10{sup {minus}10} exp(-16439 {plus minus} 186 cal mol{sup {minus}1}/RT) cm{sup 3} molecule{sup {minus}1} s{sup {minus}1}. The mean deviation of the experimentally measured rate constants from this expression is {plus minus}15% over the entire temperature range. Values for the rate constant for the reverse of reaction 1 were calculated from each of the experimentally measured K{sub 1}(T) values with expressions for the equilibrium constant derived by using the latest JANAF thermochemical data. These k{sub {minus}1}(T) values were also combined with similarly derived values from the Frank and Just data.

  2. Management of ISOLDE yields

    NASA Astrophysics Data System (ADS)

    Turrión, M.; Eller, M.; Catherall, R.; Fraile, L. M.; Herman-Izycka, U.; Köster, U.; Lettry, J.; Riisager, K.; Stora, Th.

    2008-10-01

    Isotope yields at ISOLDE are regularly measured online (with dedicated gamma and beta detectors) and off line by implantation and subsequent alpha-, beta- or gamma spectroscopy. The Java based measurement software, dedicated to tape station measurements, has been updated in order to automate yield measurements and provide possibilities to repeat existing measurements. A procedure supported by dedicated programs was established to analyze data. The results are centrally stored and provide an interface to the existing ISOLDE yield database. The present ISOLDE yield database has been recently created and updated with a large number of yields compiled from published data. The database developed on ORACLE guarantees reliability and security and provides a simple way of compiling new information. A user oriented interface has been programmed allowing accessing the information via a web browser. Several levels in the database structure provide selective access to different layers of technical information for advanced users and for technical R&D. The improvements in the yield measurement procedure, the data storage and accessibility, as well as the new database structure, the web application and the access interfaces, enhance the communication between technical information like yields and the users of the ISOLDE facility.

  3. Lipases in lipophilization reactions.

    PubMed

    Villeneuve, Pierre

    2007-01-01

    Lipases are used in various sectors, as pharmaceutical, food or detergency industry. Their advantage versus classical chemical catalysts is that they exhibit a better selectivity and operate in milder reaction conditions. Theses enzymes can also be used in lipophilization reactions corresponding to the grafting of a lipophilic moiety to a hydrophilic one such as sugar, amino acids and proteins, or phenolic compounds. The major difficulty to overcome in such enzyme-catalyzed reaction resides in the fact that the two involved substrates greatly differ in term of polarity and solvent affinity. Therefore, several key parameters are to be considered in order to achieve the reaction in satisfactory kinetics and yields. The present review discusses the nature of such parameters (eg solvent nature, water activity, chemical modification of substrates) and illustrates their effect with examples of lipase-catalyzed lipophilization reactions of various sugar, amino acids or phenolic derivatives. PMID:17681737

  4. Low-Yield Cigarettes

    MedlinePlus

    ... Secondhand Smoke Smokeless Products Youth Tobacco Prevention Tobacco Industry and Products Federal Tax Increase Tobacco Ingredient Reporting ... be used. 3 In the past, the tobacco industry categorized low-yield cigarettes using measurements of tar ...

  5. Argentina wheat yield model

    NASA Technical Reports Server (NTRS)

    Callis, S. L.; Sakamoto, C.

    1984-01-01

    Five models based on multiple regression were developed to estimate wheat yields for the five wheat growing provinces of Argentina. Meteorological data sets were obtained for each province by averaging data for stations within each province. Predictor variables for the models were derived from monthly total precipitation, average monthly mean temperature, and average monthly maximum temperature. Buenos Aires was the only province for which a trend variable was included because of increasing trend in yield due to technology from 1950 to 1963.

  6. Argentina soybean yield model

    NASA Technical Reports Server (NTRS)

    Callis, S. L.; Sakamoto, C.

    1984-01-01

    A model based on multiple regression was developed to estimate soybean yields for the country of Argentina. A meteorological data set was obtained for the country by averaging data for stations within the soybean growing area. Predictor variables for the model were derived from monthly total precipitation and monthly average temperature. A trend variable was included for the years 1969 to 1978 since an increasing trend in yields due to technology was observed between these years.

  7. Argentina corn yield model

    NASA Technical Reports Server (NTRS)

    Callis, S. L.; Sakamoto, C.

    1984-01-01

    A model based on multiple regression was developed to estimate corn yields for the country of Argentina. A meteorological data set was obtained for the country by averaging data for stations within the corn-growing area. Predictor variables for the model were derived from monthly total precipitation, average monthly mean temperature, and average monthly maximum temperature. A trend variable was included for the years 1965 to 1980 since an increasing trend in yields due to technology was observed between these years.

  8. Dynamic Reaction Figures: An Integrative Vehicle for Understanding Chemical Reactions

    ERIC Educational Resources Information Center

    Schultz, Emeric

    2008-01-01

    A highly flexible learning tool, referred to as a dynamic reaction figure, is described. Application of these figures can (i) yield the correct chemical equation by simply following a set of menu driven directions; (ii) present the underlying "mechanism" in chemical reactions; and (iii) help to solve quantitative problems in a number of different…

  9. Kinetics of O{sub 2}({sup 1{Sigma}}) formation in the reaction O{sub 2}({sup 1{Delta}}) + O{sub 2}({sup 1{Delta}}) {yields} O{sub 2}({sup 1{Sigma}}) + O{sub 2}({sup 3{Sigma}})

    SciTech Connect

    Zagidullin, M V; Khvatov, N A; Nyagashkin, A Yu

    2011-02-28

    The dependence of the ratio of specific powers of dimole radiation of singlet oxygen in the 634 nm band and in the b - X band of the O{sub 2}({sup 1{Sigma}}) molecule in the O{sub 2}(X) - O{sub 2}({sup 1{Delta}}) - O{sub 2}({sup 1{Sigma}}) - H{sub 2}O - CO{sub 2} mixture on the CO{sub 2} concentration is measured. As a result, the rate constant of the reaction O{sub 2}({sup 1{Delta}}) + O{sub 2}({sup 1{Delta}}) {yields} O{sub 2}({sup 1{Sigma}}) + O{sub 2}({sup 3{Sigma}}) at the temperature {approx}330 K is found to equal (4.5 {+-} 1.1) 10{sup -17} cm{sup 3} s{sup -1}. (active media)

  10. Yield threshold decision framework

    SciTech Connect

    Judd, B.R.; Younker, L.W.; Hannon, W.J.

    1989-08-17

    The USA is developing a decision analysis framework for evaluating the relative value of lower yield thresholds and related verification policies. The framework facilitates systematic analysis of the major issues in the yield threshold decision. The framework can be used to evaluate options proposed either in the inter-agency process or in the negotiations. In addition, the framework can measure the importance of uncertainties and alternative judgments, and thereby determine the advantages of additional research. Since the model is explicit and quantitative, it provides a rational, defensible approach for reaching important treaty and verification decisions. 9 figs.

  11. Atmospheric pressure microwave assisted heterogeneous catalytic reactions.

    PubMed

    Chemat-Djenni, Zoubida; Hamada, Boudjema; Chemat, Farid

    2007-01-01

    The purpose of the study was to investigate microwave selective heating phenomena and their impact on heterogeneous chemical reactions. We also present a tool which will help microwave chemists to answer to such questions as "My reaction yields 90% after 7 days at reflux; is it possible to obtain the same yield after a few minutes under microwaves?" and to have an approximation of their reactions when conducted under microwaves with different heterogeneous procedures. This model predicting reaction kinetics and yields under microwave heating is based on the Arrhenius equation, in agreement with experimental data and procedures. PMID:17909495

  12. Atmospheric Fluorescence Yield

    NASA Technical Reports Server (NTRS)

    Adams, James H., Jr.; Christl, M. J.; Fountain, W. F.; Gregory, J. C.; Martens, K.; Sokolsky, P.; Whitaker, Ann F. (Technical Monitor)

    2001-01-01

    Several existing and planned experiments estimate the energies of ultra-high energy cosmic rays from air showers using the atmospheric fluorescence from these showers. Accurate knowledge of the conversion from atmospheric fluorescence to energy loss by ionizing particles in the atmosphere is key to this technique. In this paper we discuss a small balloon-borne instrument to make the first in situ measurements versus altitude of the atmospheric fluorescence yield. The instrument can also be used in the lab to investigate the dependence of the fluorescence yield in air on temperature, pressure and the concentrations of other gases that present in the atmosphere. The results can be used to explore environmental effects on and improve the accuracy of cosmic ray energy measurements for existing ground-based experiments and future space-based experiments.

  13. Total radical yields from tropospheric ethene ozonolysis.

    PubMed

    Alam, Mohammed S; Camredon, Marie; Rickard, Andrew R; Carr, Timo; Wyche, Kevin P; Hornsby, Karen E; Monks, Paul S; Bloss, William J

    2011-06-21

    The gas-phase reactions of ozone with alkenes can be significant sources of free radicals (OH, HO(2) and RO(2)) in the Earth's atmosphere. In this study the total radical production and degradation products from ethene ozonolysis have been measured, under conditions relevant to the troposphere, during a series of detailed simulation chamber experiments. Experiments were carried out in the European photoreactor EUPHORE (Valencia, Spain), utilising various instrumentation including a chemical-ionisation-reaction time-of-flight mass-spectrometer (CIR-TOF-MS) measuring volatile organic compounds/oxygenated volatile organic compounds (VOCs/OVOCs), a laser induced fluorescence (LIF) system for measuring HO(2) radical products and a peroxy radical chemical amplification (PERCA) instrument measuring HO(2) + ΣRO(2). The ethene + ozone reaction system was investigated with and without an OH radical scavenger, in order to suppress side reactions. Radical concentrations were measured under dry and humid conditions and interpreted through detailed chemical chamber box modelling, incorporating the Master Chemical Mechanism (MCMv3.1) degradation scheme for ethene, which was updated to include a more explicit representation of the ethene-ozone reaction mechanism.The rate coefficient for the ethene + ozone reaction was measured to be (1.45 ± 0.25) × 10(-18) cm(3) molecules(-1) s(-1) at 298 K, and a stabilised Criegee intermediate yield of 0.54 ± 0.12 was determined from excess CO scavenger experiments. An OH radical yield of 0.17 ± 0.09 was determined using a cyclohexane scavenger approach, by monitoring the formation of the OH-initiated cyclohexane oxidation products and HO(2). The results highlight the importance of knowing the [HO(2)] (particularly under alkene limited conditions and high [O(3)]) and scavenger chemistry when deriving radical yields. An averaged HO(2) yield of 0.27 ± 0.07 was determined by LIF/model fitting. The observed yields are interpreted in terms of

  14. Modified triglyceride oil through reactions with phenyltriazolinedione

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The synthesis of a modified triglyceride oil was achieved through the reactions with 4-phenyl-1,2-4-triazoline-3,5-dione (PTAD). 1H NMR was used for structure determination and to monitor the reactions. Several reaction products were produced, and their relative yields depended on the stoichiometry ...

  15. Reaction Order Ambiguity in Integrated Rate Plots

    ERIC Educational Resources Information Center

    Lee, Joe

    2008-01-01

    Integrated rate plots are frequently used in reaction kinetics to determine orders of reactions. It is often emphasised, when using this methodology in practice, that it is necessary to monitor the reaction to a substantial fraction of completion for these plots to yield unambiguous orders. The present article gives a theoretical and statistical…

  16. Technique for increasing yield of trifluoroni-trosomethane-tetrafluoro- ethylene copolymer

    NASA Technical Reports Server (NTRS)

    Glickman, S. A.

    1972-01-01

    Polymerization technique using equimolar amounts of trifluoronitrosomethane and tetrafluoroethylene to increase yield of copolymer is described. Yields were increased by ninety percent and final product displayed better physical properties. Test equipment and chemical reactions for process are described.

  17. Interactive effects of pests increase seed yield.

    PubMed

    Gagic, Vesna; Riggi, Laura Ga; Ekbom, Barbara; Malsher, Gerard; Rusch, Adrien; Bommarco, Riccardo

    2016-04-01

    Loss in seed yield and therefore decrease in plant fitness due to simultaneous attacks by multiple herbivores is not necessarily additive, as demonstrated in evolutionary studies on wild plants. However, it is not clear how this transfers to crop plants that grow in very different conditions compared to wild plants. Nevertheless, loss in crop seed yield caused by any single pest is most often studied in isolation although crop plants are attacked by many pests that can cause substantial yield losses. This is especially important for crops able to compensate and even overcompensate for the damage. We investigated the interactive impacts on crop yield of four insect pests attacking different plant parts at different times during the cropping season. In 15 oilseed rape fields in Sweden, we estimated the damage caused by seed and stem weevils, pollen beetles, and pod midges. Pest pressure varied drastically among fields with very low correlation among pests, allowing us to explore interactive impacts on yield from attacks by multiple species. The plant damage caused by each pest species individually had, as expected, either no, or a negative impact on seed yield and the strongest negative effect was caused by pollen beetles. However, seed yield increased when plant damage caused by both seed and stem weevils was high, presumably due to the joint plant compensatory reaction to insect attack leading to overcompensation. Hence, attacks by several pests can change the impact on yield of individual pest species. Economic thresholds based on single species, on which pest management decisions currently rely, may therefore result in economically suboptimal choices being made and unnecessary excessive use of insecticides. PMID:27099712

  18. {lambda}(1520) {yields} {lambda}{gamma} Radiative-Decay Width

    SciTech Connect

    Vavilov, D.V.; Antipov, Yu.M.; Artamonov, A.V.; Batarin, V.A.; Victorov, V.A.; Golovkin, S.V.; Gorin, Yu.P.; Eroshin, O.V.; Kozhevnikov, A.P.; Konstantinov, A.S.; Kubarovsky, V.P.; Kurshetsov, V.F.; Landsberg, L.G.; Leontiev, V.M.; Molchanov, V.V.; Mukhin, V.A.; Patalakha, D.I.; Petrenko, S.V.; Petrukhin, A.I.; Kolganov, V.Z.

    2005-03-01

    The radiative decay {lambda}(1520) {yields} {lambda}{gamma} was recorded in the exclusive reaction p + N {yields} {lambda}(1520)K{sup +} + N at the SPHINX facility. The branching ratio for this decay and the corresponding partial width were found to be, respectively, Br[{lambda}(1520) {yields} {lambda}{gamma}] = (1.02 {+-} 0.21) x 10{sup -2} and {gamma}[{lambda}(1520) {yields} {lambda}{gamma}] = 159 {+-} 35 keV (the quoted errors are purely statistical, the systematic errors being within 15%)

  19. YIELD EDITOR: SOFTWARE FOR REMOVING ERRORS FROM CROP YIELD MAPS

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Yield maps are a key component of precision agriculture, due to their usefulness in both development and evaluation of precision management strategies. The value of these yield maps can be compromised by the fact that raw yield maps contain a variety of inherent errors. Researchers have reported t...

  20. Drug Reactions

    MedlinePlus

    Most of the time, medicines make our lives better. They reduce aches and pains, fight infections, and control problems such as high blood pressure or diabetes. But medicines can also cause unwanted reactions. One problem is ...

  1. High-yield synthesis of bioactive ethyl cinnamate by enzymatic esterification of cinnamic acid.

    PubMed

    Wang, Yun; Zhang, Dong-Hao; Zhang, Jiang-Yan; Chen, Na; Zhi, Gao-Ying

    2016-01-01

    In this paper, Lipozyme TLIM-catalyzed synthesis of ethyl cinnamate through esterification of cinnamic acid with ethanol was studied. In order to increase the yield of ethyl cinnamate, several media, including acetone, isooctane, DMSO and solvent-free medium, were investigated in this reaction. The reaction showed a high yield by using isooctane as reaction medium, which was found to be much higher than the yields reported previously. Furthermore, several parameters such as shaking rate, water activity, reaction temperature, substrate molar ratio and enzyme loading had important influences on this reaction. For instance, when temperature increased from 10 to 50 °C, the initial reaction rate increased by 18 times and the yield of ethyl cinnamate increased by 6.2 times. Under the optimum conditions, lipase-catalyzed synthesis of ethyl cinnamate gave a maximum yield of 99%, which was of general interest for developing industrial processes for the preparation of ethyl cinnamate. PMID:26213020

  2. Yield enhancement with DFM

    NASA Astrophysics Data System (ADS)

    Paek, Seung Weon; Kang, Jae Hyun; Ha, Naya; Kim, Byung-Moo; Jang, Dae-Hyun; Jeon, Junsu; Kim, DaeWook; Chung, Kun Young; Yu, Sung-eun; Park, Joo Hyun; Bae, SangMin; Song, DongSup; Noh, WooYoung; Kim, YoungDuck; Song, HyunSeok; Choi, HungBok; Kim, Kee Sup; Choi, Kyu-Myung; Choi, Woonhyuk; Jeon, JoongWon; Lee, JinWoo; Kim, Ki-Su; Park, SeongHo; Chung, No-Young; Lee, KangDuck; Hong, YoungKi; Kim, BongSeok

    2012-03-01

    A set of design for manufacturing (DFM) techniques have been developed and applied to 45nm, 32nm and 28nm logic process technologies. A noble technology combined a number of potential confliction of DFM techniques into a comprehensive solution. These techniques work in three phases for design optimization and one phase for silicon diagnostics. In the DFM prevention phase, foundation IP such as standard cells, IO, and memory and P&R tech file are optimized. In the DFM solution phase, which happens during ECO step, auto fixing of process weak patterns and advanced RC extraction are performed. In the DFM polishing phase, post-layout tuning is done to improve manufacturability. DFM analysis enables prioritization of random and systematic failures. The DFM technique presented in this paper has been silicon-proven with three successful tape-outs in Samsung 32nm processes; about 5% improvement in yield was achieved without any notable side effects. Visual inspection of silicon also confirmed the positive effect of the DFM techniques.

  3. Secondary Electron Emission Yields

    NASA Technical Reports Server (NTRS)

    Krainsky, I.; Lundin, W.; Gordon, W. L.; Hoffman, R. W.

    1981-01-01

    The secondary electron emission (SEE) characteristics for a variety of spacecraft materials were determined under UHV conditions using a commercial double pass CMA which permits sequential Auger electron electron spectroscopic analysis of the surface. The transparent conductive coating indium tin oxide (ITO) was examined on Kapton and borosilicate glass and indium oxide on FED Teflon. The total SEE coefficient ranges from 2.5 to 2.6 on as-received surfaces and from 1.5 to 1.6 on Ar(+) sputtered surfaces with 5 nm removed. A cylindrical sample carousel provides normal incidence of the primary beam as well as a multiple Faraday cup measurement of the approximately nA beam currents. Total and true secondary yields are obtained from target current measurements with biasing of the carousel. A primary beam pulsed mode to reduce electron beam dosage and minimize charging of insulating coatings was applied to Mg/F2 coated solar cell covers. Electron beam effects on ITO were found quite important at the current densities necessary to do Auger studies.

  4. Yield gains in leafy vegetables

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Yield of all crops have increased during the past century through improved cultural practices and plant breeding. We reviewed gains in yield of lettuce and spinach in the U.S., principally California and Arizona. We proposed several genetic models for yield of lettuce based on the market type: whole...

  5. Mineral-water reactions in metamorphism and volcanism

    USGS Publications Warehouse

    Barnes, I.

    1985-01-01

    Low-temperature (120??C and less) metamorphism of graywacke, granite and andesite yields zeolites and precursor gels by reaction with fresh water but low-greenschist facies by reaction with salt (sea)water. ?? 1985.

  6. Fundamental reaction pathways during coprocessing

    SciTech Connect

    Stock, L.M.; Gatsis, J.G.

    1992-12-01

    The objective of this research was to investigate the fundamental reaction pathways in coal petroleum residuum coprocessing. Once the reaction pathways are defined, further efforts can be directed at improving those aspects of the chemistry of coprocessing that are responsible for the desired results such as high oil yields, low dihydrogen consumption, and mild reaction conditions. We decided to carry out this investigation by looking at four basic aspects of coprocessing: (1) the effect of fossil fuel materials on promoting reactions essential to coprocessing such as hydrogen atom transfer, carbon-carbon bond scission, and hydrodemethylation; (2) the effect of varied mild conditions on the coprocessing reactions; (3) determination of dihydrogen uptake and utilization under severe conditions as a function of the coal or petroleum residuum employed; and (4) the effect of varied dihydrogen pressure, temperature, and residence time on the uptake and utilization of dihydrogen and on the distribution of the coprocessed products. Accomplishments are described.

  7. Fusion yield: Guderley model and Tsallis statistics

    NASA Astrophysics Data System (ADS)

    Haubold, H. J.; Kumar, D.

    2011-02-01

    The reaction rate probability integral is extended from Maxwell-Boltzmann approach to a more general approach by using the pathway model introduced by Mathai in 2005 (A pathway to matrix-variate gamma and normal densities. Linear Algebr. Appl. 396, 317-328). The extended thermonuclear reaction rate is obtained in the closed form via a Meijer's G-function and the so-obtained G-function is represented as a solution of a homogeneous linear differential equation. A physical model for the hydrodynamical process in a fusion plasma-compressed and laser-driven spherical shock wave is used for evaluating the fusion energy integral by integrating the extended thermonuclear reaction rate integral over the temperature. The result obtained is compared with the standard fusion yield obtained by Haubold and John in 1981 (Analytical representation of the thermonuclear reaction rate and fusion energy production in a spherical plasma shock wave. Plasma Phys. 23, 399-411). An interpretation for the pathway parameter is also given.

  8. Drug Reactions

    MedlinePlus

    ... using any of these products. Some types of food may also cause adverse drug reactions. For example, grapefruit and grapefruit juice, as well as alcohol and caffeine, may affect how drugs work. Every time your doctor ... interactions with any foods or beverages. What about medicines I've used ...

  9. An ESI-MS Method to Determine Yield and Enantioselectivity in a Single Assay

    NASA Astrophysics Data System (ADS)

    Smith, Maureen E.; Knolls, Steven A.; Thompson, MyLe; Masterson, Douglas S.

    2015-03-01

    A mass spectrometry assay is presented here that allows for the simultaneous determination of yield and enantioselectivity in a single analysis. The assay makes use of molecules that are structurally similar to the analytes of interest as standards. The assay predicts the yields of the reactions reasonably well and with little error. For example, in the pig liver esterase catalyzed hydrolysis of one prochiral malonate, the yield predicted by the assay was 72%, while larger scale isolated reaction yields were within 5% of this value. This assay provides a fast method to determine yield and enantioselectivity in one analysis. The strengths and limitations of this method are discussed.

  10. Ferrier reaction in a deep eutectic solvent.

    PubMed

    Rokade, Sunil M; Bhate, Prakash M

    2015-10-13

    A mild and efficient synthesis of 2,3-unsaturated sugar derivatives has been achieved by conducting the Ferrier reaction in a deep eutectic solvent (DES). A wide range of alcohols including primary, secondary, benzylic, and sugar-derived primary alcohols can be used. Advantages include good yields, shorter reaction times and recyclability of DES. PMID:26279523

  11. Incorporating phenology into yield models

    NASA Astrophysics Data System (ADS)

    Gray, J. M.; Friedl, M. A.

    2015-12-01

    Because the yields of many crops are sensitive to meteorological forcing during specific growth stages, phenological information has potential utility in yield mapping and forecasting exercises. However, most attempts to explain the spatiotemporal variability in crop yields with weather data have relied on growth stage definitions that do not change from year-to-year, even though planting, maturity, and harvesting dates show significant interannual variability. We tested the hypothesis that quantifying temperature exposures over dynamically determined growth stages would better explain observed spatiotemporal variability in crop yields than statically defined time periods. Specifically, we used National Agricultural and Statistics Service (NASS) crop progress data to identify the timing of the start of the maize reproductive growth stage ("silking"), and examined the correlation between county-scale yield anomalies and temperature exposures during either the annual or long-term average silking period. Consistent with our hypothesis and physical understanding, yield anomalies were more correlated with temperature exposures during the actual, rather than the long-term average, silking period. Nevertheless, temperature exposures alone explained a relatively low proportion of the yield variability, indicating that other factors and/or time periods are also important. We next investigated the potential of using remotely sensed land surface phenology instead of NASS progress data to retrieve crop growth stages, but encountered challenges related to crop type mapping and subpixel crop heterogeneity. Here, we discuss the potential of overcoming these challenges and the general utility of remotely sensed land surface phenology in crop yield mapping.

  12. Rx for low cash yields.

    PubMed

    Tobe, Chris

    2003-10-01

    Certain strategies can offer not-for-profit hospitals potentially greater investment yields while maintaining stability and principal safety. Treasury inflation-indexed securities can offer good returns, low volatility, and inflation protection. "Enhanced cash" strategies offer liquidity and help to preserve capital. Stable value "wrappers" allow hospitals to pursue higher-yielding fixed-income securities without an increase in volatility. PMID:14560584

  13. Brazil soybean yield covariance model

    NASA Technical Reports Server (NTRS)

    Callis, S. L.; Sakamoto, C.

    1984-01-01

    A model based on multiple regression was developed to estimate soybean yields for the seven soybean-growing states of Brazil. The meteorological data of these seven states were pooled and the years 1975 to 1980 were used to model since there was no technological trend in the yields during these years. Predictor variables were derived from monthly total precipitation and monthly average temperature.

  14. Cross section for the reaction {sup 115}In(γ, γ′){sup 115m} In in the region of the E1 giant resonance

    SciTech Connect

    Dzhilavyan, L. Z.

    2015-07-15

    The cross section for the reaction {sup 115}In(γ, γ′){sub 115m}In was measured for photon energies in the range of E{sub γ} ≅ 4–46 MeV. The parameters of the peak in this cross section near the threshold for the reaction {sup 115}In(γ, n), (E{sub γ}){sub (γ,n)}{sup thr}, were refined. It is shown that, in the cross section for the reaction {sup 115}In(γ, γ′){sup 115m}In at Eγ ∼ 27 MeV, there is no second peak for which δ{sub II}{sup int} would exceed about 0.2δ{sub I}{sup int} for the peak at E{sub γ} ∼ (E{sub γ}){sub (γ,n)}{sup thr}. The possibility of employing this reaction both in studying photonuclear reaction physics and in monitoring bremsstrahlung photons in gamma-activation studies was examined.

  15. Integrated Microreactors for Reaction Automation: New Approaches to Reaction Development

    NASA Astrophysics Data System (ADS)

    McMullen, Jonathan P.; Jensen, Klavs F.

    2010-07-01

    Applications of microsystems (microreactors) in continuous-flow chemistry have expanded rapidly over the past two decades, with numerous reports of higher conversions and yields compared to conventional batch benchtop equipment. Synthesis applications are enhanced by chemical information gained from integrating microreactor components with sensors, actuators, and automated fluid handling. Moreover, miniaturized systems allow experiments on well-defined samples at conditions not easily accessed by conventional means, such as reactions at high pressure and temperatures. The wealth of synthesis information that could potentially be acquired through use of microreactors integrated with physical sensors and analytical chemistry techniques for online reaction monitoring has not yet been well explored. The increased efficiency resulting from use of continuous-flow microreactor platforms to automate reaction screening and optimization encourages a shift from current batchwise chemical reaction development to this new approach. We review advances in this new area and provide application examples of online monitoring and automation.

  16. Covariance Matrix Evaluations for Independent Mass Fission Yields

    NASA Astrophysics Data System (ADS)

    Terranova, N.; Serot, O.; Archier, P.; De Saint Jean, C.; Sumini, M.

    2015-01-01

    Recent needs for more accurate fission product yields include covariance information to allow improved uncertainty estimations of the parameters used by design codes. The aim of this work is to investigate the possibility to generate more reliable and complete uncertainty information on independent mass fission yields. Mass yields covariances are estimated through a convolution between the multi-Gaussian empirical model based on Brosa's fission modes, which describe the pre-neutron mass yields, and the average prompt neutron multiplicity curve. The covariance generation task has been approached using the Bayesian generalized least squared method through the CONRAD code. Preliminary results on mass yields variance-covariance matrix will be presented and discussed from physical grounds in the case of 235U(nth, f) and 239Pu(nth, f) reactions.

  17. Covariance Matrix Evaluations for Independent Mass Fission Yields

    SciTech Connect

    Terranova, N.; Serot, O.; Archier, P.; De Saint Jean, C.

    2015-01-15

    Recent needs for more accurate fission product yields include covariance information to allow improved uncertainty estimations of the parameters used by design codes. The aim of this work is to investigate the possibility to generate more reliable and complete uncertainty information on independent mass fission yields. Mass yields covariances are estimated through a convolution between the multi-Gaussian empirical model based on Brosa's fission modes, which describe the pre-neutron mass yields, and the average prompt neutron multiplicity curve. The covariance generation task has been approached using the Bayesian generalized least squared method through the CONRAD code. Preliminary results on mass yields variance-covariance matrix will be presented and discussed from physical grounds in the case of {sup 235}U(n{sub th}, f) and {sup 239}Pu(n{sub th}, f) reactions.

  18. Chemistry of heavy ion reactions

    SciTech Connect

    Hoffman, D.C.

    1988-10-01

    The use of heavy ions to induce nuclear reactions was reported as early as 1950. Since that time it has been one of the most active areas of nuclear research. Intense beams of ions as heavy as uranium with energies high enough to overcome the Coulomb barriers of even the heaviest elements are available. The wide variety of possible reactions gives rise to a multitude of products which have been studied by many ingenious chemical and physical techniques. Chemical techniques have been of special value for the separation and unequivocal identification of low yield species from the plethora of other nuclides present. Heavy ion reactions have been essential for the production of the trans-Md elements and a host of new isotopes. The systematics of compound nucleus reactions, transfer reactions, and deeply inelastic reactions have been elucidated using chemical techniques. A review of the variety of chemical procedures and techniques which have been developed for the study of heavy ion reactions and their products is given. Determination of the chemical properties of the trans-Md elements, which are very short-lived and can only be produced an ''atom-at-a-time'' via heavy ion reactions, is discussed. 53 refs., 19 figs.

  19. The Retro-Hydroformylation Reaction.

    PubMed

    Kusumoto, Shuhei; Tatsuki, Toshiumi; Nozaki, Kyoko

    2015-07-13

    Hydroformylation, a reaction that adds carbon monoxide and dihydrogen across an unsaturated carbon-carbon multiple bond, has been widely employed in the chemical industry since its discovery in 1938. In contrast, the reverse reaction, retro-hydroformylation, has seldom been studied. The retro-hydroformylation reaction of an aldehyde into an alkene and synthesis gas (a mixture of carbon monoxide and dihydrogen) in the presence of a cyclopentadienyl iridium catalyst is now reported. Aliphatic aldehydes were converted into the corresponding alkenes in up to 91% yield with concomitant release of carbon monoxide and dihydrogen. Mechanistic control experiments indicated that the reaction proceeds by retro-hydroformylation and not by a sequential decarbonylation-dehydrogenation or dehydrogenation-decarbonylation process. PMID:26089259

  20. Decomposing global crop yield variability

    NASA Astrophysics Data System (ADS)

    Ben-Ari, Tamara; Makowski, David

    2014-11-01

    Recent food crises have highlighted the need to better understand the between-year variability of agricultural production. Although increasing future production seems necessary, the globalization of commodity markets suggests that the food system would also benefit from enhanced supplies stability through a reduction in the year-to-year variability. Here, we develop an analytical expression decomposing global crop yield interannual variability into three informative components that quantify how evenly are croplands distributed in the world, the proportion of cultivated areas allocated to regions of above or below average variability and the covariation between yields in distinct world regions. This decomposition is used to identify drivers of interannual yield variations for four major crops (i.e., maize, rice, soybean and wheat) over the period 1961-2012. We show that maize production is fairly spread but marked by one prominent region with high levels of crop yield interannual variability (which encompasses the North American corn belt in the USA, and Canada). In contrast, global rice yields have a small variability because, although spatially concentrated, much of the production is located in regions of below-average variability (i.e., South, Eastern and South Eastern Asia). Because of these contrasted land use allocations, an even cultivated land distribution across regions would reduce global maize yield variance, but increase the variance of global yield rice. Intermediate results are obtained for soybean and wheat for which croplands are mainly located in regions with close-to-average variability. At the scale of large world regions, we find that covariances of regional yields have a negligible contribution to global yield variance. The proposed decomposition could be applied at any spatial and time scales, including the yearly time step. By addressing global crop production stability (or lack thereof) our results contribute to the understanding of a key

  1. Grapevine canopy reflectance and yield

    NASA Technical Reports Server (NTRS)

    Minden, K. A.; Philipson, W. R.

    1982-01-01

    Field spectroradiometric and airborne multispectral scanner data were applied in a study of Concord grapevines. Spectroradiometric measurements of 18 experimental vines were collected on three dates during one growing season. Spectral reflectance, determined at 30 intervals from 0.4 to 1.1 microns, was correlated with vine yield, pruning weight, clusters/vine, and nitrogen input. One date of airborne multispectral scanner data (11 channels) was collected over commercial vineyards, and the average radiance values for eight vineyard sections were correlated with the corresponding average yields. Although some correlations were significant, they were inadequate for developing a reliable yield prediction model.

  2. Integrated process for high conversion and high yield protein PEGylation.

    PubMed

    Pfister, David; Morbidelli, Massimo

    2016-08-01

    Over the past decades, PEGylation has become a powerful technique to increase the in vivo circulation half-life of therapeutic proteins while maintaining their activity. The development of new therapeutic proteins is likely to require further improvement of the PEGylation methods to reach even better selectivity and yield for reduced costs. The intensification of the PEGylation process was investigated through the integration of a chromatographic step in order to increase yield and conversion for the production of mono-PEGylated protein. Lysozyme was used as a model protein to demonstrate the feasibility of such approach. In the integrated reaction/separation process, chromatography was used as fractionation technique in order to isolate and recycle the unreacted protein from the PEGylated products. This allows operating the reactor with short reaction times so as to minimize the production of multi-PEGylated proteins (i.e., conjugated to more than one polymer). That is, the reaction is stopped before the desired product (i.e., the mono-PEGylated protein) can further react, thus leading to limited conversion but high yield. The recycling of the unreacted protein was then considered to drive the protein overall conversion to completion. This approach has great potential to improve processes whose yield is limited by the further reaction of the product leading to undesirable by-products. Biotechnol. Bioeng. 2016;113: 1711-1718. © 2016 Wiley Periodicals, Inc. PMID:26757029

  3. Reactions in water: alkyl nitrile coupling reactions using Fenton's reagent.

    PubMed

    Keller, Christopher L; Dalessandro, James D; Hotz, Richard P; Pinhas, Allan R

    2008-05-01

    The coupling reaction of water-soluble alkyl nitriles using Fenton's reagent (Fe(II) and H2O2) is described. The best metal for the reaction is iron(II), and the greatest yields are obtained when the concentration of the metal is kept low. Hydrogen-atom abstraction is selective, preferentially producing the radical alpha to the nitrile. In order to increase the production of dinitrile, in situ reduction of iron(III) to iron(II), using a variety of reducing agents, was investigated. PMID:18363368

  4. Combustion kinetics and reaction pathways

    SciTech Connect

    Klemm, R.B.; Sutherland, J.W.

    1993-12-01

    This project is focused on the fundamental chemistry of combustion. The overall objectives are to determine rate constants for elementary reactions and to elucidate the pathways of multichannel reactions. A multitechnique approach that features three independent experiments provides unique capabilities in performing reliable kinetic measurements over an exceptionally wide range in temperature, 300 to 2500 K. Recent kinetic work has focused on experimental studies and theoretical calculations of the methane dissociation system (CH{sub 4} + Ar {yields} CH{sub 3} + H + Ar and H + CH{sub 4} {yields} CH{sub 3} + H{sub 2}). Additionally, a discharge flow-photoionization mass spectrometer (DF-PIMS) experiment is used to determine branching fractions for multichannel reactions and to measure ionization thresholds of free radicals. Thus, these photoionization experiments generate data that are relevant to both reaction pathways studies (reaction dynamics) and fundamental thermochemical research. Two distinct advantages of performing PIMS with high intensity, tunable vacuum ultraviolet light at the National Synchrotron Light Source are high detection sensitivity and exceptional selectivity in monitoring radical species.

  5. Universality in fragment inclusive yields from Au+Au collisions

    NASA Astrophysics Data System (ADS)

    Insolia, A.; Tuvè, C.; Albergo, S.; Bieser, F.; Brady, F. P.; Caccia, Z.; Cebra, D.; Chacon, A. D.; Chance, J. L.; Choi, Y.; Costa, S.; Elliott, J. B.; Gilkes, M.; Hauger, J. A.; Hirsch, A. S.; Hjort, E. L.; Justice, M.; Keane, D.; Kintner, J.; Lisa, M.; Matis, H. S.; McMahan, M.; McParland, C.; Olson, D. L.; Partlan, M. D.; Porile, N. T.; Potenza, R.; Rai, G.; Rasmussen, J.; Ritter, H. G.; Romero, J. L.; Russo, G. V.; Scharenberg, R.; Scott, A.; Shao, Y.; Srivastava, B. K.; Symons, T. J. M.; Tincknell, M. L.; Wang, S.; Warren, P. G.; Wieman, H. H.; Wolf, K. L.

    2001-11-01

    The inclusive light fragment (Z⩽7) yield data in Au+Au reactions, measured by the EOS Collaboration at the LBNL Bevalac, are presented and discussed. For peripheral collisions the measured charge distributions develop progressively according to a power law which can be fitted by a single τ exponent independently of the bombarding energy in the range 250-1200 A MeV. In addition to this universal feature, we observe that the location of the maximum in the individual yields of different charged fragments shift towards lower multiplicity as the fragment charge increases from Z=3 to Z=7. This trend is common to all six measured beam energies. Moments of charge distributions and correlations among different moments are reported. Finally, the THe,DT thermometer has been constructed for central and peripheral collisions using the double yield ratios of He and D, T projectile fragments. The measured nuclear temperatures are in agreement with experimental findings in other fragmentation reactions.

  6. Brazil wheat yield covariance model

    NASA Technical Reports Server (NTRS)

    Callis, S. L.; Sakamoto, C.

    1984-01-01

    A model based on multiple regression was developed to estimate wheat yields for the wheat growing states of Rio Grande do Sul, Parana, and Santa Catarina in Brazil. The meteorological data of these three states were pooled and the years 1972 to 1979 were used to develop the model since there was no technological trend in the yields during these years. Predictor variables were derived from monthly total precipitation, average monthly mean temperature, and average monthly maximum temperature.

  7. Description of quasifission reactions in the dinuclear system model

    NASA Astrophysics Data System (ADS)

    Adamian, G. G.; Antonenko, N. V.; Kalandarov, Sh. A.

    2016-01-01

    The formation and evolution of dinuclear systems in quasifission reactions are investigated. The process of formation of reaction products is analyzed based on the concept of a dinuclear system. Isotopic trends of cross sections of production of superheavy nuclei in quasifission reactions are discussed. The yields of new neutron-rich isotopes of nuclei with Z = 64-80 in quasifission reactions are predicted. The mechanism of production of complex fragments in complete fusion and quasifission reactions is analyzed.

  8. Acid soil infertility effects on peanut yields and yield components

    SciTech Connect

    Blamey, F.P.C.

    1983-01-01

    The interpretation of soil amelioration experiments with peanuts is made difficult by the unpredictibility of the crop and by the many factors altered when ameliorating acid soils. The present study was conducted to investigate the effects of lime and gypsum applications on peanut kernel yield via the three first order yield components, pods per ha, kernels per pod, and kernel mass. On an acid medium sandy loam soil (typic Plinthustult), liming resulted in a highly significant kernel yield increase of 117% whereas gypsum applications were of no significant benefit. As indicated by path coefficient analysis, an increase in the number of pods per ha was markedly more important in increasing yield than an increase in either the number of kernels per pod or kernel mass. Furthermore, exch. Al was found to be particularly detrimental to pod number. It was postulated that poor peanut yields resulting from acid soil infertility were mainly due to the depressive effect of exch. Al on pod number. Exch. Ca appeared to play a secondary role by ameliorating the adverse effects of exch. Al.

  9. The Use of Data-Containing Codes for Prediction of Yields of Radioactive Isotopes

    NASA Astrophysics Data System (ADS)

    Chechenin, N. G.; Chuvilskaya, T. V.; Kadmenskii, A. G.; Shirokova, A. A.

    2015-11-01

    The capability of modern nuclear reaction codes to predict the yields of exotic nuclei in various reactions is discussed. Advanced data-containing codes EMPIRE and TALYS are considered. The yields of radioactive isotopes in high-energy p + 27Al and p + 183W collisions are calculated to illustrate the properties of the codes, their common elements and particular features. The calculations confirm a potentiality of the codes for estimation of yields of various isotopes in reactions induced by high-energy protons.

  10. Corn yield prediction using climatology

    SciTech Connect

    Duchon, C.E.

    1986-05-01

    A method is developed to predict corn yield during the growing season using a plant process model (CERES-Maize), current weather data and climatological data. The procedure is to place the current year's daily weather (temperature and precipitation) into the model up to the time the yield prediction is to be made and sequences of historical data (one sequence per year) after that time until the end of the growing season to produce yield estimates. The mean of the distribution of yield estimates is taken as the prediction. The variance associated with a prediction is relatively constant until the time of tassel initiation and then decreases toward zero as the season progresses. As a consequence, perfect weather forecasts reach their peak value between the beginning of ear growth and the beginning of grain fill. The change in the predicted yield in response to weather as the growing season progresses is discussed for 1983 and 1976 at Peoria, Illinois. Results are given of an attempt to incorporate 30-day Climate Analytic Center outlooks into the predictive scheme. 21 references, 14 figures, 1 table.

  11. Defining and managing sustainable yield.

    PubMed

    Maimone, Mark

    2004-01-01

    Ground water resource management programs are paying increasing attention to the integration of ground water and surface water in the planning process. Many plans, however, show a sophistication in approach and presentation that masks a fundamental weakness in the overall analysis. The plans usually discuss issues of demand and yield, yet never directly address a fundamental issue behind the plan--how to define sustainable yield of an aquifer system. This paper points out a number of considerations that must be addressed in defining sustainable yield in order to make the definition more useful in practical water resource planning studies. These include consideration for the spatial and temporal aspects of the problem, the development of a conceptual water balance, the influence of boundaries and changes in technology on the definition, the need to examine water demand as well as available supply, the need for stakeholder involvement, and the issue of uncertainty in our understanding of the components of the hydrologic system. PMID:15584295

  12. Continuous Flow of Nitroso Diels-Alder Reaction

    PubMed Central

    2015-01-01

    Our flow reaction systems have provided quantitative yields of nitroso Diels-Alder products with no byproducts in cases of cyclic dienes without temperature and pressure controls. Additionally, the reaction times were significantly shortened by using homogeneous catalyst (CuCl) or heterogeneous reagent (MnO2) in comparison with batch reaction. PMID:26138229

  13. A new route to improved glucose yields in cellulose hydrolysis

    SciTech Connect

    Zhao, Haibo; Holladay, John E.; Kwak, Ja Hun; Zhang, Z. Conrad

    2007-08-01

    An unusual inverse temperature-dependent pathway was discovered for cellulose decrystallization in trifluoroacetic acid (TFA). Cellulose was completely decrystallized by TFA at 0 °C in less than 2 hours, a result not achieved in 48 hours at 25°C in the same medium. The majority of TFA used in cellulose decrystallization was recycled via a vacuum process. The small remaining amount of TFA was diluted with water to make a 0.5% TFA solution and used as a catalyst in dilute acid hydrolysis. After one minute, under batch conditions at 185 °C, the glucose yield reached 63.5% without production of levulinic acid. In comparison, only 15.0% glucose yield was achieved in the hydrolysis of untreated cellulose by 0.5% H2SO4 under the same condition. Further improvement of glucose yield is possible by optimizing reaction conditions. Alternatively, the remaining TFA can be completely removed by water while keeping the regenerated cellulose in a highly amorphous state. This regenerated cellulose is much more reactive than untreated cellulose in hydrolysis reactions, but still less reactive than corn starch. The lower temperatures and shorter reaction times with this activated cellulose makes it possible to reduce operating costs and decrease byproduct yields such as HMF and levulinic acid.

  14. Effects of processing conditions on biocrude yields from fast hydrothermal liquefaction of microalgae.

    PubMed

    Faeth, Julia L; Savage, Phillip E

    2016-04-01

    This study investigated the effects of algae species, reaction time, and reactor loading on the biocrude yield from fast hydrothermal liquefaction (HTL) of microalgae. Fast HTL reaction times were always less than 2 min and employed rapid heating and nonisothermal conditions. The highest biocrude yield obtained was 67±5 wt.% (dry basis). With all other process variables fixed, increasing the reaction time in a 600 °C sand bath by 15 s increments led to a rapid increase in biocrude yield between 15 and 45 s. At longer times, the biocrude yield decreased. Low reactor loadings generally gave higher biocrude yields than did higher loadings. The low reactor loadings may facilitate biocrude production by facilitating cell rupture and/or increasing the effective concentration of algal cells in the hot, compressed water in the reactor. PMID:26879204

  15. Evaluation of a cotton stripper yield monitor

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The objective of this work was to evaluate the accuracy of a microwave sensor based yield monitor for measuring yield on a cotton stripper harvester and determine if the yield monitor can discriminate differences in yield to the same level as a reference scale system. A new yield monitor was instal...

  16. Cryoradiolytic reduction of heme proteins: Maximizing dose dependent yield

    PubMed Central

    Denisov, Ilia G.; Victoria, Doreen C.; Sligar, Stephen. G.

    2007-01-01

    Radiolytic reduction in frozen solutions and crystals is a useful method for generation of trapped intermediates in protein based radical reactions. In this communication we define the conditions which provide the maximum yield of one electron reduced myoglobin at 77 K using 60Co γ-irradiation in aqueous glycerol glass. The yield reached 50% after 20 kGy, was almost complete at ∼160 kGy total dose, and does not depend on the protein concentration in the range 0.01 – 5 mM. PMID:18379640

  17. Nuclear reactions induced by a pyroelectric accelerator.

    PubMed

    Geuther, Jeffrey; Danon, Yaron; Saglime, Frank

    2006-02-10

    This work demonstrates the use of pyroelectric crystals to induce nuclear reactions. A system based on a pair of pyroelectric crystals is used to ionize gas and accelerate the ions to energies of up to 200 keV. The system operates above room temperature by simply heating or cooling the pyroelectric crystals. A D-D fusion reaction was achieved with this technique, and 2.5 MeV neutrons were detected. The measured neutron yield is in good agreement with the calculated yield. This work also verifies the results published by Naranjo, Gimzewski, and Putterman [Nature (London) 434, 1115 (2005)]. PMID:16486940

  18. Computed potential energy surfaces for chemical reactions

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.; Levin, Eugene

    1993-01-01

    A new global potential energy surface (PES) is being generated for O(P-3) + H2 yields OH + H. This surface is being fit using the rotated Morse oscillator method, which was used to fit the previous POL-CI surface. The new surface is expected to be more accurate and also includes a much more complete sampling of bent geometries. A new study has been undertaken of the reaction N + O2 yields NO + O. The new studies have focused on the region of the surface near a possible minimum corresponding to the peroxy form of NOO. A large portion of the PES for this second reaction has been mapped out. Since state to state cross sections for the reaction are important in the chemistry of high temperature air, these studies will probably be extended to permit generation of a new global potential for reaction.

  19. Formation of oligopeptides in high yield under simple programmable conditions

    PubMed Central

    Rodriguez-Garcia, Marc; Surman, Andrew J.; Cooper, Geoffrey J.T.; Suárez-Marina, Irene; Hosni, Zied; Lee, Michael P.; Cronin, Leroy

    2015-01-01

    Many high-yielding reactions for forming peptide bonds have been developed but these are complex, requiring activated amino-acid precursors and heterogeneous supports. Herein we demonstrate the programmable one-pot dehydration–hydration condensation of amino acids forming oligopeptide chains in around 50% yield. A digital recursive reactor system was developed to investigate this process, performing these reactions with control over parameters such as temperature, number of cycles, cycle duration, initial monomer concentration and initial pH. Glycine oligopeptides up to 20 amino acids long were formed with very high monomer-to-oligomer conversion, and the majority of these products comprised three amino acid residues or more. Having established the formation of glycine homo-oligopeptides, we then demonstrated the co-condensation of glycine with eight other amino acids (Ala, Asp, Glu, His, Lys, Pro, Thr and Val), incorporating a range of side-chain functionality. PMID:26442968

  20. Nickel-Catalyzed Coupling Reactions of Alkenes

    PubMed Central

    Ng, Sze-Sze; Ho, Chun-Yu; Schleicher, Kristin D.; Jamison, Timothy F.

    2011-01-01

    Several reactions of simple, unactivated alkenes with electrophiles under nickel(0) catalysis are discussed. The coupling of olefins with aldehydes and silyl triflates provides allylic or homoallylic alcohol derivatives, depending on the supporting ligands and, to a lesser extent, the substrates employed. Reaction of alkenes with isocyanates yields N-alkyl acrylamides. In these methods, alkenes act as the functional equivalents of alkenyl- and allylmetal reagents. PMID:21814295

  1. What is a "DNA-Compatible" Reaction?

    PubMed

    Malone, Marie L; Paegel, Brian M

    2016-04-11

    DNA-encoded synthesis can generate vastly diverse screening libraries of arbitrarily complex molecules as long as chemical reaction conditions do not compromise DNA's informational integrity, a fundamental constraint that "DNA-compatible" reaction development does not presently address. We devised DNA-encoded reaction rehearsal, an integrated analysis of reaction yield and impact on DNA, to acquire these key missing data. Magnetic DNA-functionalized sensor beads quantitatively report the % DNA template molecules remaining viable for PCR amplification after exposure to test reaction conditions. Analysis of solid-phase bond forming (e.g., Suzuki-Miyaura cross-coupling, reductive amination) and deprotection reactions (e.g., allyl esters, silyl ethers) guided the definition and optimization of DNA-compatible reaction conditions (>90% yield, >30% viable DNA molecules), most notably in cases that involved known (H(+), Pd) and more obscure (Δ, DMF) hazards to DNA integrity. The data provide an empirical yet mechanistically consistent and predictive framework for designing successful DNA-encoded reaction sequences for combinatorial library synthesis. PMID:26971959

  2. Variational transition-state theory with optimized orientation of the dividing surface and semiclassical tunneling calculations for deuterium and muonium kinetic isotope effects in the free radical association reaction H + C{sub 2}H{sub 4} {yields} C{sub 2}H{sub 5}

    SciTech Connect

    Villa, J. ||; Corchado, J.C. |; Gonzalez-Lafont, A.; Lluch, J.M.; Truhlar, D.G.

    1999-07-01

    The authors have used canonical variational transition-state theory with multidimensional tunneling contributions (CVT/MT) to calculate 21 kinetic isotope effects (KIE) for the addition of hydrogen atom to ethylene. The potential energies are obtained by variable scaling of external correlation (VSEC). The reorientation of the dividing surface (RODS) algorithm is employed so that the same reaction path can be used for every isotopic substitution. The results show the importance of the tunneling effect for explaining the trends in the KIEs in this almost barrierless reaction. The authors have predicted the regioselectivity for three different isotopically substituted substrates and have shown how the addition to the most substituted carbon is kinetically favored, especially at low temperature. However, their calculations show no cis/trans selectivity for the isotopically substituted ethylene substrate.

  3. Rotational dependence of the proton-transfer reaction HBr{sup +}+ CO{sub 2}{yields} HOCO{sup +}+ Br. II. Comparison of HBr{sup +} ({sup 2}{Pi}{sub 3/2}) and HBr{sup +} ({sup 2}{Pi}{sub 1/2})

    SciTech Connect

    Paetow, Lisa; Unger, Franziska; Beutel, Bernd; Weitzel, Karl-Michael

    2010-12-21

    The effects of reactant ion rotational excitation on the exothermic proton-transfer reactions of HBr{sup +}({sup 2}{Pi}{sub 1/2}) and DBr{sup +}({sup 2}{Pi}{sub 1/2}), respectively, with CO{sub 2} were studied in a guided ion beam apparatus. Cross sections are presented for collision energies in the center of mass system E{sub c.m.} in the range of 0.23 to 1.90 eV. The HBr{sup +}/DBr{sup +} ions were prepared in a state-selective manner by resonance enhanced multiphoton ionization. The mean rotational energy was varied from 3.4 to 46.8 meV for HBr{sup +}({sup 2}{Pi}{sub 1/2}) and from 1.8 to 40.9 meV for DBr{sup +}({sup 2}{Pi}{sub 1/2}). Both reactions studied are inhibited by collision energy, as expected for exothermic reactions. For all collision energies considered, the cross section decreases with increasing rotational energy of the ion, but the degree of the rotational dependence differs depending on the collision energy. For E{sub c.m.}= 0.31 eV, the cross sections of the deuteron transfer are significantly larger than those of the proton transfer. For higher E{sub c.m.} they differ very little. The current results for the exothermic proton transfer are systematically compared to previously published data for the endothermic proton transfer starting from HBr{sup +}({sup 2}{Pi}{sub 3/2}) [L. Paetow et al., J. Chem. Phys. 132, 174305 (2010)]. Additional new data regarding the latter reaction are presented to further confirm the conclusions. The dependences on rotational excitation found cannot be explained by the corresponding change in the total energy of the system. For both the endothermic and the exothermic reaction, the cross section is maximized for the smallest rotational energy, at least well above the threshold.

  4. Relative yields of radicals produced in deuterated methanol by irradiation

    NASA Astrophysics Data System (ADS)

    Nakagawa, Seiko

    2016-05-01

    The relative yields of radicals produced in four kinds of methanols; i.e., CH3OH, CH3OD, CD3OH and CD3OD, by γ-irradiation have been studied using ESR spin trapping with PBN. Both PBN-H and PBN-D were produced from CH3OD and CD3OH. This means that the proton transfer to the neutral methanol from the cationic one is one of the processes to produce both the methoxy and hydoxy-methyl radicals. The yield of the methoxy radical adduct relative to the hydroxy-methyl radical adduct decreased in the order CD3OH>CD3OD>CH3OH>CH3OD. The difference in the rates of the proton transfer and hydrogen abstraction reactions by substitution with deuterium is the reason for the variation in the relative radical yield.

  5. Science Yield Modeling with EXOSIMS

    NASA Astrophysics Data System (ADS)

    Garrett, Daniel; Savransky, Dmitry

    2016-01-01

    Accurately modeling science yield of an exoplanet direct imaging mission to build confidence in the achievement of science goals can be almost as complicated as designing the mission itself. It is challenging to compare science simulation results and systematically test the effects of changing instrument or mission designs. EXOSIMS (Exoplanet Open-Source Imaging Mission Simulator) addresses this by generating ensembles of mission simulations for exoplanet direct imaging missions to estimate distributions of science yield. EXOSIMS consists of stand-alone modules written in Python which may be individually modified without requiring modifications to the code elsewhere. This structure allows for user driven systemic exploration of the effects of changing designs on the estimated science yield.The modules of EXOSIMS are classified as either input or simulation modules. Input modules contain specific mission design parameters and functions. These include Planet Population, Star Catalog, Optical System, Zodiacal Light, Planet Physical Model, Observatory, Time Keeping, and Post-Processing. Simulation modules perform tasks requiring input from one or more input modules as well as calling functions from other simulation modules. These include Completeness, Target List, Simulated Universe, Survey Simulation, and Survey Ensemble. The required parameters and functionality of each of these modules is defined in the documentation for EXOSIMS.EXOSIMS is available to the public at https://github.com/dsavransky/EXOSIMS. Included in the documentation is an interface control document which defines the required inputs and outputs to each input and simulation module. Future development of EXOSIMS is intended to be community-driven. Mission planners and instrument designers may quickly write their own modules, following the guidelines in the interface control document, and drop them directly into the code without making additional modifications elsewhere. It is expected that EXOSIMS

  6. Application of the organic on water reactions to prebiotic chemistry

    NASA Astrophysics Data System (ADS)

    Kolb, Vera M.

    2012-10-01

    The old view that prebiotic reactions in water are hampered by the low solubility of the organic compounds in water is now being revised due to the discoveries of the reactions "on water". These reactions occur in the heterogeneous system comprising of the organic compounds and water. Unexpectedly, such reactions are extremely efficient; they often give quantitative yields, and are accelerated in the presence of water as compared to the organic solvents. These "on water" reactions are not the same as the "in water" reactions, which occur in solution, and are thus homogenous. Examples of the "on water" reactions include Diels-Alder, Claisen, Passerini and Ugi reactions, among many others. Some of these reactions are multicomponent, but give a single product. We survey a selected number of the "on water" reactions, which have a potential prebiotic applications.

  7. Kinugasa reactions in water: from green chemistry to bioorthogonal labelling.

    PubMed

    Chigrinova, Mariya; MacKenzie, Douglas A; Sherratt, Allison R; Cheung, Lawrence L W; Pezacki, John Paul; Pezacki, Paul

    2015-01-01

    The Kinugasa reaction has become an efficient method for the direct synthesis of β-lactams from substituted nitrones and copper(I) acetylides. In recent years, the reaction scope has been expanded to include the use of water as the solvent, and with micelle-promoted [3+2] cycloadditions followed by rearrangement furnishing high yields of β-lactams. The high yields of stable products under aqueous conditions render the modified Kinugasa reaction amenable to metabolic labelling and bioorthogonal applications. Herein, the development of methods for use of the Kinugasa reaction in aqueous media is reviewed, with emphasis on its potential use as a bioorthogonal coupling strategy. PMID:25913933

  8. Measurement of the Helicity Difference in {gamma}{sup {yields}p{yields}{yields}p{pi}+{pi}-} with the CLAS Spectrometer at Jefferson Laboratory

    SciTech Connect

    Park, Sungkyun

    2010-08-05

    The study of the properties of baryon resonances can provide us with hints to help us understand the structure of non-perturbative QCD and the effect of a particular resonance on polarization observables. The investigation of double-pion photoproduction data is needed to discover higher-lying states and their properties at and above W {approx_equal} 1.8 GeV. Therefore, the analysis of the helicity difference in gp {gamma}p{yields}p{pi}{sup +{pi}-} will help us in our understanding of QCD.The CLAS g9a (FROST) experiment, as part of the N* spectroscopy program at Jefferson Laboratory, has accumulated photoproduction data using linearly and circularly polarized photons incident on a longitudinally-polarized butanol target in the photon energy range 0.3 to 2.4 GeV. The FROST experiment provides an important step toward a ''complete'' experiment for the reaction {gamma}N{yields}KY.In this contribution, the method to calculate the helicity difference for the reaction {gamma}p{yields}p{pi}{sup +{pi}-} will be described and preliminary results will be discussed.

  9. Achieving yield gains in wheat.

    PubMed

    Reynolds, Matthew; Foulkes, John; Furbank, Robert; Griffiths, Simon; King, Julie; Murchie, Erik; Parry, Martin; Slafer, Gustavo

    2012-10-01

    Wheat provides 20% of calories and protein consumed by humans. Recent genetic gains are <1% per annum (p.a.), insufficient to meet future demand. The Wheat Yield Consortium brings expertise in photosynthesis, crop adaptation and genetics to a common breeding platform. Theory suggest radiation use efficiency (RUE) of wheat could be increased ~50%; strategies include modifying specificity, catalytic rate and regulation of Rubisco, up-regulating Calvin cycle enzymes, introducing chloroplast CO(2) concentrating mechanisms, optimizing light and N distribution of canopies while minimizing photoinhibition, and increasing spike photosynthesis. Maximum yield expression will also require dynamic optimization of source: sink so that dry matter partitioning to reproductive structures is not at the cost of the roots, stems and leaves needed to maintain physiological and structural integrity. Crop development should favour spike fertility to maximize harvest index so phenology must be tailored to different photoperiods, and sensitivity to unpredictable weather must be modulated to reduce conservative responses that reduce harvest index. Strategic crossing of complementary physiological traits will be augmented with wide crossing, while genome-wide selection and high throughput phenotyping and genotyping will increase efficiency of progeny screening. To ensure investment in breeding achieves agronomic impact, sustainable crop management must also be promoted through crop improvement networks. PMID:22860982

  10. Isobaric yield ratio difference and Shannon information entropy

    NASA Astrophysics Data System (ADS)

    Ma, Chun-Wang; Wei, Hui-Ling; Wang, Shan-Shan; Ma, Yu-Gang; Wada, Ryoichi; Zhang, Yan-Li

    2015-03-01

    The Shannon information entropy theory is used to explain the recently proposed isobaric yield ratio difference (IBD) probe which aims to determine the nuclear symmetry energy. Theoretically, the difference between the Shannon uncertainties carried by isobars in two different reactions (ΔIn21), is found to be equivalent to the difference between the chemical potentials of protons and neutrons of the reactions [the IBD probe, IB- Δ(βμ)21, with β the reverse temperature]. From the viewpoints of Shannon information entropy, the physical meaning of the above chemical potential difference is interpreted by ΔIn21 as denoting the nuclear symmetry energy or density difference between neutrons and protons in reactions more concisely than from the statistical ablation-abrasion model.

  11. Albite [yields] jadeite + quartz transformation in rock: Mechanism and kinetics

    SciTech Connect

    Bohlen, S.R.; Kirby, S.H. ); Hacker, B.R.

    1992-01-01

    Recent work on the calcite [yields] aragonite transformation using fully dense marble revealed significant differences from earlier experiments on powders and single-crystals. The reaction rate is retarded by a factor of > 1,000 and reaction mechanisms and resultant textures are considerably more complex. Stimulated by this, the authors conducted a study of the albite [yields] jadeite + quartz/coesite transformation in a fully dense albitite. Again the results are in marked contrast with previous powder-based studies of this archetypal metamorphic reaction. Solid cores of albitite were held at temperatures of 500-1,200 C and at pressure oversteps of 500 MPa into the jadeite + quartz stability field for 1--8 days in piston-cylinder apparatus. Samples that were dried in vacuum transformed appreciably only at temperatures in excess of 1,000 C. At all grain boundaries there is subequal transformation to micron-scale intergrowths of jadeite + quartz. Samples that were vacuum-impregnated with 1 wt% water contain jadeite + quartz to temperatures as low as 600 C. In contrast to the dried samples, transformation is much less homogeneous. The jadeite + quartz intergrowths do not form rows of subparallel crystals on grain boundaries, but rather are flower-shaped clusters that radiate outward from single nucleation sites at 3-grain edges and 4-grain corners. Compared to powders, pressure oversteps a factor of 10 greater are necessary to induce equivalent reaction in albitite. The sluggishness of this reaction has important implications for the evolution of the lower continental crust and subducting oceanic crust in terms of their (1) seismic velocity profiles, (2) petrological evolution, and (3) buoyancy forces, stresses and vertical crustal movements connected with densification and dilatational reactions.

  12. Effects of electron acceptors and radical scavengers on nonchain radical nucleophilic substitution reactions

    SciTech Connect

    Xianman Zhang; Dilun Yang; Youcheng Liu )

    1993-01-01

    The yields of reaction products from thermal nucleophilic substitution reactions in dimethyl sulfoxide (DMSO) of six o- and p-nitrohalobenzenes with the sodium salt of ethyl [alpha]-cyanoacetate carbanion [Na[sup +][sup [minus

  13. Stereoselective intermolecular C-H amination reactions.

    PubMed

    Lebel, Hélène; Trudel, Carl; Spitz, Cédric

    2012-08-14

    A novel chiral N-mesyloxycarbamate to perform rhodium-catalyzed stereoselective C-H amination reactions is reported. Chiral benzylic and propargylic amines are produced in good yields and selectivities using ethyl acetate as solvent. The corresponding free amines are easily obtained by cleavage of the chiral reagent, which could also be recovered. PMID:22751570

  14. Novel electrochemical deoxygenation reaction using diphenylphosphinates.

    PubMed

    Lam, Kevin; Markó, István E

    2011-02-01

    The electrochemical reduction of diphenylphosphinate esters leads smoothly and in high yields to the corresponding deoxygenated products. In comparison with the previously developed methodologies, the electrolysis could be performed at lower temperature and with a higher current density, resulting in a shorter reaction time. PMID:21174395

  15. High Yielding Microbubble Production Method

    PubMed Central

    Fiabane, Joe; Prentice, Paul; Pancholi, Ketan

    2016-01-01

    Microfluidic approaches to microbubble production are generally disadvantaged by low yield and high susceptibility to (micro)channel blockages. This paper presents an alternative method of producing microbubbles of 2.6 μm mean diameter at concentrations in excess of 30 × 106 mL−1. In this method, the nitrogen gas flowing inside the liquid jet is disintegrated into spray of microbubble when air surrounding this coflowing nitrogen gas-liquid jet passes through a 100 μm orifice at high velocity. Resulting microbubble foam has the polydispersity index of 16%. Moreover, a ratio of mean microbubble diameter to channel width ratio was found to be less than 0.025, which substantially alleviates the occurrence of blockages during production. PMID:27034935

  16. Copper-Catalyzed Divergent Addition Reactions of Enoldiazoacetamides with Nitrones.

    PubMed

    Cheng, Qing-Qing; Yedoyan, Julietta; Arman, Hadi; Doyle, Michael P

    2016-01-13

    Catalyst-controlled divergent addition reactions of enoldiazoacetamides with nitrones have been developed. By using copper(I) tetrafluoroborate/bisoxazoline complex as the catalyst, a [3+3]-cycloaddition reaction was achieved with excellent yield and enantioselectivity under exceptionally mild conditions, which represents the first highly enantioselective base-metal-catalyzed vinylcarbene transformation. When the catalyst was changed to copper(I) triflate, Mannich addition products were formed in high yields with near exclusivity under otherwise identical conditions. PMID:26699516

  17. Growth of Organic Microspherules in Sugar-Ammonia Reactions

    NASA Astrophysics Data System (ADS)

    Weber, Arthur L.

    2005-12-01

    Reaction of small sugars of less than four carbons with ammonia in water yielded organic microspherules generally less than ten microns in size. The time course of microspherule growth was examined for the D-erythrose-ammonia reaction that yielded microspherules attached to the glass walls of containers. Measurements were made of the elemental composition and infrared spectrum of the microspherule material. These viscose semi-solid microspherules are viewed as possible containers for prebiotic catalytic processes relevant to the origin of life.

  18. Chemical pathways in ultracold reactions of SrF molecules

    SciTech Connect

    Meyer, Edmund R.; Bohn, John L.

    2011-03-15

    We present a theoretical investigation of the chemical reaction SrF + SrF {yields} products, focusing on reactions at ultralow temperatures. We find that bond swapping SrF + SrF {yields} Sr{sub 2} + F{sub 2} is energetically forbidden at these temperatures. Rather, the only energetically allowed reaction is SrF + SrF {yields} SrF{sub 2} + Sr, and even then only singlet states of the SrF{sub 2} trimer can form. A calculation along a reduced reaction path demonstrates that this abstraction reaction is barrierless and proceeds by one SrF molecule ''handing off'' a fluorine atom to the other molecule.

  19. Rate of reaction between molecular hydrogen and molecular oxygen

    NASA Technical Reports Server (NTRS)

    Brokaw, R. S.

    1973-01-01

    The shock tube data of Jachimowski and Houghton were rigorously analyzed to obtain rate constants for the candidate initiation reactions H2 + O2 yields H + HO2, H2 + O2 yields H2O + O, and H2 + O2 yields OH + OH. Reaction (01) is probably not the initiation process because the activation energy obtained is less than the endothermicity and because the derived rates greatly exceed values inferred in the literature from the reverse of reaction (01). Reactions (02) and (03) remain as possibilities, with reaction (02) slightly favored on the basis of steric and statistical considerations. The solution of the differential equations is presented in detail to show how the kinetics of other ignition systems may be solved.

  20. The Glyoxal Clock Reaction

    ERIC Educational Resources Information Center

    Ealy, Julie B.; Negron, Alexandra Rodriguez; Stephens, Jessica; Stauffer, Rebecca; Furrow, Stanley D.

    2007-01-01

    Research on the glyoxal clock reaction has led to adaptation of the clock reaction to a general chemistry experiment. This particular reaction is just one of many that used formaldehyde in the past. The kinetics of the glyoxal clock makes the reaction suitable as a general chemistry lab using a Calculator Based Laboratory (CBL) or a LabPro. The…

  1. Critical reaction rates in hypersonic combustion chemistry

    SciTech Connect

    Oldenborg, R.C.; Harradine, D.M.; Loge, G.W.; Lyman, J.L.; Schott, G.L.; Winn, K.R.

    1989-01-01

    High Mach number flight requires that the scramjet propulsion system operate at a relatively low static inlet pressure and a high inlet temperature. These two constraints can lead to extremely high temperatures in the combustor, yielding high densities of radical species and correspondingly poor chemical combustion efficiency. As the temperature drops in the nozzle expansion, recombination of these excess radicals can produce more product species, higher heat yield, and potentially more thrust. The extent to which the chemical efficiency can be enhanced in the nozzle expansion depends directly on the rate of the radical recombination reactions. A comprehensive assessment of the important chemical processes and an experimental validation of the critical rate parameters is therefore required if accurate predictions of scramjet performance are to be obtained. This report covers the identification of critical reactions, and the critical reaction rates in hypersonic combustion chemistry. 4 refs., 2 figs.

  2. Nuclear Astrophysics and Neutron Induced Reactions: Quasi-Free Reactions and RIBs

    SciTech Connect

    Cherubini, S.; Spitaleri, C.; Crucilla, V.; Gulino, M.; La Cognata, M.; Lamia, L.; Pizzone, R. G.; Puglia, S.; Rapisarda, G. G.; Romano, S.; Sergi, M. L.; Coc, A.; Kubono, S.; Binh, D. N.; Hayakawa, S.; Wakabayashi, Y.; Yamaguchi, H.; Burjan, V.; Kroha, V.; De Sereville, N.

    2010-08-12

    The use of quasi-free reactions in studying nuclear reactions between charged particles of astrophysical interest has received much attention over the last two decades. The Trojan Horse Method is based on this approach and it has been used to study a number of reactions relevant for Nuclear Astrophysics. Recently we applied this method to the study of nuclear reactions that involve radioactive species, namely to the study of the {sup 18}F+p{yields}{sup 15}O+{alpha} process at temperatures corresponding to the energies available in the classical novae scenario. Quasi-free reactions can also be exploited to study processes induced by neutrons. This technique is particularly interesting when applied to reaction induced by neutrons on unstable short-lived nuclei. Such processes are very important in the nucleosynthesis of elements in the sand r-processes scenarios and this technique can give hints for solving key questions in nuclear astrophysics where direct measurements are practically impossible.

  3. Practice Gaps: Drug Reactions.

    PubMed

    Wolverton, Stephen E

    2016-07-01

    The term "drug reactions" is relevant to dermatology in three categories of reactions: cutaneous drug reactions without systemic features, cutaneous drug reactions with systemic features, and systemic drugs prescribed by the dermatologist with systematic adverse effects. This article uses examples from each of these categories to illustrate several important principles central to drug reaction diagnosis and management. The information presented will help clinicians attain the highest possible level of certainty before making clinical decisions. PMID:27363888

  4. Yield and yield gaps in central U.S. corn production systems

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The magnitude of yield gaps (YG) (potential yield – farmer yield) provides some indication of the prospects for increasing crop yield. Quantile regression analysis was applied to county maize (Zea mays L.) yields (1972 – 2011) from Kentucky, Iowa and Nebraska (irrigated) (total of 115 counties) to e...

  5. Learning to predict chemical reactions.

    PubMed

    Kayala, Matthew A; Azencott, Chloé-Agathe; Chen, Jonathan H; Baldi, Pierre

    2011-09-26

    Being able to predict the course of arbitrary chemical reactions is essential to the theory and applications of organic chemistry. Approaches to the reaction prediction problems can be organized around three poles corresponding to: (1) physical laws; (2) rule-based expert systems; and (3) inductive machine learning. Previous approaches at these poles, respectively, are not high throughput, are not generalizable or scalable, and lack sufficient data and structure to be implemented. We propose a new approach to reaction prediction utilizing elements from each pole. Using a physically inspired conceptualization, we describe single mechanistic reactions as interactions between coarse approximations of molecular orbitals (MOs) and use topological and physicochemical attributes as descriptors. Using an existing rule-based system (Reaction Explorer), we derive a restricted chemistry data set consisting of 1630 full multistep reactions with 2358 distinct starting materials and intermediates, associated with 2989 productive mechanistic steps and 6.14 million unproductive mechanistic steps. And from machine learning, we pose identifying productive mechanistic steps as a statistical ranking, information retrieval problem: given a set of reactants and a description of conditions, learn a ranking model over potential filled-to-unfilled MO interactions such that the top-ranked mechanistic steps yield the major products. The machine learning implementation follows a two-stage approach, in which we first train atom level reactivity filters to prune 94.00% of nonproductive reactions with a 0.01% error rate. Then, we train an ensemble of ranking models on pairs of interacting MOs to learn a relative productivity function over mechanistic steps in a given system. Without the use of explicit transformation patterns, the ensemble perfectly ranks the productive mechanism at the top 89.05% of the time, rising to 99.86% of the time when the top four are considered. Furthermore, the system

  6. Learning to Predict Chemical Reactions

    PubMed Central

    Kayala, Matthew A.; Azencott, Chloé-Agathe; Chen, Jonathan H.

    2011-01-01

    Being able to predict the course of arbitrary chemical reactions is essential to the theory and applications of organic chemistry. Approaches to the reaction prediction problems can be organized around three poles corresponding to: (1) physical laws; (2) rule-based expert systems; and (3) inductive machine learning. Previous approaches at these poles respectively are not high-throughput, are not generalizable or scalable, or lack sufficient data and structure to be implemented. We propose a new approach to reaction prediction utilizing elements from each pole. Using a physically inspired conceptualization, we describe single mechanistic reactions as interactions between coarse approximations of molecular orbitals (MOs) and use topological and physicochemical attributes as descriptors. Using an existing rule-based system (Reaction Explorer), we derive a restricted chemistry dataset consisting of 1630 full multi-step reactions with 2358 distinct starting materials and intermediates, associated with 2989 productive mechanistic steps and 6.14 million unproductive mechanistic steps. And from machine learning, we pose identifying productive mechanistic steps as a statistical ranking, information retrieval, problem: given a set of reactants and a description of conditions, learn a ranking model over potential filled-to-unfilled MO interactions such that the top ranked mechanistic steps yield the major products. The machine learning implementation follows a two-stage approach, in which we first train atom level reactivity filters to prune 94.00% of non-productive reactions with a 0.01% error rate. Then, we train an ensemble of ranking models on pairs of interacting MOs to learn a relative productivity function over mechanistic steps in a given system. Without the use of explicit transformation patterns, the ensemble perfectly ranks the productive mechanism at the top 89.05% of the time, rising to 99.86% of the time when the top four are considered. Furthermore, the system

  7. Yield model development project implementation plan

    NASA Technical Reports Server (NTRS)

    Ambroziak, R. A.

    1982-01-01

    Tasks remaining to be completed are summarized for the following major project elements: (1) evaluation of crop yield models; (2) crop yield model research and development; (3) data acquisition processing, and storage; (4) related yield research: defining spectral and/or remote sensing data requirements; developing input for driving and testing crop growth/yield models; real time testing of wheat plant process models) and (5) project management and support.

  8. Reduced yield detonation characteristics in large failure diameter materials

    SciTech Connect

    Lambert, R R; Lee, E L; Maienschein, J L; Merill, C I; Nichols, III; Reaugh, J E

    1998-08-10

    We have made detailed measurements of the approach to steady, self-supported propagating shock waves at greatly reduced yield in composite propellants. Propa- gation velocities are less than one half the theoretical value expected for full reac- tion at the sonic plane. Previous experimental studies 1 have given evidence of similar behavior. Also, previous theoretical work 2 in an analytic form has shown the possibility of reduced yield detonations. We have developed a reaction model coupled with a hydrody- namic code that together provide a description of the coupling of the complex reac- tion behavior with shock propagation and expansion in energetic materials. The model results show clearly that if the dependence of reaction rate on pressure is of sufficiently low order and the mode of consumption is by "grain burning" the calcu- lated detonation behavior closely parallels the observed non-ideal results. We describe the experiments, the reaction model, and compare experimental and calculational results. We also extend the model to predict results in the unexplored regime of very large size charges.

  9. Matsuda-Heck reaction with arenediazonium tosylates in water.

    PubMed

    Kutonova, Ksenia V; Trusova, Marina E; Stankevich, Andrey V; Postnikov, Pavel S; Filimonov, Victor D

    2015-01-01

    An environmentally friendly Matsuda-Heck reaction with arenediazonium tosylates has been developed for the first time. A range of alkenes was arylated in good to quantitative yields in water. The reaction is significantly accelerated when carried out under microwave heating. The arylation of haloalkylacrylates with diazonium salts has been implemented for the first time. PMID:25977709

  10. Mechanism of the reaction of isocyanic acid with ethanol

    SciTech Connect

    Sheludyakov, Y.L.; Shubareva, F.Z.; Golodov, V.A.; Korolev, A.V.

    1995-03-01

    The kinetics of the interaction of isocyanic acid with ethanol is investigated. The reaction products include ethyl carbamate and ethyl allophanate, the yields of which depend on both the concentration ratio of HNCO:ROH and the presence of a catalyst. The influence of water, acid, and base additives is also examined. A reaction mechanism is proposed.

  11. Possible future directions in crop yield forecasting

    NASA Technical Reports Server (NTRS)

    Colwell, J. E.

    1979-01-01

    This paper examines present and future possible applications of remote sensing to crop yield forecasting. It is concluded that there are ways in which Landsat data could be used to assist in crop yield forecasting using present technology. A framework for global crop yield forecasting which uses remote sensing, meteorological, field and ancillary data, as available, is proposed for the future.

  12. SOME QUESTIONS OF EVALUATION OF YIELD MAPS

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The ultimate goal for the application of yield maps is to provide profitable crop output in farming systems. Recently, several methods and tools have been developed for the evaluation of yield maps. It is based on crisp and fuzzy modeling. However, the process of evaluation of yield maps is full o...

  13. High temperature chemical kinetic study of the H2-CO-CO2-NO reaction system

    NASA Technical Reports Server (NTRS)

    Jachimowski, C. J.

    1975-01-01

    An experimental study of the kinetics of the H2-CO-CO2-NO reaction system was made behind incident shock waves at temperatures of 2460 and 2950 K. The overall rate of the reaction was measured by monitoring radiation from the CO + O yields CO2 + h upoilon reaction. Correlation of these data with a detailed reaction mechanism showed that the high-temperature rate of the reaction N + OH yields NO + H can be described by the low-temperature (320 K) rate coefficient. Catalytic dissociation of molecular hydrogen was an important reaction under the tests conditions.

  14. Versatile Protecting-Group Free Tetrazolomethane Amine Synthesis by Ugi Reaction.

    PubMed

    Patil, Pravin; de Haan, Michel; Kurpiewska, Katarzyna; Kalinowska-Tłuścik, Justyna; Dömling, Alexander

    2016-03-14

    The use of ammonia in the Ugi reaction is often problematic due to low yields and multiple side reactions. Here, we report the use of ammonia in the tetrazole Ugi variation providing a clean, good-to-high yielding reaction, especially with ketones as oxo components. The scope and limitations of this reaction and a structure-reactivity relationship are provided by performing >85 reactions. The primary amine component of the α-amino tetrazole is a versatile starting material for further reactions. PMID:26848739

  15. Reaction mechanism for chlorination of urea.

    PubMed

    Blatchley, Ernest R; Cheng, Mingming

    2010-11-15

    Experiments were conducted to elucidate the mechanism of the reaction between free chlorine and urea. In combination with findings of previous investigations, the results of these experiments indicate a process by which urea undergoes multiple N-chlorination steps. The first of these steps results in the formation of N-chlorourea; this step appears to require Cl₂ to proceed and is the overall rate-limiting step in the reaction for conditions that correspond to most swimming pools. N-Chlorourea then appears to undergo further chlorine substitution; the fully N-chlorinated urea molecule is hypothesized to undergo hydrolysis and additional chlorination to yield NCl₃ as an intermediate. NCl₃ is hydrolyzed to yield NH₂Cl and NHCl₂, with subsequent decay to stable end products, including N₂ and NO₃⁻. Conversion of urea-N to nitrate is pH-dependent. The pattern of nitrate yield is believed to be attributable to the fact that when urea serves as the source of reduced-N, entry into the reactions that describe chlorination of ammoniacal nitrogen is through NCl₃, whereas when NH₃ is the source of reduced-N, entry to these reactions is through NH₂Cl. PMID:20964367

  16. A characterization of the two-step reaction mechanism of phenol decomposition by a Fenton reaction

    NASA Astrophysics Data System (ADS)

    Valdés, Cristian; Alzate-Morales, Jans; Osorio, Edison; Villaseñor, Jorge; Navarro-Retamal, Carlos

    2015-11-01

    Phenol is one of the worst contaminants at date, and its degradation has been a crucial task over years. Here, the decomposition process of phenol, in a Fenton reaction, is described. Using scavengers, it was observed that decomposition of phenol was mainly influenced by production of hydroxyl radicals. Experimental and theoretical activation energies (Ea) for phenol oxidation intermediates were calculated. According to these Ea, phenol decomposition is a two-step reaction mechanism mediated predominantly by hydroxyl radicals, producing a decomposition yield order given as hydroquinone > catechol > resorcinol. Furthermore, traces of reaction derived acids were detected by HPLC and GS-MS.

  17. Linking Drought Information to Crop Yield

    NASA Astrophysics Data System (ADS)

    Madadgar, S.; Farahmand, A.; Li, L.; Aghakouchak, A.

    2015-12-01

    Droughts have detrimental impacts on agricultural yields all over the world every year. This study analyzes the relationship between three drought indicators including Standardized Precipitation Index (SPI); Standardized Soil Moisture Index (SSI), Multivariate Standardized Drought Index (MSDI) and the yields of five largest rain-fed crops in Australia (wheat, broad beans, canola, lupins and barley). Variation of the five chosen crop yields is overall in agreement with the three drought indicators SPI, SSI, and MSDI during the analysis period of 1980-2012. This study develops a bivariate copula model to investigate the statistical dependence of drought and crop yield. Copula functions are used to establish the existing connections between climate variables and crop yields during the Millennium drought in Australia. The proposed model estimates the likelihood of crop yields given the observed or predicted drought indicators SPI, SSI or MSDI. The results are also useful to estimate crop yields associated with different thresholds of precipitation or soil moisture.

  18. Typewriting rate as a function of reaction time.

    PubMed

    Hayes, V; Wilson, G D; Schafer, R L

    1977-12-01

    This study was designed to determine the relationship between reaction time and typewriting rate. Subjects were 24 typists ranging in age from 19 to 39 yr. Reaction times (.001 sec) to a light were recorded for each finger and to each alphabetic character and three punctuation marks. Analysis of variance yielded significant differences in reaction time among subjects and fingers. Correlation between typewriting rate and average reaction time to the alphabetic characters and three punctuation marks was --.75. Correlation between typewriting rate and the difference between the reaction time of the hands was --.42. Factors influencing typewriting rate may include reaction time of the fingers, difference between the reaction time of the hands, and reaction time to individual keys on the typewriter. Implications exist for instructional methodology and further research. PMID:604897

  19. A high yield neutron target for cancer therapy

    NASA Technical Reports Server (NTRS)

    Alger, D. L.; Steinberg, R.

    1972-01-01

    A rotating target was developed that has the potential for providing an initial yield of 10 to the 13th power neutrons per second by the T(d,n)He-4 reaction, and a useable lifetime in excess of 600 hours. This yield and lifetime are indicated for a 300 Kv and 30 mA deuteron accelerator and a 30 microns thick titanium tritide film formed of the stoichiometric compound TiT2. The potential for extended lifetime is made possible by incorporating a sputtering electrode that permits use of titanium tritide thicknesses much greater than the deuteron range. The electrode is used to remove in situ depleted titanium layers to expose fresh tritide beneath. The utilization of the rotating target as a source of fast neutrons for cancer therapy is discussed.

  20. A Covariance Generation Methodology for Fission Product Yields

    NASA Astrophysics Data System (ADS)

    Terranova, N.; Serot, O.; Archier, P.; Vallet, V.; De Saint Jean, C.; Sumini, M.

    2016-03-01

    Recent safety and economical concerns for modern nuclear reactor applications have fed an outstanding interest in basic nuclear data evaluation improvement and completion. It has been immediately clear that the accuracy of our predictive simulation models was strongly affected by our knowledge on input data. Therefore strong efforts have been made to improve nuclear data and to generate complete and reliable uncertainty information able to yield proper uncertainty propagation on integral reactor parameters. Since in modern nuclear data banks (such as JEFF-3.1.1 and ENDF/BVII.1) no correlations for fission yields are given, in the present work we propose a covariance generation methodology for fission product yields. The main goal is to reproduce the existing European library and to add covariance information to allow proper uncertainty propagation in depletion and decay heat calculations. To do so, we adopted the Generalized Least Square Method (GLSM) implemented in CONRAD (COde for Nuclear Reaction Analysis and Data assimilation), developed at CEA-Cadarache. Theoretical values employed in the Bayesian parameter adjustment are delivered thanks to a convolution of different models, representing several quantities in fission yield calculations: the Brosa fission modes for pre-neutron mass distribution, a simplified Gaussian model for prompt neutron emission probability, theWahl systematics for charge distribution and the Madland-England model for the isomeric ratio. Some results will be presented for the thermal fission of U-235, Pu-239 and Pu-241.

  1. Primary reactions of sensory rhodopsins

    PubMed Central

    Lutz, I.; Sieg, A.; Wegener, A. A.; Engelhard, M.; Boche, I.; Otsuka, M.; Oesterhelt, D.; Wachtveitl, J.; Zinth, W.

    2001-01-01

    The first steps in the photocycles of the archaeal photoreceptor proteins sensory rhodopsin (SR) I and II from Halobacterium salinarum and SRII from Natronobacterium pharaonis have been studied by ultrafast pump/probe spectroscopy and steady-state fluorescence spectroscopy. The data for both species of the blue-light receptor SRII suggests that their primary reactions are nearly analogous with a fast decay of the excited electronic state in 300–400 fs and a transition between two red-shifted product states in 4–5 ps. Thus SRII behaves similarly to bacteriorhodopsin. In contrast for SRI at pH 6.0, which absorbs in the orange part of the spectrum, a strongly increased fluorescence quantum yield and a drastically slower and biexponential decay of the excited electronic state occurring on the picosecond time scale (5 ps and 33 ps) is observed. The results suggest that the primary reactions are controlled by the charge distribution in the vicinity of the Schiff base and demonstrate that there is no direct connection between absorption properties and reaction dynamics for the retinal protein family. PMID:11158578

  2. Reaction Selectivity in Heterogeneous Catalysis

    SciTech Connect

    Somorjai, Gabor A.; Kliewer, Christopher J.

    2009-02-02

    The understanding of selectivity in heterogeneous catalysis is of paramount importance to our society today. In this review we outline the current state of the art in research on selectivity in heterogeneous catalysis. Current in-situ surface science techniques have revealed several important features of catalytic selectivity. Sum frequency generation vibrational spectroscopy has shown us the importance of understanding the reaction intermediates and mechanism of a heterogeneous reaction, and can readily yield information as to the effect of temperature, pressure, catalyst geometry, surface promoters, and catalyst composition on the reaction mechanism. DFT calculations are quickly approaching the ability to assist in the interpretation of observed surface spectra, thereby making surface spectroscopy an even more powerful tool. HP-STM has revealed three vitally important parameters in heterogeneous selectivity: adsorbate mobility, catalyst mobility, and selective site-blocking. The development of size controlled nanoparticles from 0.8 to 10 nm, of controlled shape, and of controlled bimetallic composition has revealed several important variables for catalytic selectivity. Lastly, DFT calculations may be paving the way to guiding the composition choice for multi-metallic heterogeneous catalysis for the intelligent design of catalysts incorporating the many factors of selectivity we have learned.

  3. Microfluidic chemical reaction circuits

    DOEpatents

    Lee, Chung-cheng; Sui, Guodong; Elizarov, Arkadij; Kolb, Hartmuth C.; Huang, Jiang; Heath, James R.; Phelps, Michael E.; Quake, Stephen R.; Tseng, Hsian-rong; Wyatt, Paul; Daridon, Antoine

    2012-06-26

    New microfluidic devices, useful for carrying out chemical reactions, are provided. The devices are adapted for on-chip solvent exchange, chemical processes requiring multiple chemical reactions, and rapid concentration of reagents.

  4. Continuous detonation reaction engine

    NASA Technical Reports Server (NTRS)

    Lange, O. H.; Stein, R. J.; Tubbs, H. E.

    1968-01-01

    Reaction engine operates on the principles of a controlled condensed detonation rather than on the principles of gas expansion. The detonation results in reaction products that are expelled at a much higher velocity.

  5. Allergic reactions (image)

    MedlinePlus

    Allergic reaction is a sensitivity to a specific substance, called an allergen, that is contacted through the skin, inhaled into the lungs, swallowed or injected. The body's reaction to an allergen can be mild, such as ...

  6. Allergic reactions (image)

    MedlinePlus

    Allergic reaction can be provoked by skin contact with poison plants, chemicals and animal scratches, as well as by ... dust, nuts and shellfish, may also cause allergic reaction. Medications such as penicillin and other antibiotics are ...

  7. Microscale Thermite Reactions.

    ERIC Educational Resources Information Center

    Arnaiz, Francisco J.; Aguado, Rafael; Arnaiz, Susana

    1998-01-01

    Describes the adaptation of thermite (aluminum with metal oxides) reactions from whole-class demonstrations to student-run micro-reactions. Lists detailed directions and possible variations of the experiment. (WRM)

  8. Reaction coordinates for electron transfer reactions

    SciTech Connect

    Rasaiah, Jayendran C.; Zhu Jianjun

    2008-12-07

    The polarization fluctuation and energy gap formulations of the reaction coordinate for outer sphere electron transfer are linearly related to the constant energy constraint Lagrangian multiplier m in Marcus' theory of electron transfer. The quadratic dependence of the free energies of the reactant and product intermediates on m and m+1, respectively, leads to similar dependence of the free energies on the reaction coordinates and to the same dependence of the activation energy on the reorganization energy and the standard reaction free energy. Within the approximations of a continuum model of the solvent and linear response of the longitudinal polarization to the electric field in Marcus' theory, both formulations of the reaction coordinate are expected to lead to the same results.

  9. Decoupling interfacial reactions between plasmas and liquids: charge transfer vs plasma neutral reactions.

    PubMed

    Rumbach, Paul; Witzke, Megan; Sankaran, R Mohan; Go, David B

    2013-11-01

    Plasmas (gas discharges) formed at the surface of liquids can promote a complex mixture of reactions in solution. Here, we decouple two classes of reactions, those initiated by electrons (electrolysis) and those initiated by gaseous neutral species, by examining an atmospheric-pressure microplasma formed in different ambients at the surface of aqueous saline (NaCl) solutions. Electrolytic reactions between plasma electrons and aqueous ions yield an excess of hydroxide ions (OH(-)), making the solution more basic, while reactions between reactive neutral species formed in the plasma phase and the solution lead to nitrous acid (HNO2), nitric acid (HNO3), and hydrogen peroxide (H2O2), making the solution more acidic. The relative importance of either reaction path is quantified by pH measurements, and we find that it depends directly on the composition of the ambient background gas. With a background gas of oxygen or argon, electron transfer reactions yielding excess OH(-) dominate, while HNO2 and HNO3 formed in the plasma and by the dissolution of nitrogen oxide (NOx) species dominate in the case of air and nitrogen. For pure nitrogen (N2) gas, we observe a unique coupling between both reactions, where oxygen (O2) gas formed via water electrolysis reacts in the bulk of the plasma to form NOx, HNO2, and HNO3. PMID:24144120

  10. Catalytic diastereoselective petasis reactions.

    PubMed

    Muncipinto, Giovanni; Moquist, Philip N; Schreiber, Stuart L; Schaus, Scott E

    2011-08-22

    Multicomponent Petasis reactions: the first diastereoselective Petasis reaction catalyzed by chiral biphenols that enables the synthesis of syn and anti β-amino alcohols in pure form has been developed. The reaction exploits a multicomponent approach that involves boronates, α-hydroxy aldehydes, and amines. PMID:21751322

  11. Reaction efficiency effects on binary chemical reactions

    NASA Astrophysics Data System (ADS)

    Lazaridis, Filippos; Savara, Aditya; Argyrakis, Panos

    2014-09-01

    We study the effect of the variation of reaction efficiency in binary reactions. We use the well-known A + B → 0 model, which has been extensively studied in the past. We perform simulations on this model where we vary the efficiency of reaction, i.e., when two particles meet they do not instantly react, as has been assumed in previous studies, but they react with a probability γ, where γ is in the range 0 < γ < 1. Our results show that at small γ values the system is reaction limited, but as γ increases it crosses over to a diffusion limited behavior. At early times, for small γ values, the particle density falls slower than for larger γ values. This fall-off goes over a crossover point, around the value of γ = 0.50 for high initial densities. Under a variety of conditions simulated, we find that the crossover point was dependent on the initial concentration but not on the lattice size. For intermediate and long times simulations, all γ values (in the depleted reciprocal density versus time plot) converge to the same behavior. These theoretical results are useful in models of epidemic reactions and epidemic spreading, where a contagion from one neighbor to the next is not always successful but proceeds with a certain probability, an analogous effect with the reaction probability examined in the current work.

  12. Neutrino-Nucleus Reactions and Nucleosynthesis

    SciTech Connect

    Suzuki, Toshio; Chiba, Satoshi; Yoshida, Takashi; Honma, Michio; Higashiyama, Koji; Umeda, Hideyuki; Nomoto, Ken'ichi; Kajino, Toshitaka; Otsuka, Takaharu

    2008-05-21

    Neutrino-induced reactions on {sup 12}C, {sup 4}He as well as Fe and Ni isotopes are studied based on new shell model Hamiltonians for p-shell and fp-shell. Gamow-Teller and spin-dipole transitions are investigated, and applied to neutrino-nucleus reactions induced by both DAR and supernova neutrinos. The reaction cross sections are found to be enhanced compared with conventional Hamiltonians as well as previous calculations. The production yields of {sup 7}Li and {sup 11}B during supernova explosions are found to be enhanced, and the effects of neutrino oscillations and implications of the enhancement on the constraint on temperature for {nu}{sub {mu}}{sub ,{tau}} and {nu}-bar{sub {mu}}{sub ,{tau}} are discussed. Production of other light elements such as {sup 10}Be and {sup 10}B by neutrino processes is also discussed. Neutral current reactions on Ni and Fe isotopes induced by supernova neutrinos are investigated. Effects of neutrino-induced reactions on the production yields of heavy elements such as Mn are discussed.

  13. Asymmetric petasis reactions catalyzed by chiral biphenols.

    PubMed

    Lou, Sha; Schaus, Scott E

    2008-06-01

    Chiral biphenols catalyze the enantioselective Petasis reaction of alkenyl boronates, secondary amines, and ethyl glyoxylate. The reaction requires the use of 15 mol % of (S)-VAPOL as the catalyst, alkenyl boronates as nucleophiles, ethyl glyoxylate as the aldehyde component, and 3 A molecular sieves as an additive. The chiral alpha-amino ester products are obtained in good yields (71-92%) and high enantiomeric ratios (89:11-98:2). Mechanistic investigations indicate single ligand exchange of acyclic boronate with VAPOL and tetracoordinate boronate intermediates. PMID:18459782

  14. Soot Reaction Properties (Ground-Based Study)

    NASA Technical Reports Server (NTRS)

    Dai, Z.; El-Leathy, A. M.; Lin, K.-C.; Sunderland, P. B.; Xu, F.; Faeth, G. M.; Urban, D. L. (Technical Monitor); Yuan, Z.-G. (Technical Monitor)

    2000-01-01

    Three major soot reaction processes are needed to predict soot properties in flame environments: soot growth, or the formation of soot on soot nuclei and soot particles; soot oxidation, or the reaction of soot with oxidizing species to yield the combustion products of soot oxidation; and soot nucleation, or the formation of soot nuclei from soot precursors having large molecular weights (generally thought to be large and particularly stable PAH molecules in flame environments, called stabilomers). These processes are addressed in the following, considering soot growth, oxidation and nucleation, in turn, by exploiting the soot and flame structure results for premixed and diffusion flames already discussed in Section 2.

  15. Reactions and structure of exotic nuclei

    SciTech Connect

    Esbensen, H.

    1993-08-01

    Radioactive beam experiments have made it possible to study the structure of light neutron rich nuclei. A characteristic feature is a large dipole strength near threshold. An excellent example is the loosely bound nucleus ``Li for which Coulomb dissociation plays a dominant role in breakup reactions on a high Z target. I will describe a three-body model and apply it to calculate the dipole response of {sup 11}Li and the momentum distributions for the three-body breakup reaction: {sup 11}Li {yields} {sup 9}Li+n+n, and comparisons will be made to recent three-body coincidence measurements.

  16. Shock profile studies on selected silicon carbide ceramics with application to dynamic yield mechanisms

    NASA Astrophysics Data System (ADS)

    Grady, Dennis E.

    2000-04-01

    Recent shock wave profile studies have been performed on several hot-pressed silicon carbide ceramics and a reaction bonded silicon carbide ceramic. Comparisons of the data with earlier wave profile measurements reveal striking differences in dynamic yield behavior through observations of the compression precursor wave structure. New data are presented and underlying microstructural mechanisms are considered to explain observed differences in the dynamic yield process.

  17. The yield of N/2D/ atoms in the dissociative recombination of NO/+/

    NASA Technical Reports Server (NTRS)

    Kley, D.; Lawrence, G. M.; Stone, E. J.

    1977-01-01

    The quantum yield or branching ratio of N(2D) atoms formed in the reaction e + NO(+) yields N + O was measured to be 76% plus or minus 6%. Photoionization of buffered nitric oxide by a flash lamp was studied using time-resolved atomic absorption. Atoms were produced both by direct photodissociation and by dissociative recombination, and these two effects were separated by means of SF6 as an electron scavenger.

  18. Quasifission and fusion-fission in reactions with massive nuclei: Comparison of reactions leading to the Z=120 element

    SciTech Connect

    Nasirov, A. K.; Giardina, G.; Mandaglio, G.; Manganaro, M.; Hanappe, F.; Heinz, S.; Hofmann, S.; Muminov, A. I.; Scheid, W.

    2009-02-15

    The yields of evaporation residues, fusion-fission, and quasifission fragments in the {sup 48}Ca+{sup 144,154}Sm and {sup 16}O+{sup 186}W reactions are analyzed in the framework of the combined theoretical method based on the dinuclear system concept and advanced statistical model. The measured yields of evaporation residues for the {sup 48}Ca+{sup 154}Sm reaction can be well reproduced. The measured yields of fission fragments are decomposed into contributions coming from fusion-fission, quasifission, and fast-fission. The decrease in the measured yield of quasifission fragments in {sup 48}Ca+{sup 154}Sm at the large collision energies and the lack of quasifission fragments in the {sup 48}Ca+{sup 144}Sm reaction are explained by the overlap in mass angle distributions of the quasifission and fusion-fission fragments. The investigation of the optimal conditions for the synthesis of the new element Z=120 (A=302) show that the {sup 54}Cr+{sup 248}Cm reaction is preferable in comparison with the {sup 58}Fe+{sup 244}Pu and {sup 64}Ni+{sup 238}U reactions because the excitation function of the evaporation residues of the former reaction is some orders of magnitude larger than that for the last two reactions.

  19. Measurement of fission products yields in the quasi-mono-energetic neutron-induced fission of 232Th

    NASA Astrophysics Data System (ADS)

    Naik, H.; Mukherji, Sadhana; Suryanarayana, S. V.; Jagadeesan, K. C.; Thakare, S. V.; Sharma, S. C.

    2016-08-01

    The cumulative yields of various fission products in the 232Th(n, f) reaction at average neutron energies of 5.42, 7.75, 9.35 and 12.53 MeV have been determined by using an off-line γ-ray spectrometric technique. The neutron beam was produced from the 7Li(p, n) reaction by using the proton energies of 7.8, 12, 16 and 20 MeV. The mass chain yields were obtained from the cumulative fission yields by using the charge distribution correction of medium energy fission. The fine structure in the mass yield distribution was interpreted from the point of nuclear structure effect. On the other hand, the higher yield around mass number 133-134 and 143-144 as well as their complementary products were explained based on the standard I and standard II asymmetric mode of fission. From the mass yield data, the average value of light mass (), heavy mass (), the average number of neutrons (< ν >) and the peak-to-valley (P / V) ratios at different neutron energies of present work and literature data were obtained in the 232Th(n, f) reaction. The different parameters of the mass yield distribution in the 232Th(n, f) reaction were compared with the similar data in the 232Th(γ, f) reaction at comparable excitation energy and a surprising difference was observed.

  20. Fragment yield corrections in tin-tin collisions

    NASA Astrophysics Data System (ADS)

    Tsang, Chun Yuen; HiRA Collaboration

    2014-09-01

    In nuclear collisions that occur at the NSCL and FRIB, many different species of nuclei are produced. Most of these nuclei are stripped of all the electrons but some still have electrons attached. They will be misidentified in a mass spectrometer and the yield of other fragments will be affected. In my research, we compare the yields of fragments produced in the collisions of different Sn isotopes which have same number of protons but different number of neutrons. Such measurements help us to study the differences in the interactions of neutrons and protons, which is important in our understanding of very neutron rich objects such as the neutron stars. The S800 mass spectrograph is used to identify different fragments produced in these Sn reactions at 70 MeV per nucleon. We show that the hydrogen-like fragments contaminate mainly the yields of isotopes with two extra neutrons. Then we use the algorithm GLOBAL to estimates of the contamination fractions of each fragments to obtain correct yields for fragments we want to measure. Contamination fractions depend on the velocity of the particles but most of them are small values. In this poster, I will present how we estimate the effects of contamination fractions on the fragment yield and the physics results we obtain. In nuclear collisions that occur at the NSCL and FRIB, many different species of nuclei are produced. Most of these nuclei are stripped of all the electrons but some still have electrons attached. They will be misidentified in a mass spectrometer and the yield of other fragments will be affected. In my research, we compare the yields of fragments produced in the collisions of different Sn isotopes which have same number of protons but different number of neutrons. Such measurements help us to study the differences in the interactions of neutrons and protons, which is important in our understanding of very neutron rich objects such as the neutron stars. The S800 mass spectrograph is used to identify

  1. Comparative yield estimation via shock hydrodynamic methods

    SciTech Connect

    Attia, A.V.; Moran, B.; Glenn, L.A.

    1991-06-01

    Shock TOA (CORRTEX) from recent underground nuclear explosions in saturated tuff were used to estimate yield via the simulated explosion-scaling method. The sensitivity of the derived yield to uncertainties in the measured shock Hugoniot, release adiabats, and gas porosity is the main focus of this paper. In this method for determining yield, we assume a point-source explosion in an infinite homogeneous material. The rock is formulated using laboratory experiments on core samples, taken prior to the explosion. Results show that increasing gas porosity from 0% to 2% causes a 15% increase in yield per ms/kt{sup 1/3}. 6 refs., 4 figs.

  2. Wheat yield forecasts using LANDSAT data

    NASA Technical Reports Server (NTRS)

    Colwell, J. E.; Rice, D. P.; Nalepka, R. F.

    1977-01-01

    Several considerations of winter wheat yield prediction using LANDSAT data were discussed. In addition, a simple technique which permits direct early season forecasts of wheat production was described.

  3. Crop status evaluations and yield predictions

    NASA Technical Reports Server (NTRS)

    Haun, J. R.

    1976-01-01

    One phase of the large area crop inventory project is presented. Wheat yield models based on the input of environmental variables potentially obtainable through the use of space remote sensing were developed and demonstrated. By the use of a unique method for visually qualifying daily plant development and subsequent multifactor computer analyses, it was possible to develop practical models for predicting crop development and yield. Development of wheat yield prediction models was based on the discovery that morphological changes in plants are detected and quantified on a daily basis, and that this change during a portion of the season was proportional to yield.

  4. Ab initio yield curve dynamics [rapid communication

    NASA Astrophysics Data System (ADS)

    Hawkins, Raymond J.; Roy Frieden, B.; D'Anna, Joseph L.

    2005-09-01

    We derive an equation of motion for interest-rate yield curves by applying a minimum Fisher information variational approach to the implied probability density. By construction, solutions to the equation of motion recover observed bond prices. More significantly, the form of the resulting equation explains the success of the Nelson Siegel approach to fitting static yield curves and the empirically observed modal structure of yield curves. A practical numerical implementation of this equation of motion is found by using the Karhunen Lòeve expansion and Galerkin's method to formulate a reduced-order model of yield curve dynamics.

  5. Germplasm for genetic improvement of lint yield in Upland cotton genetic analysis of lint yield with yield components

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Determination of genetic effects for lint yield and yield components in cotton (Gossypium hirsutum L.) germplasm is critical for its utilization in breeding programs. This study was designed to apply the conditional approach and an additive and dominant (AD) model to analyze genetic effects and gen...

  6. Mass production of multi-wall carbon nanotubes by metal dusting process with high yield

    SciTech Connect

    Ghorbani, H.; Rashidi, A.M.; Rastegari, S.; Mirdamadi, S.; Alaei, M.

    2011-05-15

    Research highlights: {yields} Synthesis of carbon nanotubes over Fe-Ni nanoparticles supported alloy 304L. {yields} Production of carbon nanotubes with high yield (700-1000%) and low cost catalyst. {yields} Optimum growth condition is CO/H{sub 2} = 1/1, 100 cm{sup 3}/min, at 620 {sup o}C under long term repetitive thermal cycling. {yields} Possibility of the mass production by metal dusting process with low cost. -- Abstract: Carbon nanotube materials were synthesized over Fe-Ni nanoparticles generated during disintegration of the surface of alloy 304L under metal dusting environment. The metal dusting condition was simulated and optimized through exposing stainless steel samples during long term repetitive thermal cycling in CO/H{sub 2} = 1/1, total gas flow rate 100 cm{sup 3}/min, at 620 {sup o}C for 300 h. After reaction, surface morphology of the samples and also carbonaceous deposition which had grown on sample surfaces were examined by stereoscopy, scanning electron microscopy (SEM) and transmission electron microscopy (TEM). Results revealed that multi-wall carbon nanotubes could be formed over nanocatalyst generated on the alloy surface by exploiting metal dusting process. By optimization of reaction parameters the yields of carbon nanotube materials obtained were 700-1000%. Also it has been shown herein that the amount of carbon nanotube materials remarkably increases when the reaction time is extended up to 300 h, indicating a possibility of the mass production by this easy method.

  7. (19)F(α,n) thick target yield from 3.5 to 10.0 MeV.

    PubMed

    Norman, E B; Chupp, T E; Lesko, K T; Grant, P J; Woodruff, G L

    2015-09-01

    Using a target of PbF2, the thick-target yield from the (19)F(α,n) reaction was measured from E(α)=3.5-10 MeV. From these results, we infer the thick-target neutron yields from targets of F2 and UF6 over this same alpha-particle energy range. PMID:26115205

  8. A regioselective double Stille coupling reaction of bicyclic stannolanes.

    PubMed

    Kamimura, Akio; Tanaka, Toshiyuki; So, Masahiro; Itaya, Tomoyuki; Matsuda, Kantaro; Kawamoto, Takuji

    2016-09-14

    A regioselective double Stille coupling reaction was explored using bicyclic stannolanes that were easily prepared from the radical cascade reaction of β-amino-α-methylene esters. Various 1-bromo-2-iodoarenes underwent the double coupling reaction to afford benzoisoindole derivatives in a regioselective manner, where the carbon attached to the iodine selectively coupled with the vinylic carbon, and then the carbon attached to bromine coupled with the alkyl carbon. The combination of intra- and intermolecular coupling reactions provided hexahydroindeno[1,2-b]pyrrole derivatives in good yields. The yields were further improved in the presence of excess amounts of CsF. An attempt to identify the reaction intermediate was made wherein the decomposition of the stannolanes with aqueous HCl and HBr afforded trigonal bipyramidal (TBP) pentacoordinated tin complexes, as confirmed by microanalyses and (119)Sn NMR. Using DCl for the decomposition selectively introduced a deuterium to the E-position of the exomethylene unit. The complexes smoothly underwent the intramolecular Stille coupling reaction in the presence of both a palladium catalyst and DABCO, affording hexahydroindeno[1,2-b]pyrroles in good yields. These results suggest that the double coupling reaction progresses through a TBP tin complex, promoting the second intramolecular coupling reaction between the aryl halide and Csp(3)-tin bond. PMID:27506959

  9. The OH + HBr reaction revisited

    NASA Technical Reports Server (NTRS)

    Ravishankara, A. R.; Wine, P. H.; Wells, J. R.

    1985-01-01

    Variable-temperature measurements of the rate coefficient /k(1)/ for the reaction OH + HBr yield Br + H2O are presented. The measurements are verified by two techniques: one involved a 266-nm pulsed-laser photolysis of O3/H2O/HBr/He mixtures in conjunction with time-resolved resonance fluorescence detection of OH, the second comprised pulsed laser-induced fluorescence detection of OH following 248-nm pulsed-laser photolysis of H2O2/HBr/Ar mixtures. It is reported that k(1) = (11.9 + or -1.4 x 10 to the -12th (cu cm)/(molecule)(s) independent of temperature. The measurements are compared with other available results.

  10. Automatic NMR-based identification of chemical reaction types in mixtures of co-occurring reactions.

    PubMed

    Latino, Diogo A R S; Aires-de-Sousa, João

    2014-01-01

    The combination of chemoinformatics approaches with NMR techniques and the increasing availability of data allow the resolution of problems far beyond the original application of NMR in structure elucidation/verification. The diversity of applications can range from process monitoring, metabolic profiling, authentication of products, to quality control. An application related to the automatic analysis of complex mixtures concerns mixtures of chemical reactions. We encoded mixtures of chemical reactions with the difference between the (1)H NMR spectra of the products and the reactants. All the signals arising from all the reactants of the co-occurring reactions were taken together (a simulated spectrum of the mixture of reactants) and the same was done for products. The difference spectrum is taken as the representation of the mixture of chemical reactions. A data set of 181 chemical reactions was used, each reaction manually assigned to one of 6 types. From this dataset, we simulated mixtures where two reactions of different types would occur simultaneously. Automatic learning methods were trained to classify the reactions occurring in a mixture from the (1)H NMR-based descriptor of the mixture. Unsupervised learning methods (self-organizing maps) produced a reasonable clustering of the mixtures by reaction type, and allowed the correct classification of 80% and 63% of the mixtures in two independent test sets of different similarity to the training set. With random forests (RF), the percentage of correct classifications was increased to 99% and 80% for the same test sets. The RF probability associated to the predictions yielded a robust indication of their reliability. This study demonstrates the possibility of applying machine learning methods to automatically identify types of co-occurring chemical reactions from NMR data. Using no explicit structural information about the reactions participants, reaction elucidation is performed without structure elucidation of

  11. Automatic NMR-Based Identification of Chemical Reaction Types in Mixtures of Co-Occurring Reactions

    PubMed Central

    Latino, Diogo A. R. S.; Aires-de-Sousa, João

    2014-01-01

    The combination of chemoinformatics approaches with NMR techniques and the increasing availability of data allow the resolution of problems far beyond the original application of NMR in structure elucidation/verification. The diversity of applications can range from process monitoring, metabolic profiling, authentication of products, to quality control. An application related to the automatic analysis of complex mixtures concerns mixtures of chemical reactions. We encoded mixtures of chemical reactions with the difference between the 1H NMR spectra of the products and the reactants. All the signals arising from all the reactants of the co-occurring reactions were taken together (a simulated spectrum of the mixture of reactants) and the same was done for products. The difference spectrum is taken as the representation of the mixture of chemical reactions. A data set of 181 chemical reactions was used, each reaction manually assigned to one of 6 types. From this dataset, we simulated mixtures where two reactions of different types would occur simultaneously. Automatic learning methods were trained to classify the reactions occurring in a mixture from the 1H NMR-based descriptor of the mixture. Unsupervised learning methods (self-organizing maps) produced a reasonable clustering of the mixtures by reaction type, and allowed the correct classification of 80% and 63% of the mixtures in two independent test sets of different similarity to the training set. With random forests (RF), the percentage of correct classifications was increased to 99% and 80% for the same test sets. The RF probability associated to the predictions yielded a robust indication of their reliability. This study demonstrates the possibility of applying machine learning methods to automatically identify types of co-occurring chemical reactions from NMR data. Using no explicit structural information about the reactions participants, reaction elucidation is performed without structure elucidation of the

  12. Reaction kinetics of hydrothermal carbonization of loblolly pine.

    PubMed

    Reza, M Toufiq; Yan, Wei; Uddin, M Helal; Lynam, Joan G; Hoekman, S Kent; Coronella, Charles J; Vásquez, Victor R

    2013-07-01

    Hydrothermal carbonization (HTC) is a pretreatment process to convert diverse feedstocks to homogeneous energy-dense solid fuels. Understanding of reaction kinetics is necessary for reactor design and optimization. In this study, the reaction kinetics and effects of particle size on HTC were investigated. Experiments were conducted in a novel two-chamber reactor maintaining isothermal conditions for 15s to 30 min reaction times. Loblolly pine was treated at 200, 230, and 260°C. During the first few minutes of reaction, the solid-product mass yield decreases rapidly while the calorific value increases rapidly. A simple reaction mechanism is proposed and validated, in which both hemicellulose and cellulose degrade in parallel first-order reactions. Activation energy of hemicellulose and cellulose degradation were determined to be 30 and 73 kJ/mol, respectively. For short HTC times, both reaction and diffusion effects were observed. PMID:23651600

  13. Copper activation deuterium-tritium neutron yield measurements at the National Ignition Facility.

    PubMed

    Cooper, G W; Ruiz, C L; Leeper, R J; Chandler, G A; Hahn, K D; Nelson, A J; Torres, J A; Smelser, R M; McWatters, B R; Bleuel, D L; Yeamans, C B; Knittel, K M; Casey, D T; Frenje, J A; Gatu Johnson, M; Petrasso, R D; Styron, J D

    2012-10-01

    A DT neutron yield diagnostic based on the reactions, (63)Cu(n,2n)(62)Cu(β(+)) and (65)Cu(n,2n)( 64) Cu(β(+)), has been fielded at the National Ignition Facility (NIF). The induced copper activity is measured using a NaI γ-γ coincidence system. Uncertainties in the 14-MeV DT yield measurements are on the order of 7% to 8%. In addition to measuring yield, the ratio of activities induced in two, well-separated copper samples are used to measure the relative anisotropy of the fuel ρR to uncertainties as low as 5%. PMID:23126920

  14. Anaphylactic reactions to cinoxacin.

    PubMed Central

    Stricker, B. H.; Slagboom, G.; Demaeseneer, R.; Slootmaekers, V.; Thijs, I.; Olsson, S.

    1988-01-01

    During 1981 to mid-1988 three cases of anaphylactic shock after treatment with the quinolone derivative cinoxacin were reviewed by the Netherlands Centre for Monitoring of Adverse Reactions to Drugs and 17 cases of an anaphylactic type of reaction notified to the World Health Organisation Collaborating Centre for International Drug Monitoring. In five out of six patients for whom data were available the reaction began shortly after taking a single capsule of a second or next course of treatment. Cinoxacin is related to nalidixic acid, and one patient previously treated with that agent subsequently had an anaphylactoid reaction to cinoxacin and later developed a skin reaction to nalidixic acid. There were no deaths, and patients treated as an emergency with plasma expanders or with adrenaline and corticosteroids generally recovered promptly and uneventfully. In view of the potentially fatal consequences of anaphylactic reactions to cinoxacin and other quinolones doctors should take care when prescribing these drugs. PMID:3147004

  15. Reactions to radiocontrast media.

    PubMed

    Hong, Sandra J; Wong, Johnson T; Bloch, Kurt J

    2002-01-01

    Adverse reactions to radiocontrast media (RCM) occur unexpectedly and may be life-threatening. This article describes an anaphylactoid reaction (AR) in one patient. The term AR refers to a syndrome clinically similar to anaphylaxis, but these reactions are independent of immunoglobulin E antibody-mediated mast cell or basophil degranulation. This article briefly reviews the literature regarding RCMs and types of reactions to RCM. The risk factors for AR to RCM infusions will be discussed along with current concepts of the pathogenesis of RCM-induced ARs. This article also describes the therapeutic management of patients who have had a previous adverse reaction to RCM and provides an approach to patients who have breakthrough reactions despite adequate premedication, but require additional radiographic studies. PMID:12476546

  16. Noncanonical Reactions of Flavoenzymes

    PubMed Central

    Sobrado, Pablo

    2012-01-01

    Enzymes containing flavin cofactors are predominantly involved in redox reactions in numerous cellular processes where the protein environment modulates the chemical reactivity of the flavin to either transfer one or two electrons. Some flavoenzymes catalyze reactions with no net redox change. In these reactions, the protein environment modulates the reactivity of the flavin to perform novel chemistries. Recent mechanistic and structural data supporting novel flavin functionalities in reactions catalyzed by chorismate synthase, type II isopentenyl diphosphate isomerase, UDP-galactopyranose mutase, and alkyl-dihydroxyacetonephosphate synthase are presented in this review. In these enzymes, the flavin plays either a direct role in acid/base reactions or as a nucleophile or electrophile. In addition, the flavin cofactor is proposed to function as a “molecular scaffold” in the formation of UDP-galactofuranose and alkyl-dihydroxyacetonephosphate by forming a covalent adduct with reaction intermediates. PMID:23203060

  17. Mechanisms in Knockout Reactions

    NASA Astrophysics Data System (ADS)

    Bazin, D.; Charity, R. J.; de Souza, R. T.; Famiano, M. A.; Gade, A.; Henzl, V.; Henzlova, D.; Hudan, S.; Lee, J.; Lukyanov, S.; Lynch, W. G.; McDaniel, S.; Mocko, M.; Obertelli, A.; Rogers, A. M.; Sobotka, L. G.; Terry, J. R.; Tostevin, J. A.; Tsang, M. B.; Wallace, M. S.

    2009-06-01

    We report the first detailed study of the relative importance of the stripping and diffraction mechanisms involved in nucleon knockout reactions, by the use of a coincidence measurement of the residue and fast proton following one-proton knockout reactions. The measurements used the S800 spectrograph in combination with the HiRA detector array at the NSCL. Results for the reactions Be9(C9,B8+X)Y and Be9(B8,Be7+X)Y are presented and compared with theoretical predictions for the two reaction mechanisms calculated using the eikonal model. The data show a clear distinction between the stripping and diffraction mechanisms and the measured relative proportions are very well reproduced by the reaction theory. This agreement adds support to the results of knockout reaction analyses and their applications to the spectroscopy of rare isotopes.

  18. Improving Photosynthetic Efficiency for Greater Yield

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Increasing the yield potential of the major food grain crops has contributed very significantly to a rising global supply of grain over the past 50 years, which has until recently more than kept pace with rising global demand. Yield potential is the product of the solar radiation available at a giv...

  19. THE ZONES PROJECTS: UNDERSTANDING SOYBEAN YIELD VARIABILITY

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Two regional projects funded by the North Central Soybean Research Program and the United Soybean Board are entitled Mapping of Soil and Field Characteristics to Understand Soybean Yield and Using Remotely Sensed Data to Diagnose Soybean Yield Limiting Factors. These projects were developed in resp...

  20. Effects of cultivation frequency on sugarcane yields

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Reducing the number of cultivations during one or more years of a four year crop cycle reduces production expenses and could increase profitability if yields are not adversely affected. This study was initiated to determine the effects of cultivation on yields of sugarcane grown on a clay soil both ...

  1. The Tradeoff Between Alfalfa Yield and Quality

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Extensive cutting management research has documented the effects of date and frequency of harvest on alfalfa (Medicago sativa L.) forage yield and quality. Information is lacking, however, on the change in quality relative to yield that occurs as alfalfa matures within individual harvest periods. ...

  2. Calibrating your forage harvester's yield monitor

    Technology Transfer Automated Retrieval System (TEKTRAN)

    With some attention to the details, you will have a harvester that should be able to produce yield maps that will allow the same precision management that is expected in cereal crops. Forage yield maps, coupled with site-specific technologies in application of soil amendments, fertilizers, and pesti...

  3. Winter wheat yield response to available water

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Dryland winter wheat yields in eastern Colorado can vary greatly from year to year and are primarily limited by available water supplies. Yields increase linearly with water use at an average rate of 4.7 bu/a per inch of water used after the first 5 inches of water use. An Excel-based spreadsheet ca...

  4. Sugarcane yield loss due to ratoon stunt

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The yield response of recently released CP-cultivars to ratoon stunt has not been determined. Cane and sugar yields of Liefsonia xyli subsp. xyli (Lxx)-infected and healthy sugarcane plants of cultivars that are currently major commercial cultivars that have not been in prior tests as well as former...

  5. High yielding Indica germplasm from China

    Technology Transfer Automated Retrieval System (TEKTRAN)

    In 1996, 213 rice accessions were introduced from China for enriching USDA rice germplasm collection. Evaluation for the Chinese germplasm on yield potential, disease resistances and grain quality was conducted in 2000 and 2001. Fifteen accessions yielded in excess of 10,130 kg/ha rough rice that ...

  6. 7 CFR 1437.102 - Yield determinations.

    Code of Federal Regulations, 2010 CFR

    2010-01-01

    ... Determining Yield Coverage Using Actual Production History § 1437.102 Yield determinations. (a) An actual... used in the actual production history base period when less than four consecutive crop years of actual... calculated, in the actual production history base period when the producer reports acreage for the crop...

  7. 7 CFR 1437.102 - Yield determinations.

    Code of Federal Regulations, 2011 CFR

    2011-01-01

    ... Determining Yield Coverage Using Actual Production History § 1437.102 Yield determinations. (a) An actual... used in the actual production history base period when less than four consecutive crop years of actual... calculated, in the actual production history base period when the producer reports acreage for the crop...

  8. Improved Yield Estimation by Trellis Tension Monitoring

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Most yield estimation practices for commercial vineyards rely on hand-sampling fruit on one or a small number of dates during the growing season. Limitations associated with the static yield estimates may be overcome with Trellis Tension Monitors (TTMs), systems that measure dynamically changes in t...

  9. Yield potential of pigeon pea cultivars

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Yield potential of twelve vegetable pigeon pea (Cajanus cajun) cultivars was evaluated at two locations in eastern Kenya during 2012 and 2013 cropping years. Pigeon pea pod numbers, seeds per pod, seed mass, grain yield and shelling percentage were quantified in three replicated plots, arranged in a...

  10. 7 CFR 1437.102 - Yield determinations.

    Code of Federal Regulations, 2012 CFR

    2012-01-01

    ... adjusted on an administrative county-wide basis for: (i) Yield variations due to different farming practices in the administrative county such as irrigated, non-irrigated, and organic practices; and (ii... missing crop years actual yield. (h) If producers add land in the farming operation and do not...

  11. 7 CFR 1437.102 - Yield determinations.

    Code of Federal Regulations, 2014 CFR

    2014-01-01

    ... adjusted on an administrative county-wide basis for: (i) Yield variations due to different farming practices in the administrative county such as irrigated, non-irrigated, and organic practices; and (ii... missing crop years actual yield. (h) If producers add land in the farming operation and do not...

  12. 7 CFR 1437.102 - Yield determinations.

    Code of Federal Regulations, 2013 CFR

    2013-01-01

    ... adjusted on an administrative county-wide basis for: (i) Yield variations due to different farming practices in the administrative county such as irrigated, non-irrigated, and organic practices; and (ii... missing crop years actual yield. (h) If producers add land in the farming operation and do not...

  13. Weed competition and dry bean yield components

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Weed competition can significantly reduce dry bean (Phaseolus vulgaris L.) yields and therefore the profitability for the producer. Depending on the dry bean variety produced, the yield components may be affected differently by the stress produced by weed competition. This research was conducted to ...

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

    SciTech Connect

    Macdonald, R.G.

    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.

  15. Aqueous Oxidative Heck Reaction as a Protein-Labeling Strategy

    PubMed Central

    Ourailidou, Maria Eleni; van der Meer, Jan-Ytzen; Baas, Bert-Jan; Jeronimus-Stratingh, Margot; Gottumukkala, Aditya L; Poelarends, Gerrit J; Minnaard, Adriaan J; Dekker, Frank J

    2014-01-01

    An increasing number of chemical reactions are being employed for bio-orthogonal ligation of detection labels to protein-bound functional groups. Several of these strategies, however, are limited in their application to pure proteins and are ineffective in complex biological samples such as cell lysates. Here we present the palladium-catalyzed oxidative Heck reaction as a new and robust bio-orthogonal strategy for linking functionalized arylboronic acids to protein-bound alkenes in high yields and with excellent chemoselectivity even in the presence of complex protein mixtures from living cells. Advantageously, this reaction proceeds under aerobic conditions, whereas most other metal-catalyzed reactions require inert atmosphere. PMID:24376051

  16. The Sugar Model: Autocatalytic Activity of the Triose Ammonia Reaction

    NASA Astrophysics Data System (ADS)

    Weber, Arthur L.

    2007-04-01

    Reaction of triose sugars with ammonia under anaerobic conditions yielded autocatalytic products. The autocatalytic behavior of the products was examined by measuring the effect of the crude triose ammonia reaction product on the kinetics of a second identical triose ammonia reaction. The reaction product showed autocatalytic activity by increasing both the rate of disappearance of triose and the rate of formation of pyruvaldehyde, the product of triose dehydration. This synthetic process is considered a reasonable model of origin-of-life chemistry because it uses plausible prebiotic substrates, and resembles modern biosynthesis by employing the energized carbon groups of sugars to drive the synthesis of autocatalytic molecules.

  17. Process of preparing nitrogen trifluoride by gas-solid reaction

    SciTech Connect

    Aramaki, M.; Kobayashi, Y.; Nakamura, T.; Nakano, H.; Suenaga, T.

    1985-09-24

    NF3 is prepared with good yields by reaction between fluorine gas and an ammonium complex of a metal fluoride, such as (NH4)3AIF6, in solid phase. The metal flouride ammonium complex may be one additionally containing an alkali metal, such as (NH4)2NaAIF6. The gas-solid reaction is carried out preferably at temperatures above 80 C. and at relatively low partial pressures of fluorine in the gas phase of the reaction system, so that the reaction is easy to control.

  18. Gas phase contributions to topochemical hydride reduction reactions

    NASA Astrophysics Data System (ADS)

    Kobayashi, Yoji; Li, Zhaofei; Hirai, Kei; Tassel, Cédric; Loyer, François; Ichikawa, Noriya; Abe, Naoyuki; Yamamoto, Takafumi; Shimakawa, Yuichi; Yoshimura, Kazuyoshi; Takano, Mikio; Hernandez, Olivier J.; Kageyama, Hiroshi

    2013-11-01

    Alkali and alkali earth hydrides have been used as solid state reductants recently to yield many interesting new oxygen-deficient transition metal oxides. These reactions have tacitly been assumed to be a solid phase reaction between the reductant and parent oxide. We have conducted a number of experiments with physical separation between the reductant and oxides, and find that in some cases reduction proceeds even when the reagents are physically separated, implying reactions with in-situ generated H2 and, to a lesser extent, getter mechanisms. Our findings change our understanding of these topochemical reactions, and should enhance the synthesis of additional new oxides and nanostructures.

  19. Sleeve reaction chamber system

    SciTech Connect

    Northrup, M. Allen; Beeman, Barton V.; Benett, William J.; Hadley, Dean R.; Landre, Phoebe; Lehew, Stacy L.; Krulevitch, Peter A.

    2009-08-25

    A chemical reaction chamber system that combines devices such as doped polysilicon for heating, bulk silicon for convective cooling, and thermoelectric (TE) coolers to augment the heating and cooling rates of the reaction chamber or chambers. In addition the system includes non-silicon-based reaction chambers such as any high thermal conductivity material used in combination with a thermoelectric cooling mechanism (i.e., Peltier device). The heat contained in the thermally conductive part of the system can be used/reused to heat the device, thereby conserving energy and expediting the heating/cooling rates. The system combines a micromachined silicon reaction chamber, for example, with an additional module/device for augmented heating/cooling using the Peltier effect. This additional module is particularly useful in extreme environments (very hot or extremely cold) where augmented heating/cooling would be useful to speed up the thermal cycling rates. The chemical reaction chamber system has various applications for synthesis or processing of organic, inorganic, or biochemical reactions, including the polymerase chain reaction (PCR) and/or other DNA reactions, such as the ligase chain reaction.

  20. Metal-mullite reactions

    SciTech Connect

    Loehman, R.E.; Tomsia, A.P.

    1993-11-01

    Mullite was reacted with pure Al and with Ti or Zr dissolved in Ag-Cu eutectic alloys at 1100 C in Ar. Analysis of the Ti and Zr-containing specimens showed reaction zones with compositions of Ti{sub 50}Cu{sub 3O}O{sub 20} and ZrO{sub 2}, respectively. The Al-mullite specimen showed much more extensive penetration into the ceramic and a more diffuse reaction zone than the other two systems. Al{sub 2}O{sub 3} and Si were the main reaction products for Al-mullite reaction.

  1. Toward Direct Reaction-in-Flight Measurements

    NASA Astrophysics Data System (ADS)

    Wilhelmy, Jerry; Bredeweg, Todd; Fowler, Malcolm; Gooden, Matthew; Hayes, Anna; Rusev, Gencho; Caggiano, Joseph; Hatarik, Robert; Henry, Eugene; Tonchev, Anton; Yeaman, Charles; Bhike, Megha; Krishichayan, Krishi; Tornow, Werner

    2016-03-01

    At the National Ignition Facility (NIF) neutrons having energies greater than the equilibrium 14.1 MeV value can be produced via Reaction-in-Flight (RIF) interactions between plasma atoms and upscattered D or T ions. The yield and spectrum of these RIF produced neutrons carry information on the plasma properties as well as information on the stopping power of ions under plasma conditions. At NIF the yield of these RIF neutrons is predicted to be 4-7 orders of magnitude below the peak 14 MeV neutron yield. The current generation of neutron time of flight (nTOF) instrumentation has so far been incapable of detecting these low-yield neutrons primarily due to high photon backgrounds. To date, information on RIF neutrons has been obtained in integral activation experiments using reactions with high energy thresholds such as 169Tm(n,3n)167Tm and 209Bi(n,4n) 206Bi. Initial experiments to selectively suppress photon backgrounds have been performed at TUNL using pulsed monoenergetic neutron beams of 14.9, 18.5, 24.2, and 28.5 MeV impinging on a Bibenzyl scintillator. By placing 5 cm of Pb before the scintillator we were able to selectively suppress the photons from the flash occurring at the production target and enhance the n/_signal by ~6 times.

  2. Competing reaction channels in IR-laser-induced unimolecular reactions

    SciTech Connect

    Berman, M.R.

    1981-01-01

    The competing reaction channels in the unimolecular decomposition of two molecules, formaldehyde and tetralin were studied. A TEA CO/sub 2/ laser was used as the excitation source in all experiments. The dissociation of D/sub 2/CO was studied by infrared multiphoton dissociation (MPD) and the small-molecule nature of formaldehyde with regard to MPD was explored. The effect of collisions in MPD were probed by the pressure dependence of the MPD yield and ir fluorescence from multiphoton excited D/sub 2/CO. MPD yield shows a near cubic dependence in pure D/sub 2/CO which is reduced to a 1.7 power dependence when 15 torr of NO is added. The peak amplitude of 5 ..mu..m ir fluorescence from D/sub 2/CO is proportional to the square of the D/sub 2/CO pressure in pure D/sub 2/CO or in the presence of 50 torr of Ar. Results are explained in terms of bottlenecks to excitation at the v = 1 level which are overcome by a combination of vibrational energy transfer and rotational relaxation. The radical/molecule branching ratio in D/sub 2/CO MPD was 0.10 +- 0.02 at a fluence of 125 J/cm/sup 2/ at 946.0 cm/sup -1/. The barrier height to molecular dissociation was calculated to be 3.6 +- 2.0 kcal/mole below the radical threshold or 85.0 +- 3.0 kcal/mole above the ground state of D/sub 2/CO. In H/sub 2/CO, this corresponds to 2.5 +- 2.0 kcal/mole below the radical threshold or 83.8 +- 3.0 kcal/mole above the ground state. Comparison with uv data indicate that RRKM theory is an acceptable description of formaldehyde dissociation in the 5 to 10 torr pressure range. The unimolecular decomposition of tetralin was studied by MPD and SiF/sub 4/ - sensitized pyrolysis. Both techniques induce decomposition without the interference of catalytic surfaces. Ethylene loss is identified as the lowest energy reaction channel. Dehydrogenation is found to result from step-wise H atom loss. Isomerization via disproportionation is also identified as a primary reaction channel.

  3. Utilization of the hydroxyalkylation reaction to prepare bis(benzocrown ethers)

    PubMed Central

    Zielinski, Matthew; Tracy, Adam F.; Klumpp, Douglas A.

    2012-01-01

    The hydroxyalkylation reaction has been used to condense benzocrown ethers with various aldehydes and ketones. The condensation reactions are catalyzed by triflic or sulfuric acid. The products from the reactions are bis(benzocrown ethers) and they are formed in good yields (42-98%, 13 examples). PMID:22753995

  4. Microwave-Assisted Organic Synthesis in the Organic Teaching Lab: A Simple, Greener Wittig Reaction

    ERIC Educational Resources Information Center

    Martin, Eric; Kellen-Yuen, Cynthia

    2007-01-01

    A greener, microwave-assisted Wittig reaction has been developed for the second-semester organic teaching laboratory. Utilizing this microwave technique, a variety of styrene derivatives have been successfully synthesized from aromatic aldehydes in good yields (41-68%). The reaction not only occurs under neat reaction conditions, but also employs…

  5. Event-Based Modeling of Driver Yielding Behavior at Unsignalized Crosswalks

    PubMed Central

    Schroeder, Bastian J.; Rouphail, Nagui M.

    2011-01-01

    This research explores factors associated with driver yielding behavior at unsignalized pedestrian crossings and develops predictive models for yielding using logistic regression. It considers the effect of variables describing driver attributes, pedestrian characteristics and concurrent conditions at the crosswalk on the yield response. Special consideration is given to ‘vehicle dynamics constraints’ that form a threshold for the potential to yield. Similarities are identified to driver reaction in response to the ‘amber’ indication at a signalized intersection. The logit models were developed from data collected at two unsignalized mid-block crosswalks in North Carolina. The data include ‘before’ and ‘after’ observations of two pedestrian safety treatments, an in-street pedestrian crossing sign and pedestrian-actuated in-roadway warning lights. The analysis suggests that drivers are more likely to yield to assertive pedestrians who walk briskly in their approach to the crosswalk. In turn, the yield probability is reduced with higher speeds, deceleration rates and if vehicles are traveling in platoons. The treatment effects proved to be significant and increased the propensity of drivers to yield, but their effectiveness may be dependent on whether the pedestrian activates the treatment. The results of this research provide new insights on the complex interaction of pedestrians and vehicles at unsignalized intersections and have implications for future work towards predictive models for driver yielding behavior. The developed logit models can provide the basis for representing driver yielding behavior in a microsimulation modeling environment. PMID:21852892

  6. /sup 64/Ni +/sup 92/Zr fission yields at energies close to the Coulomb barrier

    SciTech Connect

    Wolfs, F.L.H.; Janssens, R.V.F.; Holzmann, R.; Khoo, T.L.; Ma, W.C.; Sanders, S.J.

    1989-03-01

    Fission yields for the /sup 64/Ni+/sup 92/Zr reaction at laboratory energies between 240 and 300 MeV have been measured. ''Elastic scattering'' angular distributions were also obtained and used to deduce the generalized total reaction cross sections. The competition between fission and light-particle evaporation from the compound nucleus is well reproduced by statistical-model calculations. However, the calculated neutron multiplicities for this reaction are larger than those previously measured. Possible reasons for this discrepancy are discussed.

  7. Low Energy Nuclear Reactions: 2007 Update

    NASA Astrophysics Data System (ADS)

    Krivit, Steven B.

    2007-03-01

    This paper presents an overview of low energy nuclear reactions, a subset of the field of condensed matter nuclear science. Condensed matter nuclear science studies nuclear effects in and/or on condensed matter, including low energy nuclear reactions, an entirely new branch of science that gained widespread attention and notoriety beginning in 1989 with the announcement of a previously unrecognized source of energy by Martin Fleischmann and Stanley Pons that came to be known as cold fusion. Two branches of LENR are recognized. The first includes a set of reactions like those observed by Fleischmann and Pons that use palladium and deuterium and yield excess heat and helium-4. Numerous mechanisms have been proposed to explain these reactions, however there is no consensus for, or general acceptance of, any of the theories. The claim of fusion is still considered speculative and, as such, is not an ideal term for this work. The other branch is a wide assortment of nuclear reactions that may occur with either hydrogen or deuterium. Anomalous nuclear transmutations are reported that involve light as well as heavy elements. The significant questions that face this field of research are: 1) Are LENRs a genuine nuclear reaction? 2) If so, is there a release of excess energy? 3) If there is, is the energy release cost-effective?

  8. CW CO2 Laser Induced Chemical Reactions

    NASA Astrophysics Data System (ADS)

    Pola, Joseph

    1989-05-01

    CW CO2 laser driven reactions between sulfur hexafluoride and carbon oxide, carbon suboxide, carbonyl sulfide and carbon disulfide proceed at subatmospheric pressures and yield fluorinated carbon compounds and sulfur tetrafluoride. CW CO2 laser driven reactions of organic compounds in the presence of energy-conveying sulfur hexafluoride show reaction course different from that normally observed due to elimination of reactor hot surface effects. The examples concern the decomposition of polychlorohydrocarbons, 2-nitropropane, tert.-butylamine, allyl chloride, spirohexane, isobornyl acetate and the oxidation of haloolefins. CW CO2 laser induced fragmentation of 1-methyl-l-silacyclobutanes and 4-silaspiro(3.4)octane in the presence of sulfur hexafluoride is an effective way for preparation and deposition of stable organosilicon polymers.

  9. Dual phase multiplex polymerase chain reaction

    DOEpatents

    Pemov, Alexander; Bavykin, Sergei

    2008-10-07

    Highly specific and sensitive methods were developed for multiplex amplification of nucleic acids on supports such as microarrays. Based on a specific primer design, methods include five types of amplification that proceed in a reaction chamber simultaneously. These relate to four types of multiplex amplification of a target DNA on a solid support, directed by forward and reverse complex primers immobilized to the support and a fifth type--pseudo-monoplex polymerase chain reaction (PCR) of multiple targets in solution, directed by a single pair of unbound universal primers. The addition of the universal primers in the reaction mixture increases the yield over the traditional "bridge" amplification on a solid support by approximately ten times. Methods that provide multitarget amplification and detection of as little as 0.45-4.5.times.10.sup.-12 g (equivalent to 10.sup.2-10.sup.3 genomes) of a bacterial genomic DNA are disclosed.

  10. Theory of reactions at electrified interfaces.

    PubMed

    Lück, Jessica; Latz, Arnulf

    2016-07-21

    Interfacial reaction and transport processes are a decisive factor for the overall performance of electrochemical systems. However, existing models rely on phenomenological descriptions of charged interfaces, which yields no deeper insights. We present a generic theory to describe charge and electron transfer reactions at charged interfaces, which is applicable to different electrochemical systems, like fuel cells or batteries with liquid or solid electrolytes. In the present work, our general theory is adopted to the electrochemical double layer at the interface between a solid electrode and a liquid electrolyte. The model allows to describe the intercalation reaction in Li-ion insertion batteries as a two-step process, consisting of a first desolvation and adsorption and a second actual insertion step. It becomes apparent that a charging of the double layer acts as the necessary driving force for the charge transfer across the interface. PMID:27215943

  11. Reactions of a stable silylene with halocarbons.

    PubMed

    Delawar, Mahmood; Gehrhus, Barbara; Hitchcock, Peter B

    2005-09-01

    An unusual product formation is observed for the insertion reaction of the thermally stable silylene Si[(NCH(2)Bu(t))(2)C(6)H(4)-1,2][abbrev. as Si(NN)] into the carbon-halogen bond of alkyl or aryl halides RHal (Hal=Cl, Br). In general, depending on the halogen, the reaction either results in a disilane of type (NN)Si(Hal)-(R)Si(NN) for Hal=Cl or a mixture of disilane and the monosilane (NN)Si(R)(Hal) for Hal=Br. The results are put into context to previously suggested mechanisms. The disilane (NN)Si(Hal)-(R)Si(NN)(Hal=Cl or Br) is thermally labile and mild thermolysis yields the corresponding monosilane (NN)Si(R)(Hal) and silylene 1. Additionally, strong evidence is presented for a radical pathway for the reaction of 1 and RHal. PMID:16094485

  12. Climate change and maize yield in Iowa

    DOE PAGESBeta

    Xu, Hong; Twine, Tracy E.; Girvetz, Evan

    2016-05-24

    Climate is changing across the world, including the major maize-growing state of Iowa in the USA. To maintain crop yields, farmers will need a suite of adaptation strategies, and choice of strategy will depend on how the local to regional climate is expected to change. Here we predict how maize yield might change through the 21st century as compared with late 20th century yields across Iowa, USA, a region representing ideal climate and soils for maize production that contributes substantially to the global maize economy. To account for climate model uncertainty, we drive a dynamic ecosystem model with output frommore » six climate models and two future climate forcing scenarios. Despite a wide range in the predicted amount of warming and change to summer precipitation, all simulations predict a decrease in maize yields from late 20th century to middle and late 21st century ranging from 15% to 50%. Linear regression of all models predicts a 6% state-averaged yield decrease for every 1°C increase in warm season average air temperature. When the influence of moisture stress on crop growth is removed from the model, yield decreases either remain the same or are reduced, depending on predicted changes in warm season precipitation. Lastly, our results suggest that even if maize were to receive all the water it needed, under the strongest climate forcing scenario yields will decline by 10-20% by the end of the 21st century.« less

  13. Climate Change and Maize Yield in Iowa.

    PubMed

    Xu, Hong; Twine, Tracy E; Girvetz, Evan

    2016-01-01

    Climate is changing across the world, including the major maize-growing state of Iowa in the USA. To maintain crop yields, farmers will need a suite of adaptation strategies, and choice of strategy will depend on how the local to regional climate is expected to change. Here we predict how maize yield might change through the 21st century as compared with late 20th century yields across Iowa, USA, a region representing ideal climate and soils for maize production that contributes substantially to the global maize economy. To account for climate model uncertainty, we drive a dynamic ecosystem model with output from six climate models and two future climate forcing scenarios. Despite a wide range in the predicted amount of warming and change to summer precipitation, all simulations predict a decrease in maize yields from late 20th century to middle and late 21st century ranging from 15% to 50%. Linear regression of all models predicts a 6% state-averaged yield decrease for every 1°C increase in warm season average air temperature. When the influence of moisture stress on crop growth is removed from the model, yield decreases either remain the same or are reduced, depending on predicted changes in warm season precipitation. Our results suggest that even if maize were to receive all the water it needed, under the strongest climate forcing scenario yields will decline by 10-20% by the end of the 21st century. PMID:27219116

  14. Regression Models For Saffron Yields in Iran

    NASA Astrophysics Data System (ADS)

    S. H, Sanaeinejad; S. N, Hosseini

    Saffron is an important crop in social and economical aspects in Khorassan Province (Northeast of Iran). In this research wetried to evaluate trends of saffron yield in recent years and to study the relationship between saffron yield and the climate change. A regression analysis was used to predict saffron yield based on 20 years of yield data in Birjand, Ghaen and Ferdows cities.Climatologically data for the same periods was provided by database of Khorassan Climatology Center. Climatologically data includedtemperature, rainfall, relative humidity and sunshine hours for ModelI, and temperature and rainfall for Model II. The results showed the coefficients of determination for Birjand, Ferdows and Ghaen for Model I were 0.69, 0.50 and 0.81 respectively. Also coefficients of determination for the same cities for model II were 0.53, 0.50 and 0.72 respectively. Multiple regression analysisindicated that among weather variables, temperature was the key parameter for variation ofsaffron yield. It was concluded that increasing temperature at spring was the main cause of declined saffron yield during recent years across the province. Finally, yield trend was predicted for the last 5 years using time series analysis.

  15. Climate Change and Maize Yield in Iowa

    PubMed Central

    Xu, Hong; Twine, Tracy E.; Girvetz, Evan

    2016-01-01

    Climate is changing across the world, including the major maize-growing state of Iowa in the USA. To maintain crop yields, farmers will need a suite of adaptation strategies, and choice of strategy will depend on how the local to regional climate is expected to change. Here we predict how maize yield might change through the 21st century as compared with late 20th century yields across Iowa, USA, a region representing ideal climate and soils for maize production that contributes substantially to the global maize economy. To account for climate model uncertainty, we drive a dynamic ecosystem model with output from six climate models and two future climate forcing scenarios. Despite a wide range in the predicted amount of warming and change to summer precipitation, all simulations predict a decrease in maize yields from late 20th century to middle and late 21st century ranging from 15% to 50%. Linear regression of all models predicts a 6% state-averaged yield decrease for every 1°C increase in warm season average air temperature. When the influence of moisture stress on crop growth is removed from the model, yield decreases either remain the same or are reduced, depending on predicted changes in warm season precipitation. Our results suggest that even if maize were to receive all the water it needed, under the strongest climate forcing scenario yields will decline by 10–20% by the end of the 21st century. PMID:27219116

  16. Reaction rate and products for the reaction O/3P/ + H2CO

    NASA Technical Reports Server (NTRS)

    Chang, J. S.; Barker, J. R.

    1979-01-01

    A study of reaction kinetics of O + H2CO in a discharge-flow system using mass spectrometric detection of reactants and products is presented. It was performed under both oxygen-atom-rich and formaldehyde-rich conditions over the 296 to 437 K range, showing that the global bimolecular rate constant is in agreement with other studies. This study differs from others in that the reaction products can be observed, and a substantial yield of a primary reaction product was measured with a mass spectral peak at m/e=44. This suggests that the global reaction rate probably consists of combination, as well as of simple abstraction. For the combination, one hypothesis is that triplet dioxymethylene is formed which polymerizes to triplet formic acid; the vibrationally excited triplet formic acid may decompose to form several sets of products, including HCO + OH and HCO2 + H.

  17. Hydrogen evolution reaction catalyst

    DOEpatents

    Subbaraman, Ram; Stamenkovic, Vojislav; Markovic, Nenad; Tripkovic, Dusan

    2016-02-09

    Systems and methods for a hydrogen evolution reaction catalyst are provided. Electrode material includes a plurality of clusters. The electrode exhibits bifunctionality with respect to the hydrogen evolution reaction. The electrode with clusters exhibits improved performance with respect to the intrinsic material of the electrode absent the clusters.

  18. Chemical Reaction Problem Solving.

    ERIC Educational Resources Information Center

    Veal, William

    1999-01-01

    Discusses the role of chemical-equation problem solving in helping students predict reaction products. Methods for helping students learn this process must be taught to students and future teachers by using pedagogical skills within the content of chemistry. Emphasizes that solving chemical reactions should involve creative cognition where…

  19. Applications of Reaction Rate

    ERIC Educational Resources Information Center

    Cunningham, Kevin

    2007-01-01

    This article presents an assignment in which students are to research and report on a chemical reaction whose increased or decreased rate is of practical importance. Specifically, students are asked to represent the reaction they have chosen with an acceptable chemical equation, identify a factor that influences its rate and explain how and why it…

  20. REUSABLE REACTION VESSEL

    DOEpatents

    Soine, T.S.

    1963-02-26

    This patent shows a reusable reaction vessel for such high temperature reactions as the reduction of actinide metal chlorides by calcium metal. The vessel consists of an outer metal shell, an inner container of refractory material such as sintered magnesia, and between these, a bed of loose refractory material impregnated with thermally conductive inorganic salts. (AEC)

  1. Nuclear Reaction Data Centers

    SciTech Connect

    McLane, V.; Nordborg, C.; Lemmel, H.D.; Manokhin, V.N.

    1988-01-01

    The cooperating Nuclear Reaction Data Centers are involved in the compilation and exchange of nuclear reaction data for incident neutrons, charged particles and photons. Individual centers may also have services in other areas, e.g., evaluated data, nuclear structure and decay data, reactor physics, nuclear safety; some of this information may also be exchanged between interested centers. 20 refs., 1 tab.

  2. Degradations and Rearrangement Reactions

    NASA Astrophysics Data System (ADS)

    Zhang, Jianbo

    This section deals with recent reports concerning degradation and rearrangement reactions of free sugars as well as some glycosides. The transformations are classified in chemical and enzymatic ways. In addition, the Maillard reaction will be discussed as an example of degradation and rearrangement transformation and its application in current research in the fields of chemistry and biology.

  3. Oscillating Reactions: Two Analogies

    ERIC Educational Resources Information Center

    Petruševski, Vladimir M.; Stojanovska, Marina I.; Šoptrajanov, Bojan T.

    2007-01-01

    Oscillating chemical reactions are truly spectacular phenomena, and demonstrations are always appreciated by the class. However, explaining such reactions to high school or first-year university students is problematic, because it may seem that no acceptable explanation is possible unless the students have profound knowledge of both physical…

  4. Clock Reaction: Outreach Attraction

    ERIC Educational Resources Information Center

    Carpenter, Yuen-ying; Phillips, Heather A.; Jakubinek, Michael B.

    2010-01-01

    Chemistry students are often introduced to the concept of reaction rates through demonstrations or laboratory activities involving the well-known iodine clock reaction. For example, a laboratory experiment involving thiosulfate as an iodine scavenger is part of the first-year general chemistry laboratory curriculum at Dalhousie University. With…

  5. Chemical burn or reaction

    MedlinePlus

    ... this page: //medlineplus.gov/ency/article/000059.htm Chemical burn or reaction To use the sharing features on this page, please enable JavaScript. Chemicals that touch skin can lead to a reaction on the skin, throughout the body, or both. ...

  6. Optimizing rice yields while minimizing yield-scaled global warming potential.

    PubMed

    Pittelkow, Cameron M; Adviento-Borbe, Maria A; van Kessel, Chris; Hill, James E; Linquist, Bruce A

    2014-05-01

    To meet growing global food demand with limited land and reduced environmental impact, agricultural greenhouse gas (GHG) emissions are increasingly evaluated with respect to crop productivity, i.e., on a yield-scaled as opposed to area basis. Here, we compiled available field data on CH4 and N2 O emissions from rice production systems to test the hypothesis that in response to fertilizer nitrogen (N) addition, yield-scaled global warming potential (GWP) will be minimized at N rates that maximize yields. Within each study, yield N surplus was calculated to estimate deficit or excess N application rates with respect to the optimal N rate (defined as the N rate at which maximum yield was achieved). Relationships between yield N surplus and GHG emissions were assessed using linear and nonlinear mixed-effects models. Results indicate that yields increased in response to increasing N surplus when moving from deficit to optimal N rates. At N rates contributing to a yield N surplus, N2 O and yield-scaled N2 O emissions increased exponentially. In contrast, CH4 emissions were not impacted by N inputs. Accordingly, yield-scaled CH4 emissions decreased with N addition. Overall, yield-scaled GWP was minimized at optimal N rates, decreasing by 21% compared to treatments without N addition. These results are unique compared to aerobic cropping systems in which N2 O emissions are the primary contributor to GWP, meaning yield-scaled GWP may not necessarily decrease for aerobic crops when yields are optimized by N fertilizer addition. Balancing gains in agricultural productivity with climate change concerns, this work supports the concept that high rice yields can be achieved with minimal yield-scaled GWP through optimal N application rates. Moreover, additional improvements in N use efficiency may further reduce yield-scaled GWP, thereby strengthening the economic and environmental sustainability of rice systems. PMID:24115565

  7. Ion-molecule reactions with CF3 radical

    NASA Astrophysics Data System (ADS)

    Miller, Thomas M.; Shuman, Nicholas S.; Wiens, Justin P.; Sawyer, Jordan C.; Martinez, Oscar, Jr.; Ard, Shaun G.; Viggiano, Albert A.

    2015-09-01

    The first measurements of reaction rate coefficients and products are reported for reactions of the radical CF3 with Ar+, Xe+, O2+,NO+, CO2+,and C2F5+,at 300 K. The work was carried out in a fast flow of typically 1.5 Torr helium buffer gas (4% argon) using the variable electron and neutral density attachment mass spectrometry (VENDAMS) technique. CF3 was produced via dissociative electron attachment to CF3I, resulting in CF3 concentrations that were well-quantified because the plasma diffusion rate, the electron concentration, and the rate coefficient for attachment to CF3I were separately measured in the experiment. The Ar+ + CF3 reaction was found to proceed at nearly the calculated collisional rate coefficient, yielding 90% CF2+along with CF3+.Reaction of CF3 with C2F5+is slower and yields 75% C2F4+along with CF3+.CF3 undergoes charge transfer reaction with Xe+, O2+,NO+, and CO2+,yielding CF3+.Arguments will be made regarding reaction mechanisms, including the role of spin conservation. Comparisons with Ar+ and O2+reaction with CH3 will be made. Supported by Air Force Office of Scientific Research, AFOSR-2303EP.

  8. Mechanism of cis-prenyltransferase reaction probed by substrate analogues

    SciTech Connect

    Lu, Yen-Pin; Liu, Hon-Ge; Teng, Kuo-Hsun; Liang, Po-Huang

    2010-10-01

    Research highlights: {yields} The extremely slow trans-OPPS reaction using 2-Fluoro-FPP supports the sequential mechanism with the carbocation intermediate. {yields} The similar UPPS reaction rate under single turnover supports the concerted mechanism, without the carbocation intermediate. {yields} The secondary kinetic isotope effect also supports associate transition state for UPPS reaction, without the carbocation intermediate. -- Abstract: Undecaprenyl pyrophosphate synthase (UPPS) is a cis-type prenyltransferases which catalyzes condensation reactions of farnesyl diphosphate (FPP) with eight isopentenyl pyrophosphate (IPP) units to generate C{sub 55} product. In this study, we used two analogues of FPP, 2-fluoro-FPP and [1,1-{sup 2}H{sub 2}]FPP, to probe the reaction mechanism of Escherichia coli UPPS. The reaction rate of 2-fluoro-FPP with IPP under single-turnover condition is similar to that of FPP, consistent with the mechanism without forming a farnesyl carbocation intermediate. Moreover, the deuterium secondary KIE of 0.985 {+-} 0.022 measured for UPPS reaction using [1,1-{sup 2}H{sub 2}]FPP supports the associative transition state. Unlike the sequential mechanism used by trans-prenyltransferases, our data demonstrate E. coli UPPS utilizes the concerted mechanism.

  9. A universal model for estimating wheat yields

    NASA Technical Reports Server (NTRS)

    Feyerherm, A. M.; Paulsen, G. M. (Principal Investigator)

    1979-01-01

    A universal wheat yield model applicable to both fall- and spring-planted wheat was developed to show separate and joint effects of weather and culture on yields. Data from state experiment stations in a wide range of climates in the U.S. Great Plains were used to build basic relationships among yields, weather, and culture. The application of the model on a macroclimatic scale in the U.S., the U.S.S.R., and India is discussed along with potential improvements.

  10. Magnetic field dependence of the product yields of cycloheptanone photolysis in the dilute gas phase

    NASA Astrophysics Data System (ADS)

    Stich, E. M.; Baumeister, W. F.; Huber, J. Robert

    1984-07-01

    The product yields of the gas-phase photolysis of cycloheptanone were measured in magnetic fields up to 10 kG. The magnetic-field effect is explained in terms of the radical pair model. A reaction mechanism is proposed that explains the magnetic field dependence, pressure dependence, and excitation enegy dependence of the gas-phase photochemistry of cycloheptanone.

  11. Precompound analyses of spectra and yields following nuclear capture of stopped π-

    NASA Astrophysics Data System (ADS)

    Blann, M.

    1983-10-01

    The hybrid model has been modified for application in the energy region involved in capture of stopped negative pions (140 MeV). Comparisons of the improved formulation have been made with data from reactions induced by protons up to 164 MeV and the agreement was good. The model was used to predict n and p spectra and activation yields from stopped π- capture on targets from 12C to 209Bi, assuming a predominant quasideuteron capture mechanism. Predictions are given for primary versus secondary emission contributions to the spectra. Qualitative predictions for nn, np, and pp angular correlations are presented. Sensitivity of spectra and yields to parameters related to the nuclear density at which capture occurs is illustrated. While overall comparisons between calculated and experimental results are quite satisfactory, more detailed analyses suggest that a geometry dependent formulation integrating along the density profile for π- capture will be necessary, coupled with explicit treatment of enhanced nucleon emission probability versus nucleon induced reactions (due to momentum differences in the entrance channels) if such model results are to simultaneously reproduce particle spectra and yields. NUCLEAR REACTIONS Reactions induced by stopped π- calculate proton and neutron emission spectra and yields 12C to 209Bi targets using hybrid plus Weisskopf models.

  12. Yield Editor 2.0: software for automated removal of yield map errors

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Yield maps provide important information for developing and evaluating precision management strategies. The high-quality yield maps needed for decision-making require screening raw yield monitor datasets for errors and removing them before maps are made. To facilitate this process, we developed the ...

  13. Yield drag associated with resistance to root-knot nematodes in high-yielding cotton germplasm.

    Technology Transfer Automated Retrieval System (TEKTRAN)

    In plant breeding, accidental incorporation of deleterious DNA near a desirable gene is called linkage drag; if it reduces yield, it is called yield drag. Yield drag is best documented by comparing near isogenic lines with and without the DNA containing the desired gene to minimize other genetic di...

  14. The reaction of NH2 with NO2

    NASA Technical Reports Server (NTRS)

    Jayanty, R. K. M.; Simonaitis, R.; Heicklen, J.

    1976-01-01

    Ammonia (NH3) was photolyzed at 213.9 nm in the presence of NO2 at 25 C in order to study the reactions of NH2 with NO2. The products included NO, with a quantum yield of 1.0. The other measured products of the reaction were N2 and N2O with respective quantum yields of 0.94 plus or minus 0.10 and 0.3 in the presence of small amounts of He and 0.65 plus or minus 0.15 and 0.13 in the presence of a large excess of He. The quantum yield for NO2 consumption was 6.0 plus or minus 2.0 in the absence of He. These results are explained in terms of various reactions.

  15. Neutron yields for reactions induced by 120 GeV protons on thick copper target

    SciTech Connect

    Kajimoto, Tsuyoshi; Sanami, Toshiya; Iwamoto, Yosuke; Shigyo, Nobuhiro; Hagiwara, Masayuki; Saitoh, Kiwamu; Nakashima, Hiroshi; Ishibashi, Kenji; Lee, Hee-Seock; Ramberg, Eric; Coleman, Richard; /Fermilab

    2011-02-01

    We developed an experimental method to measure neutron energy spectrum for 120-GeV protons on a thick copper target at Fermilab Test Beam Facility (FTBF). The spectrum in the energy range from 16 to 1600 MeV was obtained for 60-cm long copper target by time-of-flight technique with an NE213 scintillator and 5.5-m flight path. Energy spectra of neutrons generated from an interaction with beam and materials are important to design shielding structure of high energy accelerators. Until now, the energy spectra for the incident energy up to 3 GeV have been measured by several groups, Ishibashi et al., Amian et al., and Leray et al. In the energy region above 3 GeV, few experimental data are available because of small number of facilities for neutron experiment. On the other hand, concerning simulation codes, theoretical models for particle generation and transportation are switched from intermediate to high energy one around this energy. The spectra calculated by the codes have not been examined using experimental data. In shielding experiments using 120 GeV hadron beam, experimental data shows systematic differences from calculations. Hagiwara et al. have measured leakage neutron spectra behind iron and concrete shield from 120 GeV proton on target at anti-proton target station in Fermilab by using Bonner Spheres with unfolding technique. In CERN, Nakao et al reported experimental results of neutron spectra behind iron and concrete wall from 120 GeV/c proton and pion mixed beam on copper by using NE213 liquid scintillators with unfolding technique. Both of the results reported systematic discrepancies between experimental and calculation results. Therefore, experimental data are highly required to verify neutron production part of calculations. In this study, we developed an experimental method to measure neutron energy spectrum for 120 GeV proton on target. The neutron energy was determined using time-of-flight technique. We used the Fermilab Test Beam Facility (FTBF) in Fermilab that provided 120 GeV proton beam with intensity of 2 x 10{sup 5}/4 sec in every minute. The point of this study was determination of experimental configuration to satisfy enough statistic and energy resolution of neutrons.

  16. Boosting production yield of biomedical peptides

    NASA Technical Reports Server (NTRS)

    Manatt, S. L.

    1978-01-01

    Nuclear magnetic resonance (NMR) technique is employed to monitor synthesis of biomedical peptides. Application of NMR technique may improve production yields of insulin, ACTH, and growth hormones, as well as other synthesized biomedical peptides.

  17. User's appraisal of yield model evaluation criteria

    NASA Technical Reports Server (NTRS)

    Warren, F. B. (Principal Investigator)

    1982-01-01

    The five major potential USDA users of AgRISTAR crop yield forecast models rated the Yield Model Development (YMD) project Test and Evaluation Criteria by the importance placed on them. These users were agreed that the "TIMELINES" and "RELIABILITY" of the forecast yields would be of major importance in determining if a proposed yield model was worthy of adoption. Although there was considerable difference of opinion as to the relative importance of the other criteria, "COST", "OBJECTIVITY", "ADEQUACY", AND "MEASURES OF ACCURACY" generally were felt to be more important that "SIMPLICITY" and "CONSISTENCY WITH SCIENTIFIC KNOWLEDGE". However, some of the comments which accompanied the ratings did indicate that several of the definitions and descriptions of the criteria were confusing.

  18. Spectral behavior of wheat yield variety trials

    NASA Technical Reports Server (NTRS)

    Hatfield, J. L.

    1981-01-01

    Little variation between varieties is seen at jointing, but the variability is found to increase during grain filling and decline again at maturity. No relationship is found between spectral response and yield, and when yields are segregated into various classes the spectral response is the same. Spring and winter nurseries are found to separate during the reproductive stage because of differences in dates of heading and maturity, but they exhibit similar spectral responses. The transformed normalized difference is at a minimum after the maximum grain weight occurs and the leaves begin to brown and fall off. These data of 100% ground cover demonstrate that it is not possible to predict grain yield from only spectral data. This, however, may not apply when reduced yields are caused by less-than-full ground cover

  19. Low-energy {omega} ({yields}{pi}{sup 0}{gamma}) meson photoproduction in the nucleus

    SciTech Connect

    Das, Swapan

    2011-06-15

    The {pi}{sup 0{gamma}} invariant mass distribution spectra in the ({gamma},{pi}{sup 0{gamma}}) reaction were measured by the TAPS/ELSA Collaboration to look for the hadron parameters of the {omega} meson in the Nb nucleus. We study the mechanism for this reaction, where we consider that the elementary reaction in the Nb nucleus proceeds as {gamma}N{yields}{omega}N;{omega}{yields}{pi}{sup 0}{gamma}. The {omega}-meson photoproduction amplitude for this reaction is extracted from the measured four-momentum transfer distribution in the {gamma}p{yields}{omega}p reaction. The propagation of the {omega} meson and the distorted wave function for the {pi}{sup 0} meson in the final state are described by the eikonal form. The {omega} and {pi}{sup 0} mesons' nucleus optical potentials, appearing in the {omega} meson propagator and {pi}{sup 0} meson distorted wave function respectively, are estimated using the t{rho} approximation. The effects of pair correlation and color transparency are also studied. The calculated results do not show medium modification for the {omega} meson produced in the nucleus for momentum greater than 200 MeV. It occurs because the {omega} meson predominantly decays outside the nucleus. The dependence of the cross section on the final-state interaction is also investigated. The broadening of the {omega}-meson mass distribution spectra is shown to occur due to the large resolution width associated with the detector used in the experiment.

  20. Oxidation of dithiocarbamates to yield N-nitrosamines by water disinfection oxidants.

    PubMed

    Padhye, Lokesh P; Kim, Jae-Hong; Huang, Ching-Hua

    2013-02-01

    Two most commonly used dithiocarbamate (DTC) pesticides, dimethyldithiocarbamate (DMDTC) and diethyldithiocarbamate (DEDTC), were examined in this study to evaluate their potential to form nitrosamines when in contact with various water disinfection oxidants. Results show that DTCs can serve as nitrosamine precursors, by release of secondary amines through hydrolysis or through reactions with oxidants. The reactions of DTCs with monochloramine and ozone were found to be particularly problematic in the risk of generating nitrosamines, though all four tested oxidants, including free chlorine and chlorine dioxide, formed nitrosamines. NDEA yield from DEDTC was lower, by different degrees, than NDMA yield from DMDTC for all four oxidants, which was attributed to the steric hindrance associated with bulkier reaction intermediate that are more difficult to be further oxidized to form nitrosamine. The yield of nitrosamines increased with the oxidant dosage for both monochloramination and ozonation of DTCs. Results for nitrosamine formation from DTCs at varying pH were found to be consistent with the pH trend of nitrosamine formation from ozonation and monochloramination of secondary amines. Kinetic study results and identification and quantification of reaction products suggest that the DTCs were not significant direct precursors of nitrosamines during monochloramination or ozonation, but rather nitrosamines formed were primarily from reaction of oxidants with the amine which may be generated either through hydrolysis or through oxidation of DTCs. PMID:23176828