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Sample records for sydsvenska kraft ab reactor 2

  1. Kraft cooking of gamma irradiated wood, (2)

    International Nuclear Information System (INIS)

    Inaba, Masamitsu; Meshitsuka, Gyosuke; Ishizu, Atsushi; Nakano, Junzo

    1981-01-01

    Pre-irradiation of wood in alkaline aqueous ethanol increases kraft pulp yield by up to 1.2%, as already reported. In order to clarify the mechanism of the pulp yield gain, the behaviors of lignin and carbohydrates during pre-irradiation and cooking were investigated. The results are summarized as follows: 1) γ-Irradiation of guaiacylethane in alkaline aqueous ethanol produced 5-(1-hydroxyethyl)-guaicylethane, which is formed by radical coupling between α-hydroxyethyl radical from ethanol and guaiacylethane radical having an unpaired electron at C-5. 5,5'-Dehydrodiguaiacylethane, which may be a predominant product produced by γ-irradiation in the absence of ethanol, was also detected. 2) The yield of vanillin obtained by nitrobenzene oxidation of MWL decreased with an increase of γ-ray dosage. The presence of ethanol during γ-irradiation lessened the extent of this decrease and also the degradation of cellobiose. 3) Gel filtration of the products obtained by γ-irradiation of MWL and cellobiose in the presence of 14 C-ethanol showed the possible combination between ethanol and MWL or cellobiose. 4) Molecular weight distributions of kraft lignin obtained from pre-irradiated beech chips were compared with those obtained from unirradiated chips. This result shows that γ-irradiation in the presence of ethanol decreases the ability of lignin to condense during kraft cooking. (author)

  2. Oxidative pyrolysis of kraft lignin in a bubbling fluidized bed reactor with air

    International Nuclear Information System (INIS)

    Li, Dongbing; Briens, Cedric; Berruti, Franco

    2015-01-01

    Fast pyrolysis of kraft lignin with partial (air) oxidation was studied in a bubbling fluidized bed reactor at reaction temperatures of 773 and 823 K. The bio-oil vapors were fractionated using a series of three condensers maintained at desired temperatures, providing a dry bio-oil with less than 1% water and over 96% of the total bio-oil energy. Oxygen feed was varied to study its effect on yield, composition, and energy recovery in the gas, char and oil products. The addition of oxygen to the pyrolysis process increased the production of gases such as CO and CO 2 . It also changed the dry bio-oil properties, reducing its heating value, increasing its oxygen content, reducing its average molecular weight and tar concentration, while increasing its phenolics concentration. The lower reaction temperature of 773 K was preferred for both dry bio-oil yield and quality. Autothermal operation of the pyrolysis process was achieved with an oxygen feed of 72 or 54 g per kg of biomass at the reaction temperatures of 773 and 823 K, respectively. Autothermal operation reduced both yield and total energy content of the dry bio-oil, with relative reductions of 24 and 20% for the yield, 28 and 23% for the energy content, at 773 and 823 K. - Highlights: • Autothermal pyrolysis of Kraft lignin is possible with introduction of air. • Under autothermal conditions, 24% of the dry bio-oil chemicals are lost at 773 K. • Partial oxidation helps produce more simple phenols and less pyrolytic lignin. • Bio-oil from lignin pyrolysis has a very high phenolics concentration

  3. UV pretreatment of Alkaline Bleaching Wastewater from a Kraft Pulp and Paper Mill prior to Anaerobic Digestion in a Lab scale UASB Reactor

    OpenAIRE

    Karlsson, Marielle

    2013-01-01

    The effects of UV pretreatment on alkaline bleaching (EOP) wastewater from a kraft pulp and paper mill were investigated prior to anaerobic digestion (AD) in an upflow anaerobic sludge blanket (UASB) reactor. The aim was to enhance the methane production, increase the reduction of total organic carbon (TOC) and determine the best UV exposure time. The exposure time of 2.6 minutes partially degraded the organic material in the EOP wastewater since it generated higher biogas and methane product...

  4. Experimental Studies on the Hydrotreatment of Kraft Lignin to Aromatics and Alkylphenolics Using Economically Viable Fe-Based Catalysts

    NARCIS (Netherlands)

    Agarwal, Shilpa; Chowdari, Ramesh Kumar; Hita, Idoia; Heeres, Hero Jan

    Limonite, a low-cost iron ore, was investigated as a potential hydrotreatment catalyst for kraft lignin without the use of an external solvent (batch reactor, initial H-2 pressure of 100 bar, 4 h). The best results were obtained at 450 degrees C resulting in 34 wt % of liquefied kraft lignin (lignin

  5. Lignin-based Phenol-Formalehyde Resins from Purified CO2 Precipitated Kraft Lignin (PCO2KL)

    Science.gov (United States)

    Yao Chen; Charles R. Frihart; Zhiyong Cai; Linda F. Lorenz; Nicole M. Stark

    2013-01-01

    To investigate the potential for using purified CO2-precipitated Kraft lignin (PCO2KL) with phenol-formaldehyde (PF) for application as an adhesive in plywood production, two lignin replacement procedures were examined to assess lignin’s effect on bond quality. Methylolation and oxidation with hydrogen peroxide (H

  6. Lignin-based Phenol-Formaldehyde Resins from Purified CO2 Precipitated Kraft lignin (PCO2KL)

    Science.gov (United States)

    Yao Chen; Charles R. Frihart; Zhiyong Cai; Linda F. Lorenz; Nicole M. Stark

    2013-01-01

    To investigate the potential for using purified CO2-precipitated Kraft lignin (PCO2KL) with phenol-formaldehyde (PF) for application as an adhesive in plywood production, two lignin replacement procedures were examined to assess lignin’s effect on bond quality. Methylolation and oxidation with hydrogen peroxide (H

  7. CDKN2A/B

    Science.gov (United States)

    Kong, Yahui; Sharma, Rohit B; Ly, Socheata; Stamateris, Rachel E; Jesdale, William M; Alonso, Laura C

    2018-02-06

    Genome-wide association studies link the CDKN2A/B locus with T2D risk, but mechanisms increasing risk remain unknown. The CDKN2A/B locus encodes cell cycle inhibitors p14 , p15 , and p16, MTAP, and ANRIL , a lncRNA. The goal of this study was to determine whether CDKN2A/B T2D risk-SNPs impact locus gene expression, insulin secretion, or beta cell proliferation, in human islets. Islets from non-diabetic donors (n=95) were tested for SNP genotype ( rs10811661 , rs2383208 , rs564398 , rs10757283 ), gene expression ( p14 , p15 , p16 , MTAP , ANRIL , PCNA , KI67 , CCND2 ), insulin secretion (n=61) and beta cell proliferation (n=47). Intriguingly, locus genes were co-regulated in islets in two physically overlapping cassettes: p14 - p16-ANRIL , which increased with age, and MTAP - p15 , which did not. Risk-alleles at rs10811661 and rs2383208 were differentially associated with expression of ANRIL , but not p14 , p15, p16 or MTAP , in age-dependent fashion, such that younger homozygous-risk donors had higher ANRIL expression, equivalent to older donor levels. We identified several risk-SNP haplotype combinations that may impact locus gene expression, suggesting possible mechanisms by which SNPs impact locus biology. Risk-allele carriers at ANRIL coding SNP rs564398 had reduced beta cell proliferation index. In conclusion, CDKN2A/B locus SNPs may impact T2D risk by modulating islet gene expression and beta cell proliferation. © 2018 by the American Diabetes Association.

  8. PARR-2: reactor description and experiments

    International Nuclear Information System (INIS)

    Wyne, M.F.; Meghji, J.H.

    1990-12-01

    PARR-2 is a miniature neutron source reactor (MNSR) research reactor has been designed at the rate of 27 kW. Reactor assembly comprises of peaking characteristics with a self limiting flux. In this report reactor description with its assembly and instrumentation control system has been explained. The reactor engineering and physics experiments which can be performed on this reactor are explained in this report. PARR-2 is fueled with HEU fuel pins which are about 90% enriched in U-235. Specific requirements for the safety of the reactor, its building and the personnel, normal instrumentation as required in an industrial environment is sufficient. (A.B.)

  9. Impact of burning oil as auxiliary fuel in kraft recovery furnaces upon SO2 emissions

    International Nuclear Information System (INIS)

    Someshwar, A.V.; Caron, A.L.; Pinkerton, J.E.

    1990-01-01

    The relationship between burning medium sulfur oil as auxiliary fuel in kraft recovery furnaces and SO 2 emissions was examined. Analysis of long-term CEMS SO 2 data from four furnaces shows no increase in SO 2 emissions as a result of oil burning. The results of field tests conducted at four furnaces while co-firing oil with liquor (up to 34% of total heat input) show that (1) average SO 2 emissions during the oil firing period either decreased or remained unchanged; (2) the overall sulfur retention within the furnace remained consistently high (more than 90%) with increasing levels of oil burning; (3) apportioning stack SO 2 emissions between those derived from oil and black liquor was infeasible. The results indicate that the same alkali fume generation processes that lead to the efficient capture of SO 2 resulting from black liquor combustion may be responsible for the capture of SO 2 resulting from sulfur-containing oil combustion

  10. Influence of kraft pulping on carboxylate content of softwood kraft pulps

    Science.gov (United States)

    Zheng Dang; Thomas Elder; Arthur J. Ragauskas

    2006-01-01

    This study characterizes changes in fiber charge, which is the carboxylate content of fibers, for two sets of kraft pulps: (1) conventional laboratory cooked loblolly pine kraft pulps and (2) conventional pulping (CK) versus low solids pulping (LS) pulps. Laboratory kraft pulping of loblolly pine was carried out to study the influence of pulping conditions, including...

  11. Reactor BR2

    International Nuclear Information System (INIS)

    Gubel, P.

    2000-01-01

    The BR2 reactor is still SCK-CEN's most important nuclear facility. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. Various aspects concerning the operation of the BR2 Reactor, the utilisation of the CALLISTO loop and the irradiation programme, the BR2 R and D programme and the production of isotopes and of NTD-silicon are discussed. Progress and achievements in 1999 are reported

  12. Reactor BR2

    Energy Technology Data Exchange (ETDEWEB)

    Gubel, P

    2000-07-01

    The BR2 reactor is still SCK-CEN's most important nuclear facility. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. Various aspects concerning the operation of the BR2 Reactor, the utilisation of the CALLISTO loop and the irradiation programme, the BR2 R and D programme and the production of isotopes and of NTD-silicon are discussed. Progress and achievements in 1999 are reported.

  13. Kraft lignin depolymerisation by based catalysed degradation (BCD) - The effect of process parameters on conversion degree and structural features of BCD fractions

    OpenAIRE

    Schmiedl, Schmiedl; Böringer, Sarah; Schweppe, Rainer; Liitiä, Tiina; Rovio, Stella; Tamminen, Tarja; Rencoret, Jorge; Gutiérrez Suárez, Ana; Río Andrade, José Carlos del; Río Andrade, José Carlos del

    2014-01-01

    The objective of the study is the generation of oxy-aromatic compounds (monomer, oligomer) from Eucalyptus- Kraft-lignin via multi-stage processes. These processes (1st base catalysed degradation & 2nd separation of the organic phase from reactor water) have to be feasible in bio refineries & in new Pulp-mill bio refineries as a new technology module. The Eucalyptus-Kraft-lignin (Suzano Pulp & Paper) was used for catalyzed conversion into oxy aromatics. Subsequently, the effect of process par...

  14. Reactor BR2: Introduction

    International Nuclear Information System (INIS)

    Gubel, P.

    2000-01-01

    The BR2 reactor is still SCK-CEN's most important nuclear facility. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. A safety audit was conduced by the IAEA, the conclusions of which demonstrated the excellent performance of the plant in terms of operational safety. In 1999, the CALLISTO facility was extensively used for various programmes involving LWR pressure vessel materials, IASCC of LWR structural materials, fusion reactor materials and martensic steels for use in ADS systems. In 1999, BR2's commercial programmes were further developed

  15. Reactor BR2. Introduction

    Energy Technology Data Exchange (ETDEWEB)

    Gubel, P

    2001-04-01

    The BR2 is a materials testing reactor and is still one of SCK-CEN's important nuclear facilities. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. During the last three years, the availability of the installation was maintained at an average level of 97.6 percent. In the year 2000, the reactor was operated for a total of 104 days at a mean power of 56 MW. In 2000, most irradiation experiments were performed in the CALLISTO PWR loop. The report describes irradiations achieved or under preparation in 2000, including the development of advanced facilities and concept studies for new programmes. An overview of the scientific irradiation programmes as well as of the R and D programme of the BR2 reactor in 2000 is given.

  16. Reactor BR2. Introduction

    International Nuclear Information System (INIS)

    Gubel, P.

    2002-01-01

    The BR2 materials testing reactor is one of SCK-CEN's most important nuclear facilities. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. In 2001, the reactor was operated for a total of 123 days at a mean power of 59 MW in order to satisfy the irradiation conditions of the internal and external programmes using mainly the CALLISTO PWR loop. The mean consumption of fresh fuel elements was 5.26 per 1000 MWd. Main achievements in 2001 included the development of a three-dimensional full-scale model of the BR2 reactor for simulation and prediction of irradiation conditions for various experiments; the construction of the FUTURE-MT device designed for the irradiation of fuel plates under representative conditions of geometry, neutron spectrum, heat flux and thermal-hydraulic conditions and the development of in-pile instrumentation and a data acquisition system

  17. Reactor BR2. Introduction

    Energy Technology Data Exchange (ETDEWEB)

    Gubel, P

    2002-04-01

    The BR2 materials testing reactor is one of SCK-CEN's most important nuclear facilities. After an extensive refurbishment to compensate for the ageing of the installation, the reactor was restarted in April 1997. In 2001, the reactor was operated for a total of 123 days at a mean power of 59 MW in order to satisfy the irradiation conditions of the internal and external programmes using mainly the CALLISTO PWR loop. The mean consumption of fresh fuel elements was 5.26 per 1000 MWd. Main achievements in 2001 included the development of a three-dimensional full-scale model of the BR2 reactor for simulation and prediction of irradiation conditions for various experiments; the construction of the FUTURE-MT device designed for the irradiation of fuel plates under representative conditions of geometry, neutron spectrum, heat flux and thermal-hydraulic conditions and the development of in-pile instrumentation and a data acquisition system.

  18. Kraft kasvatab Nordea haaret Eestis / Vahur Kraft

    Index Scriptorium Estoniae

    Kraft, Vahur, 1961-

    2006-01-01

    Avades lähikuudel seitse uut harukontorit, toimub Nordea Panga juhatuse esimehe Vahur Krafti juhtimisel suurim laienemine ettevõtte ajaloos. Ühtlasi peab Kraft jätkuvalt oluliseks internetipanga ja teiste elektrooniliste teenuste arendamist

  19. Alkaline peroxide treatment of ECF bleached softwood kraft pulps: part 2. effect of increased fiber charge on refining, wet-end application, and hornification

    Science.gov (United States)

    Zheng Dang; Thomas Elder; Jeffery S. Hsieh; Arthur J. Ragauskas

    2007-01-01

    The effect of increased fiber charge on refining, cationic starch adsorption, and hornification was examined. Two pulps were investigated: (1) a softwood (SW) kraft pulp (KP) which was bleached elementally chlorine-free (ECF) and sewed as control; and (2) a control pulp treated with alkaline peroxide, which had a higher fiber charge. It was shown that increased fiber...

  20. BR2 Reactor: Introduction

    International Nuclear Information System (INIS)

    Moons, F.

    2007-01-01

    The irradiations in the BR2 reactor are in collaboration with or at the request of third parties such as the European Commission, the IAEA, research centres and utilities, reactor vendors or fuel manufacturers. The reactor also contributes significantly to the production of radioisotopes for medical and industrial applications, to neutron silicon doping for the semiconductor industry and to scientific irradiations for universities. Along the ongoing programmes on fuel and materials development, several new irradiation devices are in use or in design. Amongst others a loop providing enhanced cooling for novel materials testing reactor fuel, a device for high temperature gas cooled fuel as well as a rig for the irradiation of metallurgical samples in a Pb-Bi environment. A full scale 3-D heterogeneous model of BR2 is available. The model describes the real hyperbolic arrangement of the reactor and includes the detailed 3-D space dependent distribution of the isotopic fuel depletion in the fuel elements. The model is validated on the reactivity measurements of several tens of BR2 operation cycles. The accurate calculations of the axial and radial distributions of the poisoning of the beryllium matrix by 3 He, 6 Li and 3T are verified on the measured reactivity losses used to predict the reactivity behavior for the coming decades. The model calculates the main functionals in reactor physics like: conventional thermal and equivalent fission neutron fluxes, number of displacements per atom, fission rate, thermal power characteristics as heat flux and linear power density, neutron/gamma heating, determination of the fission energy deposited in fuel plates/rods, neutron multiplication factor and fuel burn-up. For each reactor irradiation project, a detailed geometry model of the experimental device and of its neighborhood is developed. Neutron fluxes are predicted within approximately 10 percent in comparison with the dosimetry measurements. Fission rate, heat flux and

  1. MELCOR 1.8.2 assessment: Aerosol experiments ABCOVE AB5, AB6, AB7, and LACE LA2

    Energy Technology Data Exchange (ETDEWEB)

    Souto, F.J.; Haskin, F.E. [Univ. of New Mexico, Albuquerque, NM (United States). Dept. of Chemical and Nuclear Engineering; Kmetyk, L.N. [Sandia National Labs., Albuquerque, NM (United States)

    1994-10-01

    The MELCOR computer code has been used to model four of the large-scale aerosol behavior experiments conducted in the Containment System Test Facility (CSTF) vessel. Tests AB5, AB6 and AB7 of the ABCOVE program simulate the dry aerosol conditions during a hypothetical severe accident in an LMFBR. Test LA2 of the LACE program simulates aerosol behavior in a condensing steam environment during a postulated severe accident in an LWR with failure to isolate the containment. The comparison of code results to experimental data show that MELCOR is able to correctly predict most of the thermal-hydraulic results in the four tests. MELCOR predicts reasonably well the dry aerosol behavior of the ABCOVE tests, but significant disagreements are found in the aerosol behavior modelling for the LA2 experiment. These results tend to support some of the concerns about the MELCOR modelling of steam condensation onto aerosols expressed in previous works. During these analyses, a limitation in the MELCOR input was detected for the specification of the aerosol parameters for more than one component. A Latin Hypercube Sampling (LHS) sensitivity study of the aerosol dynamic constants is presented for test AB6. The study shows the importance of the aerosol shape factors in the aerosol deposition behavior, and reveals that MELCOR input/output processing is highly labor intensive for uncertainty and sensitivity analyses based on LHS.

  2. Quantum phases of AB2 fermionic chains

    International Nuclear Information System (INIS)

    Murcia-Correa, L S; Franco, R; Silva-Valencia, J

    2016-01-01

    A fermionic chain is a one-dimensional system with fermions that interact locally and can jump between sites in the lattice, in particular an AB n chain type, where A and B are sites that exhibit a difference in energy level of Δ and site B is repeated n-times, such that the unit cell has n +1 sites. A limit case of this model, called the ionic Hubbard model (n = 1), has been widely studied due to its interesting physics and applications. In this paper, we study the ground state of an AB 2 chain, which describes the material R 4 [Pt 2 (P 2 O 5 H 2 ) 4 X] · nH 2 O. Specifically, we consider a filling with two electrons per unit cell, and using the density matrix renormalization group method we found that the system exhibits the band insulator and Mott correlated insulator phases, as well as an intermediate phase between them. For couplings of Δ = 2,10 and 20, we estimate the critical points that separate these phases through the structure factor and the energy gap in the sector of charge and spin, finding that the position of the critical point rises as a function of Δ. (paper)

  3. A comprehensive program to develop correlations for the physical properties of Kraft black liquor. Interim report No. 2

    Energy Technology Data Exchange (ETDEWEB)

    Fricke, A.L.

    1990-12-01

    Experimental effort for the program to evaluate physical properties of kraft black liquors is now proceeding well. Experimental work includes pulping, liquor analysis, lignin purification and characterization, vapor-liquid equilibria, heat capacity, heats of solution and combustion, and viscosity measurements. Measurement of thermal conductivity has not yet begun. Collection of the data necessary for development of generalized correlations is proceeding, but will require about two more years. The digester is operating very well. It is now possible to operate the digester as a closed, rotating reactor or as a batch reactor with liquor circulation. When operated with liquor circulation, temperatures within the chip bed can be monitored during cooking. Cooking is reproducible, and cooks are being performed to produce liquors for experimental studies. The digester could be further modified to permit us to conduct rapid exchange batch pulping or to permit us to simulate continuous pulping. Liquors to be used in experimental studies are concentrated in our large scale evaporator or in our small scale evaporator. The large scale evaporator is used to concentrate liquors to about 50% solids for storage and for use in studies requiring high solids liquors. The small scale evaporator is used for preparing final samples to as high as 85% solids and for measuring vapor-liquid equilibria. Liquors are now routinely analyzed to determine all components, except higher molecular weight organic acids and extractives. Lignin determination by uv-visible means has been improved. Lignin purification from black liquor has been improved and lignin molecular weights are determined routinely. Work on lignin molecular weight distribution is still not satisfactory, but recent developments holds promise.

  4. Structural characterization of Kraft lignins from different spent cooking liquors by 1D and 2D Nuclear Magnetic Resonance spectroscopy

    International Nuclear Information System (INIS)

    Fernández-Costas, C.; Gouveia, S.; Sanromán, M.A.; Moldes, D.

    2014-01-01

    Three Kraft lignins isolated from black liquors of several paper pulp mills of the North of Spain and Portugal were structurally characterized by using monodimensional ( 1 H and 13 C) and bidimensional Nuclear Magnetic Resonance (NMR) spectrometry. From the latter, 13 C– 1 H heteronuclear single quantum correlation (HSQC) and heteronuclear multiple bond correlation (HMBC) were employed. Lignins from black liquors are usually burned for power generation. Nevertheless, they could become high value added products within a biorefinery context. In that case, a good understanding of their structure is a prior step to transform them. From all the NMR techniques studied, HSQC has risen as the most powerful tool in lignin characterization. Kraft cooking conditions and the type of wood seem to be the main factors that determine the differences observed in the lignins. All the samples have shown an important decrease in the number of β–O–4′ linkages, due to the Kraft process, and resinol has become the most resistant linkage to the process. Moreover, all samples seem to be mainly linked to a one polysaccharide: xylan. Several parameters like S/G ratio, portion of phenolic and aliphatic hydroxyls, amount of aromatic protons and other structural aspects were also estimated. - Highlights: • Lignins from three Kraft spent liquors were obtained by acid precipitation. • Structural characterization of the dissolved lignins was performed by NMR. • Wood source and pulping conditions determine the lignin characteristics. • Kraft process implies cleavage of β–O–4 linkages and survival of resinol linkages. • Comparison of the samples would aid decisions on its future revalorization

  5. SM-2 reactor potentialities for investigation of fusion reactor materials

    International Nuclear Information System (INIS)

    Tsykanov, V.A.; Samsonov, B.V.; Markina, N.V.; Polyakov, Yu.N.; Sluzhaev, V.I.; Losev, N.P.; Lobanov, G.P.

    1981-01-01

    The possibility of utilization of the SM-2 type reactors for fusion reactor (FR) materials testing is discussed. The measuring and calculational results, while estimating irradiation conditions in the SM-2 reactor channels, are given. The basic characteristics, necessary for correct simulation of FR parameters in fission reactors such as neutron flux density, radiation damage in the shift per atom values, gas accumulation, are considered. The characteristics of existing and tested in the SM-2 reactor investigational methods for studying structural and isolation materials are given. The conclusion about the possibility of SM-2 reactor utilization for the FR materials testing is made [ru

  6. BR2 reactor neutron beams

    International Nuclear Information System (INIS)

    Neve de Mevergnies, M.

    1977-01-01

    The use of reactor neutron beams is becoming increasingly more widespread for the study of some properties of condensed matter. It is mainly due to the unique properties of the ''thermal'' neutrons as regards wavelength, energy, magnetic moment and overall favorable ratio of scattering to absorption cross-sections. Besides these fundamental reasons, the impetus for using neutrons is also due to the existence of powerful research reactors (such as BR2) built mainly for nuclear engineering programs, but where a number of intense neutron beams are available at marginal cost. A brief introduction to the production of suitable neutron beams from a reactor is given. (author)

  7. Kraft cooking of gamma irradiated wood, (1)

    International Nuclear Information System (INIS)

    Inaba, Masamitsu; Meshitsuka, Gyosuke; Nakano, Junzo

    1979-01-01

    Studies have been made of kraft cooking of gamma irradiated wood. Beech (Fagus crenata Blume) wood meal suspended in aqueous alkaline alcohol was irradiated up to 1.5 KGy (0.15 Mrad) with gamma rays from a Co-60 source in the presence or absence of oxygen. The irradiated wood meals were washed thoroughly with fresh water, air dried and cooked under the ordinary cooking conditions. The results are summarized as follows: (1) Pre-irradiation in aqueous alkali have negligible effect on kraft cooking. (2) In the case of ethanol addition (50 g/l), pre-irradiation in vacuo shows acceleration of delignification and stabilization of carbohydrates during kraft cooking. Cooked yield gain by pre-irradiation was about 1.2% in all over the range of delignification from 80 to 90%. Aqueous ethanol without alkali also shows positive but smaller effect than that with alkali. (3) Propanol, iso-propanol and butanol show positive but smaller effects than ethanol. However, methanol does not show any positive effect. (4) Irradiation in the presence of oxygen does not show any attractive effect on kraft cooking. (author)

  8. Excess heat from kraft pulp mills. Trade-offs between internal and external use in the case of Sweden. Part 2. Results for future energy market scenarios

    International Nuclear Information System (INIS)

    Joensson, Johanna; Berntsson, Thore; Svensson, Inger-Lise; Moshfegh, Bahram

    2008-01-01

    In this paper the trade-off between internal and external use of excess heat from a kraft pulp mill is investigated for four different future energy market scenarios. The work follows the methodology described in Svensson et al. [2008. Excess heat from kraft pulp mills: trade-offs between internal and external use in the case of Sweden - Part 1: methodology. Energy Policy, submitted for publication], where a systematic approach is proposed for investigating the potential for profitable excess heat cooperation. The trade-off is analyzed by economic optimization of an energy system model consisting of a pulp mill and an energy company (ECO). In the model, investments can be made, which increase the system's energy efficiency by utilization of the mill's excess heat, as well as investments that increase the electricity production. The results show that the trade-off depends on energy market prices, the district heating demand and the type of existing heat production. From an economic point of view, external use of the excess heat is preferred for all investigated energy market scenarios if the mill is studied together with an ECO with a small heat load. For the cases with medium or large district heating loads, the optimal use of excess heat varies with the energy market price scenarios. However, from a CO 2 emissions perspective, external use is preferred, giving the largest reduction of global emissions in most cases. (author)

  9. The degradation of kraft lignin during hydrothermal treatment for phenolics

    Directory of Open Access Journals (Sweden)

    Tang Kai

    2015-09-01

    Full Text Available Kraft lignin was hydrothermally depolymerized at low temperature/short time in water for producing value-added phenolics. The effects of residence time (15, 60 min and reaction temperature (130, 180, 230ºC on yields of oils and phenolic compounds were studied in detail. Total oil yield was found to range between 7% and 10%. The compositions of oils were analyzed by GC-MS to confirm the main compound to be guaiacol (2-methoxy phenol in the range of 12–55% of oil depending on different reaction conditions. The most interesting was the finding that maximum value of total oil yield (10% of kraft lignin and guaiacol amount (55% of oil was obtained at 130ºC/15, 60 min which is a low reaction temperature/short time, while the residual kraft lignins were analyzed by FTIR with respect to the conversion mechanism of kraft lignin by this process.

  10. The 2-alkyl-2H-indazole regioisomers of synthetic cannabinoids AB-CHMINACA, AB-FUBINACA, AB-PINACA, and 5F-AB-PINACA are possible manufacturing impurities with cannabimimetic activities

    OpenAIRE

    Longworth, Mitchell; Banister, Samuel D.; Mack, James B. C.; Glass, Michelle; Connor, Mark; Kassiou, Michael

    2016-01-01

    Indazole-derived synthetic cannabinoids (SCs) featuring an alkyl substituent at the 1-position and l-valinamide at the 3-carboxamide position (e.g., AB-CHMINACA) have been identified by forensic chemists around the world, and are associated with serious adverse health effects. Regioisomerism is possible for indazole SCs, with the 2-alkyl-2H-indazole regioisomer of AB-CHMINACA recently identified in SC products in Japan. It is unknown whether this regiosiomer represents a manufacturing impurit...

  11. Treatment of real industrial wastewaters through nano-TiO2 and nano-Fe2O3 photocatalysis: case study of mining and kraft pulp mill effluents.

    Science.gov (United States)

    Nogueira, V; Lopes, I; Rocha-Santos, T A P; Gonçalves, F; Pereira, R

    2017-06-01

    High quantities of industrial wastewaters containing a wide range of organic and inorganic pollutants are being directly discharged into the environment, sometimes without proper treatment. Nanotechnology has a tremendous potential improving the existing treatments or even develop new treatment solutions. In this study, nano-TiO 2 or nano-Fe 2 O 3 was used for the photocatalytic treatment of kraft pulp mill effluent and mining effluent. The experiments with the organic effluent lead to reduction percentages of 93.3%, 68.4% and 89.8%, for colour, aromatic compounds and chemical oxygen demand, respectively, when treated with nano-TiO 2 /H 2 O 2 /UV and nano-Fe 2 O 3 /H 2 O 2 /UV, at pH 3.0. Significant removal of metals from the mining effluent was recorded but only for Zn, Al and Cd, the highest removal attained with 1.0 g L -1 of nano-TiO 2 /UV and nano-Fe 2 O 3 /UV. Regarding the toxicity of the organic effluent to Vibrio fischeri, it was reduced with the treatments combining the oxidant and the catalyst. However, for the inorganic effluent, the best reduction was achieved using 1.0 g L -1 of catalyst. In fact, the increase in dose of the catalyst, especially for nano-TiO 2 , enhanced toxicity reduction. Our results have shown that the use of these NMs seemed to be more effective in the organic effluent than in metal-rich effluent.

  12. Kinesin-2 KIF3AB exhibits novel ATPase characteristics.

    Science.gov (United States)

    Albracht, Clayton D; Rank, Katherine C; Obrzut, Steven; Rayment, Ivan; Gilbert, Susan P

    2014-10-03

    KIF3AB is an N-terminal processive kinesin-2 family member best known for its role in intraflagellar transport. There has been significant interest in KIF3AB in defining the key principles that underlie the processivity of KIF3AB in comparison with homodimeric processive kinesins. To define the ATPase mechanism and coordination of KIF3A and KIF3B stepping, a presteady-state kinetic analysis was pursued. For these studies, a truncated murine KIF3AB was generated. The results presented show that microtubule association was fast at 5.7 μm(-1) s(-1), followed by rate-limiting ADP release at 12.8 s(-1). ATP binding at 7.5 μm(-1) s(-1) was followed by an ATP-promoted isomerization at 84 s(-1) to form the intermediate poised for ATP hydrolysis, which then occurred at 33 s(-1). ATP hydrolysis was required for dissociation of the microtubule·KIF3AB complex, which was observed at 22 s(-1). The dissociation step showed an apparent affinity for ATP that was very weak (K½,ATP at 133 μm). Moreover, the linear fit of the initial ATP concentration dependence of the dissociation kinetics revealed an apparent second-order rate constant at 0.09 μm(-1) s(-1), which is inconsistent with fast ATP binding at 7.5 μm(-1) s(-1) and a Kd ,ATP at 6.1 μm. These results suggest that ATP binding per se cannot account for the apparent weak K½,ATP at 133 μm. The steady-state ATPase Km ,ATP, as well as the dissociation kinetics, reveal an unusual property of KIF3AB that is not yet well understood and also suggests that the mechanochemistry of KIF3AB is tuned somewhat differently from homodimeric processive kinesins. © 2014 by The American Society for Biochemistry and Molecular Biology, Inc.

  13. Molecular weight distribution of Pinus radiata kraft mill wastewater treated by anaerobic digestion.

    Science.gov (United States)

    Vidal, G; Videla, S; Diez, M C

    2001-04-01

    Kraft mill is responsible for massive discharge of highly polluted effluents. The main characteristics of this effluent are high toxicity and low biodegradability due to tannin, lignin and chlorophenol compounds. The composition may vary dramatically depending, for instance, on the utilised feedstock and process. The purpose of this work was to investigate the molecular weight distribution of Pinus radiata kraft pulping wastewater treated by anaerobic digestion by using two types of anaerobic reactors: fixed bed and sludge blanket. Anaerobic sludge blanket (UASB) and anaerobic filter (AF) were operated. In both reactors, the total alkalinity ranged between 1.0 and 1.5 g CaCO3/l, while the organic load rate (OLR) was increasing during operation from 1.2 to 3.3 gCOD/l d. COD and total phenolic compounds (UV215) removal ranged between 30-50% and 13-20%, respectively, while the BOD5 removal ranged 60-90%. However only a partial biodegradation (10-43%) of tannin and lignin was observed. Results from ultrafiltration analyses indicated that the fraction with a molecular weight (MW) 10,000 MW fraction, colour and COD fraction increased by 14% and 5%, respectively, after anaerobic treatment. It can be concluded from this study, that treatment with UASB or AF reactors is not enough, under the conditions tested, for a large COD removal from Pinus radiata wastewater.

  14. Failure rates in Barsebaeck-1 reactor coolant pressure boundary piping. An application of a piping failure database

    Energy Technology Data Exchange (ETDEWEB)

    Lydell, B. [RSA Technologies, Vista, CA (United States)

    1999-05-01

    This report documents an application of a piping failure database to estimate the frequency of leak and rupture in reactor coolant pressure boundary piping. The study used Barsebaeck-1 as reference plant. The study tried two different approaches to piping failure rate estimation: 1) PSA-style, simple estimation using Bayesian statistics, and 2) fitting of statistical distribution to failure data. A large, validated database on piping failures (like the SKI-PIPE database) supports both approaches. In addition to documenting leak and rupture frequencies, the SKI report describes the use of piping failure data to estimate frequency of medium and large loss of coolant accidents (LOCAs). This application study was co sponsored by Barsebaeck Kraft AB and SKI Research 41 refs, figs, tabs

  15. Failure rates in Barsebaeck-1 reactor coolant pressure boundary piping. An application of a piping failure database

    International Nuclear Information System (INIS)

    Lydell, B.

    1999-05-01

    This report documents an application of a piping failure database to estimate the frequency of leak and rupture in reactor coolant pressure boundary piping. The study used Barsebaeck-1 as reference plant. The study tried two different approaches to piping failure rate estimation: 1) PSA-style, simple estimation using Bayesian statistics, and 2) fitting of statistical distribution to failure data. A large, validated database on piping failures (like the SKI-PIPE database) supports both approaches. In addition to documenting leak and rupture frequencies, the SKI report describes the use of piping failure data to estimate frequency of medium and large loss of coolant accidents (LOCAs). This application study was co sponsored by Barsebaeck Kraft AB and SKI Research

  16. Development of a combined piezoresistive pressure and temperature sensor using a chemical protective coating for Kraft pulp digester process monitoring

    Science.gov (United States)

    Mohammadi, Abdolreza R.; Bennington, Chad P. J.; Chiao, Mu

    2011-01-01

    We have developed an integrated piezoresistive pressure and temperature sensor for multiphase chemical reactors, primarily Kraft pulp digesters (pH 13.5, temperatures up to 175 °C, reaching a local maximum of 180 °C and pressures up to 2 MPa). The absolute piezoresistive pressure sensor consisted of a large square silicon diaphragm (1000 × 1000 µm2) and high resistance piezoresistors (10 000 Ω). A 4500 Ω buried piezoresistive wire was patterned on the silicon chip to form a piezoresistive temperature sensor which was used for pressure sensor compensation and temperature measurement. A 4 µm thick Parylene HT® coating, a chemically resistant epoxy and a silicone conformal coating were deposited to passivate the pressure sensor against the caustic environment in Kraft digesters. The sensors were characterized up to 2 MPa and 180 °C in an environment chamber. A maximum thermal error of ±0.72% full-scale output (FSO), an average sensitivity of 0.116 mV (V kPa)-1 and a power consumption of 0.3 mW were measured in the pressure sensor. The sensors' resistances were measured before and after test in a Kraft pulping cycle and showed no change in their values. SEM pictures and topographical surfaces were also analyzed before and after pulp liquor exposure and showed no observable changes.

  17. Utilization of softwood kraft lignin as adhsive for the manufacture of reconstituted wood

    Science.gov (United States)

    Lin-Wu Zhao; Bruce F. Griggs; Chen-Loung Chen; Josef S. Gratzl; Chung-Yun Hse

    1994-01-01

    Reaction conditions for hydroxymethylation of pine kraft lignin (KL) were optimized by kinetic studies of the reaction. Characterization of the resulting hydroxymethylated kraft lignin (HMKL) indicated that about 0.36 mole of the -CH2OH/C9 unit was introduced into the ognin under the optimal reaction conditions, of which...

  18. Carbon Fibres from Kraft Lignin

    OpenAIRE

    Norberg, Ida

    2012-01-01

    Kraft lignin has a high potential for use in more valuable applications than its current use as fuel in pulp mills and integrated pulp and paper mills. The possibility of using kraft lignin, a green material with a carbon content of more than 60 %, for the manufacturing of carbon fibres was investigated in this thesis. The strong and lightweight carbon fibre material has many potential application areas, e.g. in cars; the main obstacle limiting its demand is the high production cost, with the...

  19. Vahur Kraft soovitab elektritootmise erastada / Vahur Kraft ; interv. Vallo Toomet

    Index Scriptorium Estoniae

    Kraft, Vahur, 1961-

    2003-01-01

    Eesti Panga president Vahur Kraft soovitab seoses Iraagi sõja ja ebakindlusega maailmas suhtuda ettevaatlikult majanduskasvu prognoosi ning näeb maksureformi läbiviimiseks vajaliku kokkuhoiu võimalusi hariduse, tervishoiu ja sotsiaalkindlustuse reformimisel. Diagramm. Tabel. Vt. samas: Andrus Säälik. Tulude alla jõuavad ka toetused

  20. Ab initio Potential Energy Surface for H-H2

    Science.gov (United States)

    Partridge, Harry; Bauschlicher, Charles W., Jr.; Stallcop, James R.; Levin, Eugene

    1993-01-01

    Ab initio calculations employing large basis sets are performed to determine an accurate potential energy surface for H-H2 interactions for a broad range of separation distances. At large distances, the spherically averaged potential determined from the calculated energies agrees well with the corresponding results determined from dispersion coefficients; the van der Waals well depth is predicted to be 75 +/- (mu)E(sub h). Large basis sets have also been applied to reexamine the accuracy of theoretical repulsive potential energy surfaces. Multipolar expansions of the computed H-H2 potential energy surface are reported for four internuclear separation distances (1.2, 1.401, 1.449, and 1.7a(sub 0) of the hydrogen molecule. The differential elastic scattering cross section calculated from the present results is compared with the measurements from a crossed beam experiment.

  1. Mechanical and thermal properties of electron beam-irradiated polypropylene reinforced with Kraft lignin

    Science.gov (United States)

    Sugano-Segura, A. T. R.; Tavares, L. B.; Rizzi, J. G. F.; Rosa, D. S.; Salvadori, M. C.; dos Santos, D. J.

    2017-10-01

    Polypropylene reinforced with Kraft lignin composites (0, 2.5, 5.0 and 10.0 wt% lignin) were submitted to electron beam (EB) irradiation at doses of 0, 50, 100 and 250 kGy. Kraft lignin incorporation maintained Young´s modulus values, even at electron beam doses up to 100 kGy (10 wt% lignin). The yield stress losses were also reduced by the addition of lignin to polypropylene. Fourier transform infrared spectroscopy (FTIR) results showed low formation of carboxyl and hydroxyl groups for composites containing lignin. Dynamic mechanical analysis (DMA) curves indicated a synergistic effect between Kraft lignin and electron beam irradiation on the storage modulus (E´). Several properties evolved as a function of the Kraft lignin content. Synergistic effects between Kraft lignin incorporation and electron beam radiation contribute to applications that require the mechanical and thermal properties of iPP to be maintained, even after high doses of electron beam radiation.

  2. Core monitoring at the WNP-2 reactor

    International Nuclear Information System (INIS)

    Skeen, D.R.; Torres, R.H.; Burke, W.J.; Jenkins, I.; Jones, S.W.

    1992-01-01

    The WNP-2 reactor is a 3,323-MW(thermal) boiling water reactor (BWR) that is operated by the Washington Public Power Supply System. The WNP-2 reactor began commercial operation in 1984 and is currently in its eighth cycle. The core monitoring system used for the first cycle of operation was supplied by the reactor vendor. Cycles 2 through 6 were monitored with the POWERPLEX Core Monitoring Software System (CMSS) using the XTGBWR simulation code. In 1991, the supply system upgraded the core monitoring system by installing the POWERPLEX 2 CMSS prior to the seventh cycle of operation for WNP-2. The POWERPLEX 2 CMSS was developed by Siemens Power Corporation (SPC) and is based on SPC's advanced state-of-the-art reactor simulator code MICROBURN-B. The improvements in the POWERPLEX 2 system are possible as a result of advances in minicomputer hardware

  3. AB(2) functional polyesters via ring opening polymerization: synthesis and characterization

    NARCIS (Netherlands)

    Velthoen, I.W.; Dijkstra, Pieter J.; Feijen, Jan

    2009-01-01

    Aliphatic AB2 functional polyesters were conveniently prepared by the ring opening polymerization of ε-caprolactone and L-lactide in the presence of the AB2 functional initiator 2,2-bis(hydroxymethyl)propionic acid (bis-MPA) and Sn(Oct)2 as the catalyst. In L-lactide polymerization, both bis-MPA

  4. Improved radioimaging and tumor localization with monoclonal F(ab')2

    International Nuclear Information System (INIS)

    Wahl, R.L.; Parker, C.W.; Philpott, G.W.

    1983-01-01

    Monoclonal anti-tumor antibodies have great promise for radioimmunodetection and localization of tumors. Fab and F(ab')2 fragments, which lack the Fc fragment of antibody (Ab), are cleared more rapidly from the circulation and may have less nonspecific tissue binding than intact Ab. In radioimaging studies using a murine monoclonal antibody to carcinoembryonic antigen in a human colon carcinoma xenografted into hamsters, F(ab')2 fragments were shown superior to Fab fragments and intact antibody for scintiscanning. In double-label experiments with anti-CEA antibody and control monoclonal IgG, F(ab')2 fragments were found to give better and more rapid specific tumor localization than intact antibody or Fab fragments. F(ab')2 fragments offer significant promise for tumor imaging and possibly therapy

  5. Genetics Home Reference: GM2-gangliosidosis, AB variant

    Science.gov (United States)

    ... can be inherited? More about Inheriting Genetic Conditions Diagnosis & Management Resources Genetic Testing (1 link) Genetic Testing Registry: Tay-Sachs disease, variant AB General Information from MedlinePlus (5 ...

  6. Fungal demethylation of Kraft lignin.

    Science.gov (United States)

    Zou, Linyou; Ross, Brian M; Hutchison, Leonard J; Christopher, Lew P; Dekker, Robert F H; Malek, Lada

    2015-06-01

    Demethylation of industrial lignin has been for long coveted as a pathway to the production of an abundant natural substitute for fossil-oil derived phenol. In an attempt to possibly identify a novel Kraft lignin-demethylating enzyme, we surveyed a collection of fungi by using selected ion flow tube-mass spectrometry (SIFT-MS). This method readily identifies methanol resulting from lignin demethylation activity. Absidia cylindrospora, and unidentified Cylindrocladium sp. and Aspergillus sp. were shown to metabolize lignin via different pathways, based on the HPLC analysis of lignin fragments. Of these three, Cylindrocladium and Aspergillus were shown to retain most of the lignin intact after 3 weeks in culture, while removing about 40% of the available methoxy groups. Our results demonstrate that after optimization of culture and lignin recovery methods, biological modification of Kraft lignin may be a feasible pathway to obtaining demethylated lignin for further industrial use. Crown Copyright © 2015. Published by Elsevier Inc. All rights reserved.

  7. Radioimmunoimaging using F(ab')2 fragment of monoclonal antibodies against human alpha-fetoprotein

    International Nuclear Information System (INIS)

    Sakahara, Harumi; Endo, Keigo; Nakashima, Tetsuo; Koizumi, Mitsuru; Ohta, Hitoya; Torizuka, Kanji; Okada, Kenichiro; Yoshida, Osamu; Nishi, Shinzo.

    1985-01-01

    Using monoclonal antibodies against human α-fetoprotein (AFP), radioiodinated F(ab') 2 fragments were compared with whole IgG as a radiotracer for radioimmunoimaging of cancer. F(ab') 2 fragments were obtained by pepsin digestion of whole IgG (IgGl). IgG and F(ab') 2 were labeled with 125 I or 131 I by the chloramine-T method with almost full retention of antibody activity. F(ab') 2 fragments were cleared more rapidly from the circulation in normal mice with a half life of 6.3 hours than whole IgG with a half life of 5.5 days. Radioactivity of F(ab') 2 in various organs also decreased faster than IgG. In nude mice transplanted with AFP-producing human testicular tumor, F(ab') 2 fragments demonstrated superior scintigrams to whole IgG at 2 days after the injection, because of the fast disappearance of background radioactivity. Although absolute accumulation of 131 I labeled F(ab') 2 in the tumor was less than that of 131 I labeled IgG, tumor to other organ ratios were much higher with F(ab') 2 than those of IgG. The tumor to blood ratio of 131 I labeled F(ab') 2 was 1.04 at day 2, whereas tumor to blood ratio of 131 I labeled IgG was 0.55 at day 2 and 0.92 at day 4, respectively. These results indicated that for the radiolabeling of monoclonal antibodies, F(ab') 2 fragments would be superior to whole IgG in the radioimmunoimaging of cancer. (author)

  8. Preparation of a pure 99mTc-F(ab')2 radioimmunoconjugate by direct labeling methods

    International Nuclear Information System (INIS)

    Griffiths, G.L.; Jones, A.L.; Hansen, H.J.; Goldenberg, D.M.

    1994-01-01

    Intact IgG and Fab' can be labeled directly with 99m Tc to give quantitative incorporation of radioactivity into the protein. With F(ab') 2 the reductive conditions yield a mixture of 99m Tc-F(ab') 2 and 99m Tc-Fab'. We now report a direct labeling method to produce only 99m Tc-F(ab') 2 in quantitative yield and contaminated with 99m Tc-Fab'. The properties, stability and biodistribution of the 99m Tc-F(ab') 2 have been compared to 99m Tc-Fab'. This new technology will allow us to compare technetium direct-labeled IgG, F(ab') 2 and Fab' derivatives of the same antibody for radioimmunodetection. (author)

  9. Refurbishing the BR2 materials testing reactor

    International Nuclear Information System (INIS)

    Baugnet, J.M.; Dekeyser, J.; Gubel, P.

    1995-01-01

    SCK/CEN is refurbishing its BR2 reactor to allow its further operation during the next 15 years; in doing so, it chooses to keep BR2 available for future scientific and technological irradiation programs within an international context. (author) 2 figs

  10. Lignin modification in the initial phase of softwood kraft pulp delignification with polyoxometalates (POMs)

    Science.gov (United States)

    Biljana Bujanovic; Sally A. Ralph; Richard S. Reiner; Rajai H. Atalla

    2007-01-01

    Commercial softwood kraft pulp with kappa number 30.5 (KP30.5) was delignified with polyoxometalates (POM, Na5(+2)[SiV1(-0.1)MoW10(+0.1)O40]), and POM-treated kraft pulp of kappa number 23.6 was obtained (KPPOM,23.6). Residual lignin from pulps was isolated by mild acid hydrolysis and characterized by analytical and spectral methods to gain insight into lignin...

  11. Longer life cores for SLOWPOKE-2 reactors

    International Nuclear Information System (INIS)

    Irish, J.D.; Hilborn, J.W.

    1985-06-01

    A method has been devised to increase the lifetime of SLOWPOKE-2 cores by increasing the initial fuel loading by about 7 percent. The method was implemented during the commissioning of the SLOWPOKE-2 (Kanata) reactor. Calculations indicate that the core lifetime will be doubled

  12. Cationization increases brain distribution of an amyloid-beta protofibril selective F(ab')2 fragment

    OpenAIRE

    Syvänen, Stina; Edén, Desireé; Sehlin, Dag

    2017-01-01

    Antibodies and fragments thereof are, because of high selectivity for their targets, considered as potential therapeutics and biomarkers for several neurological disorders. However, due to their large molecular size, antibodies/fragments do not easily penetrate into the brain. The aim of the present study was to improve the brain distribution via adsorptive-mediated transcytosis of an amyloid-beta (A beta) protofibril selective F(ab')2 fragment (F(ab')2-h158). F(ab')2-h158 was cationized to d...

  13. Hydrothermal Synthesis of Bi2S3 Nanostructures and ABS-Based Polymeric Nanocomposite

    Directory of Open Access Journals (Sweden)

    D. Ghanbari

    2014-04-01

    Full Text Available Bismuth sulfide nano-rods and nano-flowers were synthesized via a hydrothermal reaction at a relatively low temperature. Thioglycolic acid is used as sulfur source and capping agent simultaneously. Bi2S3 nanostructures were then added to acrylonitrile-butadiene-styrene (ABS copolymer. The thermal stability behavior of ABS filled with bismuth sulfide nano-rods were investigated by thermogravimetric analysis (TGA. Nanostructures were characterized by X-ray diffraction (XRD, scanning electron microscopy (SEM and atomic force microscopy (AFM. The flame retardancy behavior of ABS-Bi2S3 was studied by UL-94 analysis.

  14. Effects of ozone on kraft process pulp mill effluent

    International Nuclear Information System (INIS)

    Mohammed, A.; Smith, D.W.

    1992-01-01

    Effluent from a kraft process pulp mill was studied in a batch reactor for ozone doses between 50 and 200 mg O 3 /L to identify the suitability of ozone application locations in the treatment process and see the improvements in biotreatability of wastewaters from a kraft process pulp mill. Laboratory acclimatized seed were used for (Biochemical Oxygen Demand) BOD tests for ozonated and unozonated samples. The inhibitory effects were minimized by using optimum dilutions. The studies were divided into three major sections: characterization of mill effluent; ozone system calibration, and reactor design; and ozonation of mill effluent. Seed for BOD tests were acclimatized in batch units for primary, bleach and secondary effluents separately. The results were analyzed using the open-quote t close-quote test for paired experiments and an ANOVA table for statistical confirmation. Residuals were plotted to check the assumptions of constant variance and normal distribution. It was concluded that ozone is most effective for the removal of color and the increase of BOD in secondary effluent. 21 refs., 9 figs., 7 tabs

  15. Evaluation of tumor targeting with radiolabeled F(ab2 fragment of a humanized monoclonal antibody

    Directory of Open Access Journals (Sweden)

    "Babaei MH

    2002-08-01

    Full Text Available Humanized monoclonal antibody U36 and its F(ab'2 fragment, radio labeled with 125I, were tested for tumor localization in nude mice bearing a squamous cell carcinoma xenograft line derived from a head and neck carcinoma. Monoclonal antibody IgG or F(ab'2 fragment were injected in parallel and at days 1, 2 and 3, mice were dissected for determination of isotope biodistribution. IgG as well as F(ab'2 showed highly specific localization in tumor tissue. The mean tumor uptake (n=3 is expressed as the percentage of the injected dose per gram of tumor tissue (%ID/g. %ID/g of IgG was 11.7% at day 1 and decreased to 10.9% at day 3 whereas %ID/g of F(ab'2 was 2.9% at day 1 and decreased on following days. Tumor to blood ratios (T/B at day 1 were 0.86 for IgG and 1.32 for F(ab'2 and reached a maximum at day 3 with values of 4.41 and 1.84 respectively. These findings suggest that the superior tumor to non-tumor ratios in the day of 1 render the F(ab'2 fragment more qualified for specific targeting radioisotopes to tumor xenografts in this exprimental setting.

  16. AB INITIO STUDY OF ADVANCED METALLIC NUCLEAR FUELS FOR FAST BREEDER REACTORS

    Energy Technology Data Exchange (ETDEWEB)

    Landa, A; Soderlind, P; Grabowski, B; Turchi, P A; Ruban, A V; Vitos, L

    2012-04-23

    Density-functional formalism is applied to study the ground state properties of {gamma}-U-Zr and {gamma}-U-Mo solid solutions. Calculated heats of formation are compared with CALPHAD assessments. We discuss how the heat of formation in both alloys correlates with the charge transfer between the alloy components. The decomposition curves for {gamma}-based U-Zr and U-Mo solid solutions are derived from Ising-type Monte Carlo simulations. We explore the idea of stabilization of the {delta}-UZr{sub 2} compound against the {alpha}-Zr (hcp) structure due to increase of Zr d-band occupancy by the addition of U to Zr. We discuss how the specific behavior of the electronic density of states in the vicinity of the Fermi level promotes the stabilization of the U{sub 2}Mo compound. The mechanism of possible Am redistribution in the U-Zr and U-Mo fuels is also discussed.

  17. Preventing Strength Loss of Unbleached Kraft Pulp

    Energy Technology Data Exchange (ETDEWEB)

    Martin Hubbe; Richard Venditti; John Heitmann

    2003-04-16

    Kraft pulp fibers lose inter-fiber bonding ability when they are dried during the manufacture of paper. Adverse environmental consequences of this loss include (a) limitations on the number of times that kraft fibers can be recycled, (b) reduced paper strength, sometimes making it necessary to use heavier paper or paperboard to meet product strength requirements, increasing the usage of raw materials, (c) decreased rates of paper production in cases where the fiber furnish has been over-refined in an attempt to regain inter-fiber bonding ability. The present study is the first of its type to focus on unbleached kraft fibers, which are a main ingredient of linerboard for corrugated containers. About 90 million tons of unbleached kraft fiber are used worldwide every year for this purpose.

  18. TMI-2 and reactor safety

    International Nuclear Information System (INIS)

    Kato, W.Y.

    1982-01-01

    The accident on March 28, 1979 at the Three Mile Island Unit 2 (TMI-2) Nuclear Power Station located near Harrisburg, Pennsylvania has had a major impact upon the design, construction, operation, regulation and safety research of nuclear power plants. It also has had an impact on utility and regulatory organizations. This paper presents a review of the TMI-2 accident scenario, its consequences and the conclusions of various investigating groups. An overview of the nuclear licensing process, computer codes used in safety analysis, safety research, and current issues is provided, using as a basis the TMI-2 accident. Some of the current safety issues which are included in the proposed NRC rulemaking hearings on such subjects as safety goals, siting criteria, emergency plans, and degraded or damaged core analysis are discussed. (author)

  19. Studies of the distribution of intrathecally injected 125I-tetanus antitoxin-F(ab')2

    International Nuclear Information System (INIS)

    Hanauske, A.R.

    1981-01-01

    Overall F(ab') 2 and antitetanus-f(ab') 2 - fragments were labelled with 125 I and injected i.th. into normal juvenile cats and adult rats. One group of rats was normal; in the other, unilateral local tetanus had been induced by injection of tetanus toxin into a M. gastrocnemius. The animals were sacrificed 24 h after the i.th. injection, and tissue samples were taken for histoautoradiography. 125 I-antitetanus-F(ab') 2 permeated into the extracellular space of the spinal cord, roots, and ganglia but not into the neuronal intracellular space. 125 I-overall-F(ab') showed identical permeation behaviour. 125 I-antitetanus-F(ab') 2 reacted with tetanus toxin issuing from the motoneurons after i.th. injection, forming an immunocomplex around the motorneurons. The immunocomplex was not formed around pseudo-unipolar ganglian cells in the spinal ganglia even though some of the ganglian cells contained tetanus toxin, and 125 I-antitetanus-F(ab') 2 was present in the extracellular space. As an explanation, it was suggested that tetanus toxin does not permeate into the extracellular space through the membrane of the pseudo-unipolar ganglian cells so that immune reactions will not occur. These findings help to explain the widely divergent results of tetanus therapy by means of i.th. injection of tetanus antitoxin. Recommendations for future therapy measures are derived from the findings. (orig./MG) [de

  20. Irradiation techniques at BR2 reactor

    International Nuclear Information System (INIS)

    Hebel, W.

    1978-01-01

    Since 1963 the material testing reactor BR2 at Mol is operated for the realisation of numerous research programs and experiments on the behavior of materials under nuclear radiation and in particular under intensive neutron exposure. During this period special irradiation techniques and experimental devices were developed according to the desiderata of the different experiments and to the irradiation possibilities offered at BR2. The design and the operating characteristics of quite a number of those irradiation rigs of proven reliability may be used or can be made available for new irradiation experiments. A brief description is given of some typical irradiation devices designed and constructed by CEN/SCK, Technology and Energy Dpt. They are compiled according to their main use for the different research and development programs realized at BR2. Their eventual application however for different objectives could be possible. A final chapter summarizes the principal irradiation conditions offered by BR2 reactor. (author)

  1. Expression of Cry1Ab and Cry2Ab by a polycistronic transgene with a self-cleavage peptide in rice.

    Directory of Open Access Journals (Sweden)

    Qichao Zhao

    Full Text Available Insect resistance to Bacillus thuringiensis (Bt crystal protein is a major threat to the long-term use of transgenic Bt crops. Gene stacking is a readily deployable strategy to delay the development of insect resistance while it may also broaden insecticidal spectrum. Here, we report the creation of transgenic rice expressing discrete Cry1Ab and Cry2Ab simultaneously from a single expression cassette using 2A self-cleaving peptides, which are autonomous elements from virus guiding the polycistronic viral gene expression in eukaryotes. The synthetic coding sequences of Cry1Ab and Cry2Ab, linked by the coding sequence of a 2A peptide from either foot and mouth disease virus or porcine teschovirus-1, regardless of order, were all expressed as discrete Cry1Ab and Cry2Ab at high levels in the transgenic rice. Insect bioassays demonstrated that the transgenic plants were highly resistant to lepidopteran pests. This study suggested that 2A peptide can be utilized to express multiple Bt genes at high levels in transgenic crops.

  2. Evaluation of corn hybrids expressing Cry1F, cry1A.105, Cry2Ab2, Cry34Ab1/Cry35Ab1, and Cry3Bb1 against southern United States insect pests.

    Science.gov (United States)

    Siebert, M W; Nolting, S P; Hendrix, W; Dhavala, S; Craig, C; Leonard, B R; Stewart, S D; All, J; Musser, F R; Buntin, G D; Samuel, L

    2012-10-01

    Studies were conducted across the southern United States to characterize the efficacy of multiple Bacillus thuringiensis (Bt) events in a field corn, Zea mays L., hybrid for control of common lepidopteran and coleopteran pests. Cry1F protein in event TC1507 and Cry1A.105 + Cry2Ab2 proteins in event MON 89034 were evaluated against pests infesting corn on above-ground plant tissue including foliage, stalks, and ears. Cry34Ab1/Cry35Ab1 proteins in event DAS-59122-7 and Cry3Bb1 in event MON 88017 were evaluated against the larvae of Mexican corn rootworm, Diabrotica virgifera zeae Krysan and Smith, which occur below-ground. Field corn hybrids containing Cry1F, Cry1A.105 + Cry2Ab2, Cry34Ab1/Cry35Ab1, and Cry3Bb1 insecticidal proteins (SmartStax) consistently demonstrated reductions in plant injury and/or reduced larval survivorship as compared with a non-Bt field corn hybrid. Efficacy provided by a field corn hybrid with multiple Bt proteins was statistically equal to or significantly better than corn hybrids containing a single event active against target pests. Single event field corn hybrids provided very high levels of control of southwestern corn borer, Diatraea grandiosella (Dyar), lesser cornstalk borer, Elasmopalpus lignosellus (Zeller), and fall armyworm, Spodoptera frugiperda (J.E. Smith), and were not significantly different than field corn hybrids with multiple events. Significant increases in efficacy were observed for a field corn hybrid with multiple Bt events for sugarcane borer, Diatraea saccharalis (F.), beet armyworm, Spodoptera exigua (Hübner), corn earworm, Helicoverpa zea (Boddie), and Mexican corn rootworm. Utilization of field corn hybrids containing multiple Bt events provides a means for managing insect resistance to Bt proteins and reduces non-Bt corn refuge requirements.

  3. EL-2 reactor: Thermal neutron flux distribution

    International Nuclear Information System (INIS)

    Rousseau, A.; Genthon, J.P.

    1958-01-01

    The flux distribution of thermal neutrons in EL-2 reactor is studied. The reactor core and lattices are described as well as the experimental reactor facilities, in particular, the experimental channels and special facilities. The measurement shows that the thermal neutron flux increases in the central channel when enriched uranium is used in place of natural uranium. However the thermal neutron flux is not perturbed in the other reactor channels by the fuel modification. The macroscopic flux distribution is measured according the radial positioning of fuel rods. The longitudinal neutron flux distribution in a fuel rod is also measured and shows no difference between enriched and natural uranium fuel rods. In addition, measurements of the flux distribution have been effectuated for rods containing other material as steel or aluminium. The neutron flux distribution is also studied in all the experimental channels as well as in the thermal column. The determination of the distribution of the thermal neutron flux in all experimental facilities, the thermal column and the fuel channels has been made with a heavy water level of 1825 mm and is given for an operating power of 1000 kW. (M.P.)

  4. Phonon spectrum of lead oxychloride Pb3O2Cl2: Ab initio calculation and experiment

    Science.gov (United States)

    Zakir'yanov, D. O.; Chernyshev, V. A.; Zakir'yanova, I. D.

    2016-02-01

    IR and Raman spectra of Pb3O2Cl2 in the range of 50-600 cm-1 have been detected for the first time. Ab initio calculations of the crystal structure and the phonon spectrum of Pb3O2Cl2 in the framework of LCAO approach have been performed by the Hartree-Fock method and in the framework of the density functional theory with the use of hybrid functionals. The results of calculations have made it possible to interpret the experimental vibration spectra and reveal silent modes, which do not manifest themselves in these spectra but influence the optical properties of the crystal.

  5. TMI-2 reactor vessel head removal

    International Nuclear Information System (INIS)

    Bengel, P.R.; Smith, M.D.; Estabrook, G.A.

    1985-09-01

    This report describes the safe removal and storage of the Three Mile Island Unit 2 (TMI-2) reactor vessel head. The head was removed in July 1984 to permit the removal of the plenum and the reactor core, which were damaged during the 1979 accident. From July 1982, plans and preparations were made using a standard head removal procedure modified by the necessary precautions and changes to account for conditions caused by the accident. After data acquisition, equipment and structure modifications, and training, the head was safely removed and stored; and the internals indexing fixture and a work platform were installed on top of the vessel. Dose rates during and after the operation were lower than expected; lessons were learned from the operation which will be applied to the continuing fuel removal operations activities

  6. TMI-2 reactor vessel head removal

    Energy Technology Data Exchange (ETDEWEB)

    Bengel, P.R.; Smith, M.D.; Estabrook, G.A.

    1985-09-01

    This report describes the safe removal and storage of the Three Mile Island Unit 2 (TMI-2) reactor vessel head. The head was removed in July 1984 to permit the removal of the plenum and the reactor core, which were damaged during the 1979 accident. From July 1982, plans and preparations were made using a standard head removal procedure modified by the necessary precautions and changes to account for conditions caused by the accident. After data acquisition, equipment and structure modifications, and training, the head was safely removed and stored; and the internals indexing fixture and a work platform were installed on top of the vessel. Dose rates during and after the operation were lower than expected; lessons were learned from the operation which will be applied to the continuing fuel removal operations activities.

  7. Pilot study of 68Ga-DOTA-F(ab?)2-trastuzumab in patients with breast cancer

    OpenAIRE

    Beylergil, Volkan; Morris, Patrick G.; Smith-Jones, Peter M.; Modi, Shanu; Solit, David; Hudis, Clifford A.; Lu, Yang; O?Donoghue, Joseph; Lyashchenko, Serge K.; Carrasquillo, Jorge A.; Larson, Steven M.; Akhurst, Timothy J.

    2013-01-01

    Objective 68Ga-1,4,7,10-Tetraazacyclododecane-N,N?,N??,N???-tetraacetic acid (DOTA)-F(ab?)2-trastuzumab [68Ga-DOTA-F(ab?)2-trastuzumab] has been developed at our institution as a positron imaging reagent for assessing human epidermal growth factor receptor 2 (HER2) expression status by in-vivo imaging. Initial studies on animals demonstrated promising results in the monitoring of treatment response to heat shock protein 90-targeted drugs that inhibit the client protein HER2. We report here ou...

  8. TMI-2 reactor vessel head removal

    International Nuclear Information System (INIS)

    Bengel, P.R.; Smith, M.D.; Estabrook, G.A.

    1984-12-01

    This report describes the safe removal and storage of the Three Mile Island Unit 2 reactor vessel head. The head was removed in July 1984 to permit the removal of the plenum and the reactor core, which were damaged during the 1979 accident. From July 1982, plans and preparations were made using a standard head removal procedure modified by the necessary precautions and changes to account for conditions caused by the accident. After data acquisition, equipment and structure modifications, and training the head was safely removed and stored and the internals indexing fixture and a work platform were installed on top of the vessel. Dose rates during and after the operation were lower than expected; lessons were learned from the operation which will be applied to the continuing fuel removal operations activities

  9. Decommissioning of reactor facilities (2). Required technology

    International Nuclear Information System (INIS)

    Yanagihara, Satoshi

    2014-01-01

    Decommissioning of reactor facilities was planned to perform progressive dismantling, decontamination and radioactive waste disposal with combination of required technology in a safe and economic way. This article outlined required technology for decommissioning as follows: (1) evaluation of kinds and amounts of residual radioactivity of reactor facilities with calculation and measurement, (2) decontamination technology of metal components and concrete structures so as to reduce worker's exposure and production of radioactive wastes during dismantling, (3) dismantling technology of metal components and concrete structures such as plasma arc cutting, band saw cutting and controlled demolition with mostly remote control operation, (3) radioactive waste disposal for volume reduction and reuse, and (4) project management of decommissioning for safe and rational work to secure reduction of worker's exposure and prevent the spreading of contamination. (T. Tanaka)

  10. TMI-2 reactor vessel head removal

    Energy Technology Data Exchange (ETDEWEB)

    Bengel, P.R.; Smith, M.D.; Estabrook, G.A.

    1984-12-01

    This report describes the safe removal and storage of the Three Mile Island Unit 2 reactor vessel head. The head was removed in July 1984 to permit the removal of the plenum and the reactor core, which were damaged during the 1979 accident. From July 1982, plans and preparations were made using a standard head removal procedure modified by the necessary precautions and changes to account for conditions caused by the accident. After data acquisition, equipment and structure modifications, and training the head was safely removed and stored and the internals indexing fixture and a work platform were installed on top of the vessel. Dose rates during and after the operation were lower than expected; lessons were learned from the operation which will be applied to the continuing fuel removal operations activities.

  11. Use of an anti-platelet monoclonal antibody F (ab')2 fragment for imaging thrombus

    International Nuclear Information System (INIS)

    Loutfi, I.; Stuttle, A.W.J.; Peters, A.M.; George, P.; Lavender, J.P.; Lumley, P.

    1990-01-01

    Ten patients with suspected thrombus have been studied using 111 In-labelled F (ab')2 fragments of P256, a monoclonal antibody which recognizes an epitope on the platelet membrane glycoprotein IIb/IIIa complex. The F (ab')2 fragment was radiolabelled with 111 In via diethylenetri-aminepentamacetic acid to give a specific activity of up to 190 MBq (5mCi) mg - 1 without impairment of immunoreactivity. In vitro platelet aggregation studies showed that the F (ab')2 fragment caused less platelet aggregation than the whole antibody on a molar ratio and was without significant effect upon the sensitivity of platelets to a range of aggregating agents. Platalets were labelled in ten patients by intravenous injection of approximately 100 μg P256 F (ab')2. Of the ten patients studies, six showed localization of activity consistent with platelet accumulation. Localization was clearly seen when associated with thrombus of the lower limbs (three patients: deep vein thrombosis; one patient: aortofemoral graft), and was apparent although less marked in two other cases, one of aortic aneurysm and one of carotid stenosis. Use of radiolabelled P256 F (ab')2 offers a means of non-invasive detection of thrombus which, from in vitro studies, would appear to have less direct effect of platelet behaviour than the whole antibody. (author). 9 refs. 8 figs. 1 tab

  12. The preparation of F(ab')2 fragment and it's application in tumor radioimmunoimaging

    International Nuclear Information System (INIS)

    Yang Ziyi

    1991-01-01

    Monoclonal antibody against lung cancer was digested into F(ab') 2 fragment by pepsin and papain digestion. The yields of pure F(ab') 2 were 32.3 ± 5.5% and 52.3 ± 12.0% respectively. The immunoreactivity of F(ab') 2 was based on the ELISA assay and the cell binding studies was retained well. In the localization experiments, radioiodinated F(ab') 2 was injected intraperitoneally into the nude mice bearing human xenografts of lung cancer. The highest radioactivity in tumors, 1.37% of injected dose per gram, was reached on the first day after injection; its T/NT ratios were higher than those of the intact IgG in all tissues except kidney. The localization index (LI) in tumors was 4.95, while the average LI value of normal tissues was 1.25. After the injection of 131 I-F(ab') 2 intraperitoneally into lung tumor-bearing nude mice, photo scintigraphy was performed at intervals of 12 hrs. The xenografts were visualized distinctly during 36 ∼ 48 hr, and the nonspecific background was very low at 48 hr

  13. EBR-2 [Experimental Breeder Reactor-2], IFR [Integral Fast Reactor] prototype testing programs

    International Nuclear Information System (INIS)

    Lehto, W.K.; Sackett, J.I.; Lindsay, R.W.; Planchon, H.P.; Lambert, J.D.B.

    1990-01-01

    The Experimental Breeder Reactor-2 (EBR-2) is a sodium cooled power reactor supplying about 20 MWe to the Idaho National Engineering Laboratory (INEL) grid and, in addition, is the key component in the development of the Integral Fast Reactor (IFR). EBR-2's testing capability is extensive and has seen four major phases: (1) demonstration of LMFBR power plant feasibility, (2) irradiation testing for fuel and material development. (3) testing the off-normal performance of fuel and plant systems and (4) operation as the IFR prototype, developing and demonstrating the IFR technology associated with fuel and plant design. Specific programs being carried out in support of the IFR include advanced fuels and materials development and component testing. This paper discusses EBR-2 as the IFR prototype and the associated testing programs. 29 refs

  14. Caracterização de compostos reduzidos de enxofre gerados na produção de celulose kraft e pré-hidrólise kraft.

    Directory of Open Access Journals (Sweden)

    Afonso Moraes de Moura

    2010-08-01

    Full Text Available Um problema ambiental da indústria de celulose kraft é o odor causado pela emissão dos compostos reduzidos de enxofre gerados pela deslignificação de madeiras de um modo em geral. Para monitorar essas emissões, existem equipamentos simples, desenvolvidos para a medição contínua do "total reduced sulphur" (TRS, tal como o analisador coulométrico. Neste trabalho, foram analisados sulfeto de hidrogênio (H2S, metil mercaptana (CH3SH, dimetil sulfeto [(CH32S] e dimetil dissulfeto [(CH32S2], gerados em deslignificações laboratoriais kraft e pré-hidrólise kraft de dois grupos de madeiras de folhosas. Um dos grupos de madeiras continha 25% e o outro 20% de lignina, base peso seco. Foi observado que as madeiras com menores teores de lignina geraram significativamente menores quantidades de compostos reduzidos de enxofre de TRS. Não foram notadas diferenças significativas nas quantidades totais geradas entre os processos de deslignificação estudados. O processo pré-hidrólise kraft foi mais sensível aos teores de lignina da madeira que o processo kraft. Recomenda-se, por isso, trabalhar com madeiras com menores teores de lignina quando do uso do processo pré-hidrólise kraft para produção de celulose. As principais formas geradas de TRS foram dimetil sulfeto e metil mercaptana.

  15. Composite tube cracking in kraft recovery boilers: A state-of-the-art review

    Energy Technology Data Exchange (ETDEWEB)

    Singbeil, D.L.; Prescott, R. [Pulp and Paper Research Inst. of Canada, Vancouver, British Columbia (Canada); Keiser, J.R.; Swindeman, R.W. [Oak Ridge National Lab., TN (United States)

    1997-07-01

    Beginning in the mid-1960s, increasing energy costs in Finland and Sweden made energy recovery more critical to the cost-effective operation of a kraft pulp mill. Boiler designers responded to this need by raising the steam operating pressure, but almost immediately the wall tubes in these new boilers began to corrode rapidly. Test panels installed in the walls of the most severely corroding boiler identified austenitic stainless steel as sufficiently resistant to the new corrosive conditions, and discussions with Sandvik AB, a Swedish tube manufacturer, led to the suggestion that coextruded tubes be used for water wall service in kraft recovery boilers. Replacement of carbon steel by coextruded tubes has solved most of the corrosion problems experienced by carbon steel wall tubes, however, these tubes have not been problem-free. Beginning in early 1995, a multidisciplinary research program funded by the US Department of Energy was established to investigate the cause of cracking in coextruded tubes and to develop improved materials for use in water walls and floors of kraft recovery boilers. One portion of that program, a state-of-the-art review of public- and private-domain documents related to coextruded tube cracking in kraft recovery boilers is reported here. Sources of information that were consulted for this review include the following: tube manufacturers, boiler manufacturers, public-domain literature, companies operating kraft recovery boilers, consultants and failure analysis laboratories, and failure analyses conducted specifically for this project. Much of the information contained in this report involves cracking problems experienced in recovery boiler floors and those aspects of spout and air-port-opening cracking not readily attributable to thermal fatigue. 61 refs.

  16. EBR-2 [Experimental Breeder Reactor-2] test programs

    International Nuclear Information System (INIS)

    Sackett, J.I.; Lehto, W.K.; Lindsay, R.W.; Planchon, H.P.; Lambert, J.D.B.; Hill, D.J.

    1990-01-01

    The Experimental Breeder Reactor-2 (EBR-2) is a sodium cooled power reactor supplying about 20 MWe to the Idaho National Engineering Laboratory (INEL) grid and, in addition, is the key component in the development of the Integral Fast Reactor (IFR). EBR-2's testing capability is extensive and has seen four major phases: (1) demonstration of LMFBR power plant feasibility, (2) irradiation testing for fuel and material development, (3) testing the off-normal performance of fuel and plant systems and (4) operation as the IFR prototype, developing and demonstrating the IFR technology associated with fuel and plant design. Specific programs being carried out in support of the IFR include advanced fuels and materials development, advanced control system development, plant diagnostics development and component testing. This paper discusses EBR-2 as the IFR prototype and the associated testing programs. 29 refs

  17. Little reactor that can, the bigger reactor that may be. [SLOWPOKE-2; 2 MW SLOWPOKE

    Energy Technology Data Exchange (ETDEWEB)

    Duffy, J.Q.

    1981-01-01

    The Slowpoke-2 research reactor and its marketing are featured, with an account of an interview with Dr. John Hilborn, designer. Also discussed is a scaled-up 2 MW version for space heating or small-scale district heating. The new version will rely on natural convection and inherent safety like Slowpoke, but will differ from it in many ways. The core will contain 200 kg of fuel elements with 5 percent enrichment. The new reactor lacks an upper beryllium reflector. Control will be by moving an annular beryllium reflector up and down. Inherent safety will be achieved through diminution of reactivity resulting from the onset of boiling. The article also mentions projected or actual use of small reactors for heating in the U.S.S.R. and France.

  18. Operating limits Hanford Production Reactors. Revision 2

    Energy Technology Data Exchange (ETDEWEB)

    Owsley, G.F. [comp.

    1963-05-20

    This report is applicable to the eight operating production reactors, B, C, D, DR, F, H, KE, and KW. It covers the following: operating parameter limitations; reactivity limitations; control and safety systems; reactor fuel loading; coolant requirements with irradiated fuel in reactor; reactor confinement; test facilities; code compliance; safety instrumentation and set points; and control criteria. Also discussed are administrative procedures for process control, training, audits and inspection, and reports and records.

  19. Ageing management of the BR2 research reactor

    International Nuclear Information System (INIS)

    Verpoortem, J. R.; Van Dyck, S.

    2014-01-01

    At the Belgian nuclear research centre (SCK.CEN) several test reactors are operated. Among these, Belgian Reactor 2 (BR2) is the largest Material Test Reactor (MTR). This water-cooled, beryllium moderated reactor with a maximum thermal power of 100 MW became operational in 1962. Except for two major refurbishment campaigns of one year each, this reactor has been operated continuously over the past 50 years, with a frequency of 5-12 cycles per year. At present, BR2 is used for different research activities, the production of medical isotopes, the production of n-doped silicon and various training and education activities. (Author)

  20. Loft CIS analysis 2''-LS-118-AB outside containment penetration S5-D

    International Nuclear Information System (INIS)

    Morton, D.K.

    1978-01-01

    A stress analysis was performed on the 2''-LS-118-AB pipe system outside containment penetration S5-D. Deadweight, thermal expansion, and seismic loads were considered. The results indicate that this piping will meet ASME Section III, Class 2 requirements provided a U-bolt (S4) is installed as indicated in this report

  1. Loft CIS analysis 2''-LS-118-AB outside containment penetration S5-D

    Energy Technology Data Exchange (ETDEWEB)

    Morton, D.K.

    1978-09-28

    A stress analysis was performed on the 2''-LS-118-AB pipe system outside containment penetration S5-D. Deadweight, thermal expansion, and seismic loads were considered. The results indicate that this piping will meet ASME Section III, Class 2 requirements provided a U-bolt (S4) is installed as indicated in this report.

  2. Adaptation of the ABS-S:2 for Use in Spain with Children with Intellectual Disabilities

    Science.gov (United States)

    Garcia Alonso, Isabel; De La Fuente Anuncibay, Raquel; Fernandez Hawrylak, Maria

    2010-01-01

    As there is a dearth of Spanish-language standardized scales that assess adaptive behavior in children and adolescents with intellectual disabilities (ID), the authors adapted one of the most widely used and studied scales of adaptive behavior in the U.S., the ABS-S:2 (Adaptive Behavior Scale-School, 2nd Edition), and validated it for use in…

  3. Understanding hydration of Zn(2+) in hydrothermal fluids with ab initio molecular dynamics

    NARCIS (Netherlands)

    Liu, X.; Lu, X.; Wang, R.; Meijer, E.J.

    2011-01-01

    With ab initio molecular dynamics simulations, the free-energy profiles of hydrated Zn2+ are calculated for both gaseous and aqueous systems from ambient to supercritical conditions, and from the derived free-energy information, the speciation of hydrated Zn2+ has been revealed. It is shown that the

  4. Polyvalent horse F(Ab`)2 snake antivenom: Development of process ...

    African Journals Online (AJOL)

    USER

    2010-04-19

    Apr 19, 2010 ... 2Laboratório de Biologia do Reconhecer, Centro de Biociencias e Biotecnologia, Universidade Estadual do Norte. Fluminense – Darcy Ribeiro, Campos dos ... Flow chromatography, concentrated by molecular ultrafiltration and sterilized by filtration through 0.22 μm membranes. The resulting F(ab´)2 ...

  5. Ab initio calculations of the ionization spectrum of SO2

    International Nuclear Information System (INIS)

    Zhang Yongfeng; Wang Meishan; Yang Chuanlu; Ma Meizhong; Pang Weixiu; Ma Rongcai

    2008-01-01

    The ionization spectrum of sulfur dioxide has been successfully studied by using the symmetry-adapted-cluster configuration-interaction (SAC-CI) general-R and SD-R methods and the basis set correlation-consistent polarized valence triple-zeta (cc-pVTZ). The SAC-CI general-R method reproduces the experimental spectrum well for both the main peaks and the satellite peaks of ionization spectrum of SO 2 . The sequence of ionic states corresponding to main peaks of SO 2 has been re-determined according to the SAC-CI conclusions and it is reordered as X-bar 2 A 1 , Ã 2 B 2 , B-bar 2 A 2 , C-bar 2 B 1 , D-bar 2 A 1 , Ē 2 B 2 and F-bar 2 A 1 . Besides, the equilibrium structures and adiabatic ionization potentials (AIPs) of ionic states of main peaks of SO 2 are calculated by using the SAC-CI SD-R method. (atomic and molecular physics)

  6. BR2 reactor: medical and industrial applications

    International Nuclear Information System (INIS)

    Ponsard, B.

    2005-01-01

    The radioisotopes are produced for various applications in the nuclear medicine (diagnostic, therapy, palliation of metastatic bone pain), industry (radiography of welds, ...), agriculture (radiotracers, ...) and basic research. Due to the availability of high neutron fluxes (thermal neutron flux up to 10 15 n/cm 2 .s), the BR2 reactor is considered as a major facility through its contribution for a continuous supply of products such 99 Mo ( 99 mTc), 131 I, 133 Xe, 192 Ir, 186 Re, 153 Sm, 90 Y, 32 P, 188 W ( 188 Re), 203 Hg, 82 Br, 41 Ar, 125 I, 177 Lu, 89 Sr, 60 Co, 169 Yb, 147 Nd, and others. Neutron Transmutation Doped (NTD) silicon is produced for the semiconductor industry in the SIDONIE (Silicon Doping by Neutron Irradiation Experiment) facility, which is designed to continuously rotate and traverse the silicon through the neutron flux. These combined movements produce exceptional dopant homogeneity in batches of silicon measuring 4 and 5-inches in diameter by up to 750 mm in length. The main objectives of work performed were to provide a reliable and qualitative supply of radioisotopes and NTD-silicon to the customers in accordance with a quality system that has been certified to the requirements of the EN ISO 9001: 2000. This new Quality System Certificate has been obtained in November 2003 for the Production of radioisotopes for medical and industrial applications and the Production of Neutron Transmutation Doped (NTD) Silicon in the BR2 reactor

  7. The Mechanochemical Cycle of Mammalian Kinesin-2 KIF3A/B under Load.

    Science.gov (United States)

    Andreasson, Johan O L; Shastry, Shankar; Hancock, William O; Block, Steven M

    2015-05-04

    The response of motor proteins to external loads underlies their ability to work in teams and determines the net speed and directionality of cargo transport. The mammalian kinesin-2, KIF3A/B, is a heterotrimeric motor involved in intraflagellar transport and vesicle motility in neurons. Bidirectional cargo transport is known to result from the opposing activities of KIF3A/B and dynein bound to the same cargo, but the load-dependent properties of kinesin-2 are poorly understood. We used a feedback-controlled optical trap to probe the velocity, run length, and unbinding kinetics of mouse KIF3A/B under various loads and nucleotide conditions. The kinesin-2 motor velocity is less sensitive than kinesin-1 to external forces, but its processivity diminishes steeply with load, and the motor was observed occasionally to slip and reattach. Each motor domain was characterized by studying homodimeric constructs, and a global fit to the data resulted in a comprehensive pathway that quantifies the principal force-dependent kinetic transitions. The properties of the KIF3A/B heterodimer are intermediate between the two homodimers, and the distinct load-dependent behavior is attributable to the properties of the motor domains and not to the neck linkers or the coiled-coil stalk. We conclude that the force-dependent movement of KIF3A/B differs significantly from conventional kinesin-1. Against opposing dynein forces, KIF3A/B motors are predicted to rapidly unbind and rebind, resulting in qualitatively different transport behavior from kinesin-1. Copyright © 2015 Elsevier Ltd. All rights reserved.

  8. A multi-criteria decision analysis of management alternatives for anaerobically digested kraft pulp mill sludge.

    Directory of Open Access Journals (Sweden)

    Martijn Eikelboom

    Full Text Available The Multi-Criteria Decision Analysis (MCDA procedure was used to compare waste management options for kraft pulp mill sludge following its anaerobic digestion. Anaerobic digestion of sludge is advantageous because it produces biogas that may be used to generate electricity, heat and biofuels. However, adequate management of the digested sludge is essential. Landfill disposal is a non-sustainable waste management alternative. Kraft pulp mill digested sludge applied to land may pose risks to the environment and public health if the sludge has not been properly treated. This study is aimed to compare several recycling alternatives for anaerobically digested sludge from kraft pulp mills: land application, landfill disposal, composting, incineration, pyrolysis/gasification, and biofuel production by algae. The MCDA procedure considered nine criteria into three domains to compare digested sludge recycling alternatives in a kraft pulp mill: environmental (CO2 emission, exposure to pathogens, risk of pollution, material and energy recovery, economic (overall costs, value of products and technical (maintenance and operation, feasibility of implementation. The most suitable management options for digested sludge from kraft pulp mills were found to be composting and incineration (when the latter was coupled with recycling ash to the cement industry. Landfill disposal was the worst option, presenting low performance in feasibility of implementation, risk of pollution, material and energy recovery.

  9. Papermaking Properties of Carpinus betulus with kraft, Soda and Soda-Urea Pulping Processes

    Directory of Open Access Journals (Sweden)

    Rasoul Darstan

    2013-06-01

    Full Text Available This research was carried out in order to comparatively investigate the hornbeam kraft, soda and soda-urea papermaking properties. The selected treatment in kraft process had an average yield of 44.43% and kappa number of 23.75. In soda process the selected treatment had an average yield of 38.75% and kappa number of 19.28. In soda-urea process, the selected treatments had an average yield of 39.85, 40.1, 40.5, 39.8 and 40.61 and kappa number of 21.21, 22.33, 22.66, 25.28 and 26.85. After refining the selected pulp to reach the freeness of 400±25 ml CSF, 60 g/m2 handsheets were made and physical, mechanical and optical properties were measured. Results showed that kraft pulps had higher yield and better refinability than soda and soda-urea pulps. Papers made from kraft process had higher strength properties than those made of soda and soda-urea process. With addition of urea, yield and kappa number of pulps increased. The highest improvement in tensile index, breaking length and tear index was achieved with addition of 3% urea and the highest improvement in burst index was achieved with adding 4% urea. Results of brightness measurements showed that papers from kraft and soda processes had the lowest and highest brightness degree respectively. With the addition of urea, brightness of papers decreased.

  10. A multi-criteria decision analysis of management alternatives for anaerobically digested kraft pulp mill sludge

    Science.gov (United States)

    Eikelboom, Martijn; Lopes, Alice do Carmo Precci; Silva, Claudio Mudadu; Rodrigues, Fábio de Ávila; Zanuncio, José Cola

    2018-01-01

    The Multi-Criteria Decision Analysis (MCDA) procedure was used to compare waste management options for kraft pulp mill sludge following its anaerobic digestion. Anaerobic digestion of sludge is advantageous because it produces biogas that may be used to generate electricity, heat and biofuels. However, adequate management of the digested sludge is essential. Landfill disposal is a non-sustainable waste management alternative. Kraft pulp mill digested sludge applied to land may pose risks to the environment and public health if the sludge has not been properly treated. This study is aimed to compare several recycling alternatives for anaerobically digested sludge from kraft pulp mills: land application, landfill disposal, composting, incineration, pyrolysis/gasification, and biofuel production by algae. The MCDA procedure considered nine criteria into three domains to compare digested sludge recycling alternatives in a kraft pulp mill: environmental (CO2 emission, exposure to pathogens, risk of pollution, material and energy recovery), economic (overall costs, value of products) and technical (maintenance and operation, feasibility of implementation). The most suitable management options for digested sludge from kraft pulp mills were found to be composting and incineration (when the latter was coupled with recycling ash to the cement industry). Landfill disposal was the worst option, presenting low performance in feasibility of implementation, risk of pollution, material and energy recovery. PMID:29298296

  11. Ab Initio and Phenomenological Modeling of the Phonon Spectrum of Superhard cp-BC2N

    Science.gov (United States)

    Basalaev, Yu. M.; Kopytov, A. V.; Pavlova, T. Yu.; Poplavnoi, A. S.

    2015-11-01

    The phonon spectrum of hypothetical superhard cp-BC2N is calculated based on ab initio method of density functional in the center of the Brillouin zone and interpolated over the entire Brillouin zone using the Keating phenomenological model. The interaction parameters are determined by optimization of the IR- and Ramanactive frequencies for a phenomenological model by their comparison with the results of ab initio calculations. Numerical values of short-range interaction constants and charges are in agreement with the characteristics of the chemical bond calculated ab initio. These parameters have transparent physical meaning and chemical nature and can further be used for both qualitative estimations of any physical and physico-chemical quantities and quantitative calculations of the phonon spectra of a number of isostructural compounds. The Keating phenomenological model is used to study the genesis of the phonon spectrum from the spectra of sublattices.

  12. Anti-NKG2D mAb

    DEFF Research Database (Denmark)

    Vadstrup, Kasper; Bendtsen, Flemming

    2017-01-01

    with a wide range of cell types and proteins involved. Natural Killer Group 2D (NKG2D) is an activating receptor constitutively expressed on human Natural Killer (NK), γδ T, mucosal-associated invariant T (MAIT), CD56⁺ T, and CD8⁺ T cells. Activation of NKG2D triggers cellular proliferation, cytokine...... production, and target cell killing. Research into the NKG2D mechanism of action has primarily been focused on cancer and viral infections where cytotoxicity evasion is a concern. In human inflammatory bowel disease (IBD) this system is less characterized, but the ligands have been shown to be highly...... expressed during intestinal inflammation and the following receptor activation may contribute to tissue degeneration. A recent phase II clinical trial showed that an antibody against NKG2D induced clinical remission of CD in some patients, suggesting NKG2D and its ligands to be of importance...

  13. Homogeneous SLOWPOKE reactors for replacing SLOWPOKE-2 research reactors and the production of radioisotopes

    Energy Technology Data Exchange (ETDEWEB)

    Bonin, H.W., E-mail: bonin-h@rmc.ca [Royal Military College of Canada, Kingston, Ontario (Canada); Hilborn, J.W. [Canadian Nuclear Laboratories, Chalk River, Ontario (Canada); Carlin, G.E. [Ontario Power Generation, Toronto, Ontario (Canada); Gagnon, R.; Busatta, P. [Canadian Forces (Canada)

    2014-07-01

    Inspired from the inherently safe SLOWPOKE-2 research reactor, the Homogeneous SLOWPOKE reactor was conceived with a double goal: replacing the heterogeneous SLOWPOKE-2 reactors when they reach end-of-core life to continue their missions of neutron activation analysis and neutron radiography at universities, and to produce radioisotopes such as {sup 99}Mo for medical applications. A homogeneous reactor core allows a much simpler extraction of radioisotopes (such as {sup 99}Mo) for applications in industry and nuclear medicine. The 20 kW Homogeneous SLOWPOKE reactor was modelled using both the deterministic WIMS-AECL and the probabilistic MCNP 5 reactor simulation codes. The homogeneous fuel mixture was a dilute aqueous solution of Uranyl Sulfate (UO{sub 2}SO{sub 4}) with 994.2 g of {sup 235}U (enrichment at 20%) providing an excess reactivity at operating temperature (40 {sup o}C) of 3.8 mk for a molality determined as 1.46 mol kg{sup -1} for a Zircaloy-2 reactor vessel. Because this reactor is intended to replace the core of SLOWPOKE-2 reactors, the Homogeneous SLOWPOKE reactor core had a height about twice its diameter. The reactor could be controlled by mechanical absorber rods in the beryllium reflector, chemical control in the core, or a combination of both. The safety of the Homogeneous SLOWPOKE reactor was analysed for both normal operation and transient conditions. Thermal-hydraulics calculations used COMSOL Multiphysics and the results showed that natural convection was sufficient to ensure adequate reactor cooling in all situations. The most severe transient simulated resulted from a 5.87 mk step positive reactivity insertion to the reactor in operation at critical and at steady state at 20 {sup o}C. Peak temperature and power were determined as 83 {sup o}C and 546 kW, respectively, reached 5.1 s after the reactivity insertion. However, the power fell rapidly to values below 20 kW some 35 s after the peak and remained below that value thereafter. Both the

  14. Homogeneous SLOWPOKE reactors for replacing SLOWPOKE-2 research reactors and the production of radioisotopes

    International Nuclear Information System (INIS)

    Bonin, H.W.; Hilborn, J.W.; Carlin, G.E.; Gagnon, R.; Busatta, P.

    2014-01-01

    Inspired from the inherently safe SLOWPOKE-2 research reactor, the Homogeneous SLOWPOKE reactor was conceived with a double goal: replacing the heterogeneous SLOWPOKE-2 reactors when they reach end-of-core life to continue their missions of neutron activation analysis and neutron radiography at universities, and to produce radioisotopes such as 99 Mo for medical applications. A homogeneous reactor core allows a much simpler extraction of radioisotopes (such as 99 Mo) for applications in industry and nuclear medicine. The 20 kW Homogeneous SLOWPOKE reactor was modelled using both the deterministic WIMS-AECL and the probabilistic MCNP 5 reactor simulation codes. The homogeneous fuel mixture was a dilute aqueous solution of Uranyl Sulfate (UO 2 SO 4 ) with 994.2 g of 235 U (enrichment at 20%) providing an excess reactivity at operating temperature (40 o C) of 3.8 mk for a molality determined as 1.46 mol kg -1 for a Zircaloy-2 reactor vessel. Because this reactor is intended to replace the core of SLOWPOKE-2 reactors, the Homogeneous SLOWPOKE reactor core had a height about twice its diameter. The reactor could be controlled by mechanical absorber rods in the beryllium reflector, chemical control in the core, or a combination of both. The safety of the Homogeneous SLOWPOKE reactor was analysed for both normal operation and transient conditions. Thermal-hydraulics calculations used COMSOL Multiphysics and the results showed that natural convection was sufficient to ensure adequate reactor cooling in all situations. The most severe transient simulated resulted from a 5.87 mk step positive reactivity insertion to the reactor in operation at critical and at steady state at 20 o C. Peak temperature and power were determined as 83 o C and 546 kW, respectively, reached 5.1 s after the reactivity insertion. However, the power fell rapidly to values below 20 kW some 35 s after the peak and remained below that value thereafter. Both the temperature and void coefficients are

  15. Radiation protection at the RA Reactor in 1986, Part -2, RA reactor annual report

    International Nuclear Information System (INIS)

    Ninkovic, M.; Ajdacic, N.; Zaric, M.; Vukovic, Z.

    1986-01-01

    Radiation protection tasks which enable safe operation of the RA reactor, and are defined according the the legal regulations and IAEA safety recommendations are sorted into four categories in this report: (1) Control of the working environment, dosimetry at the RA reactor; (2) Radioactivity control in the vicinity of the reactor and meteorology measurements; (3) Collecting and treatment of fluid effluents; and (4) radioactive wastes, decontamination and actions. Each of the category is described as a separate annex of this report [sr

  16. The TRIGA reactor Frankfurt FRF 2, construction and present status

    International Nuclear Information System (INIS)

    Rossberg, D.; Wolf, G.; Bass, F.

    1980-01-01

    The reactor FR2 was planned to replace the old FR1 reactor at the Frankfurt University, which was shutdown due to a failure. The FR2 is a tank reactor; the core is divided into 2 parts. The 1 MW operational core was calculated to consist of about 70 fuel elements. The grid plates contain 110 fuel element positions, surplus positions are occupied by dummy elements filled with water. The core has 5 control rods, 4 of which have fuel element followers. The reactor plant including all protection facilities was completed in 1977. The fuel elements were delivered in 1978. The reactor has been ready for critical experiments, but the permission for the start-up was not granted. In 1980 was decided that the reactor was not going in operation. Preparations are being made to dismantle the reactor components and to re-use them elsewhere

  17. Cytotoxicity and binding profiles of activated Cry1Ac and Cry2Ab to three insect cell lines

    Science.gov (United States)

    While Cry1Ac has been known to bind with larval midgut proteins cadherin, APN (amino peptidase N), ALP (alkaline phosphatase) and ABCC2 (ATP-binding cassette transporter subfamily C2), little is known about the receptors of Cry2Ab. To provide a clue to the receptors of Cry2Ab, we tested the baselin...

  18. Non-adiabatic collisions in H + O2 system: An ab initio study

    Indian Academy of Sciences (India)

    WINTEC

    Abstract. An ab initio study on the low-lying potential energy surfaces of H+ + O2 system for different orientations (γ) of H+ have been undertaken employing the multi-reference configuration interaction. (MRCI) method and Dunning's cc-pVTZ basis set to examine their role in influencing the collision dyna- mics. Nonadiabatic ...

  19. Anti-GD2 mAb and Vorinostat synergize in the treatment of neuroblastoma

    NARCIS (Netherlands)

    Kroesen, M.; Bull, C.; Gielen, P.R.; Brok, I.C.; Armandari, I.; Wassink, M.; Looman, M.W.G.; Boon, L.; Brok, M.H.M.G.M. den; Hoogerbrugge, P.M.; Adema, G.J.

    2016-01-01

    Neuroblastoma (NBL) is a childhood malignancy of the sympathetic nervous system. For high-risk NBL patients, the mortality rate is still over 50%, despite intensive multimodal treatment. Anti-GD2 monoclonal antibody (mAB) in combination with systemic cytokine immunotherapy has shown clinical

  20. Safe dismantling of the SVAFO research reactors R2 and R2-0 in Sweden

    International Nuclear Information System (INIS)

    ARNOLD, Hans-Uwe; BROY, Yvonne; Dirk Schneider

    2017-01-01

    The R2 and R2-0 reactors were part of the Swedish government's research program on nuclear power from the early 1960's. Both reactors were shut down in 2005 following a decision by former operator Studsvik Nuclear AB. The decommissioning of the R2 and R2-0 reactors is divided into three phases. The first phase - awarded to AREVA - involved dismantling of the reactors and associated systems in the reactor pool, treatment of the disassembled components as well as draining, cleaning and emptying the pool. In the second phase, the pool structure itself will be dismantled, while removal of remaining reactor systems, treatment and disposal of materials and clean-up will be carried out in the third stage. The entire work is planned to be completed before the end of this decade. The paper describes the several steps of phase 1 - starting with the team building, followed by the dismantling operations and covers challenges encountered and lessons learned as well. The reactors consist of 5.400 kg aluminum, 6.000 kg stainless steel restraint structures as well as, connection elements of the mostly flanged components (1.000 kg). The most demanding - from a radiological point of view - was the R2-0 reactor that was limited to ∼ 1 m 3 construction volumes but with an extremely heterogeneous activation profile. Based on the calculated radiological entrance data and later sampling, nuclide vectors for both reactors depending on the real placement of the single component and on the material (aluminum and stainless steel) were created. Finally, for the highest activated component from R2 reactor, 85 Sv/h were measured. The dismantling principles - adopted on a safety point of view - were the following: The always protected base area of the ponds served as a flexible buffer area for waste components and packaging. Specific protections were also installed on the walls to protect them from mechanical stress which may occur during dismantling work. A specific work platform

  1. Treatment of Synthetic Wastewater Containing AB14 Pigment by Electrooxidation in both Pilot and Bench Scale Reactors

    Directory of Open Access Journals (Sweden)

    Jalal Basiri parsa

    2016-01-01

    Full Text Available The electrochemical oxidation process was used for the degradation of Acid Brown 14 in both bench and pilot scale reactors. The bench scale one with a working volume of 0.5 L was equipped with platinum plate used as the anode and stainless steel (SS-304 plates as the cathode. The pilot scale reactor had a volume of 9 L and was equipped with SS-304 plates used as both the anode and the cathode. Experiments were run using these reactors to investigate the two parameters of energy consumption and anode efficiency. The bench scale reactor was capable of removing 92% and 36% of the dye and COD, respectively, after 18 min of operation. The pilot scale reactor, however, was capable of removing 87% and 59% of the dye and the COD content, respectively, after 60 min of operation. The kinetic study of both the bench and pilot reactors for dye and COD removals showed that both processes followed a zero order kinetic.

  2. Effects of tertiary treatment by fungi on organic compounds in a kraft pulp mill effluent.

    Science.gov (United States)

    Rocha-Santos, Teresa; Ferreira, Filipe; Silva, Lurdes; Freitas, Ana Cristina; Pereira, Ruth; Diniz, Mário; Castro, Luísa; Peres, Isabel; Duarte, Armando Costa

    2010-05-01

    Pulp and paper mills generate a plethora of pollutants depending upon the type of pulping process. Efforts to mitigate the environmental impact of such effluents have been made by developing more effective biological treatment systems in terms of biochemical oxygen demand, chemical oxygen demand, colour and lignin content. This study is the first that reports an evaluation of the effects of a tertiary treatment by fungi (Pleurotus sajor caju, Trametes versicolor and Phanerochaete chrysosporium and Rhizopus oryzae) on individual organic compounds of a Eucalyptus globulus bleached kraft pulp and paper mill final effluent after secondary treatment (final effluent). The tertiary treatment with P. sajor caju, T. versicolor and P. chrysosporium and R. oryzae was performed in batch reactors, which were inoculated with separate fungi species and monitored throughout the incubation period. Samples from effluent after secondary and after tertiary treatment with fungi were analysed for both absorbance and organic compounds. The samples were extracted for organic compounds using solid-phase extraction (SPE) and analysed by gas chromatography-mass spectrometry (GC/MS). The efficiencies of the SPE procedure was evaluated by recovery tests. A total of 38 compounds (carboxylic acids, fatty alcohols, phenolic compounds and sterols) were identified and quantified in the E. globulus bleached kraft pulp mill final effluent after secondary treatment. Recoveries from the extraction procedure were between 98.2% and 99.9%. The four fungi species showed an adequate capacity to remove organic compounds and colour. Tertiary treatment with R. oryzae was able to remove 99% of organic compounds and to reduce absorbance on 47% (270 nm) and 74% (465 nm). P. sajor caju, T. versicolor and P. chrysosporium were able to remove 97%, 92% and 99% of organic compounds, respectively, and reduce 18% (270 nm) to 77% (465 nm), 39% (270 nm) to 58% (465 nm) and 31% (270 nm) to 10% (465 nm) of absorbance

  3. Resistance to Bacillus thuringiensis Toxin Cry2Ab in Trichoplusia ni Is Conferred by a Novel Genetic Mechanism

    Science.gov (United States)

    Song, Xiaozhao; Kain, Wendy; Cassidy, Douglas

    2015-01-01

    The resistance to the Bacillus thuringiensis (Bt) toxin Cry2Ab in a greenhouse-originated Trichoplusia ni strain resistant to both Bt toxins Cry1Ac and Cry2Ab was characterized. Biological assays determined that the Cry2Ab resistance in the T. ni strain was a monogenic recessive trait independent of Cry1Ac resistance, and there existed no significant cross-resistance between Cry1Ac and Cry2Ab in T. ni. From the dual-toxin-resistant T. ni strain, a strain resistant to Cry2Ab only was isolated, and the Cry2Ab resistance trait was introgressed into a susceptible laboratory strain to facilitate comparative analysis of the Cry2Ab resistance with the susceptible T. ni strain. Results from biochemical analysis showed no significant difference between the Cry2Ab-resistant and -susceptible T. ni larvae in midgut proteases, including caseinolytic proteolytic activity and zymogram profile and serine protease activities, in midgut aminopeptidase and alkaline phosphatase activity, and in midgut esterases and hemolymph plasma melanization activity. For analysis of genetic linkage of Cry2Ab resistance with potential Cry toxin receptor genes, molecular markers for the midgut cadherin, alkaline phosphatase (ALP), and aminopeptidase N (APN) genes were identified between the original greenhouse-derived dual-toxin-resistant and the susceptible laboratory T. ni strains. Genetic linkage analysis showed that the Cry2Ab resistance in T. ni was not genetically associated with the midgut genes coding for the cadherin, ALP, and 6 APNs (APN1 to APN6) nor associated with the ABC transporter gene ABCC2. Therefore, the Cry2Ab resistance in T. ni is conferred by a novel but unknown genetic mechanism. PMID:26025894

  4. Anti-NKG2D mAb

    DEFF Research Database (Denmark)

    Vadstrup, Kasper; Bendtsen, Flemming

    2017-01-01

    production, and target cell killing. Research into the NKG2D mechanism of action has primarily been focused on cancer and viral infections where cytotoxicity evasion is a concern. In human inflammatory bowel disease (IBD) this system is less characterized, but the ligands have been shown to be highly......Crohn's disease (CD) and ulcerative colitis (UC) are immunologically-mediated, debilitating conditions resulting from destructive inflammation of the gastrointestinal tract. The pathogenesis of IBD is incompletely understood, but is considered to be the result of an abnormal immune response...

  5. Ab initio modeling of 2D layered organohalide lead perovskites

    Energy Technology Data Exchange (ETDEWEB)

    Fraccarollo, Alberto; Cantatore, Valentina; Boschetto, Gabriele; Marchese, Leonardo; Cossi, Maurizio, E-mail: maurizio.cossi@uniupo.it [Dipartimento di Scienze e Innovazione Tecnologica (DISIT), Università del Piemonte Orientale, via T. Michel 11, I-15121 Alessandria (Italy)

    2016-04-28

    A number of 2D layered perovskites A{sub 2}PbI{sub 4} and BPbI{sub 4}, with A and B mono- and divalent ammonium and imidazolium cations, have been modeled with different theoretical methods. The periodic structures have been optimized (both in monoclinic and in triclinic systems, corresponding to eclipsed and staggered arrangements of the inorganic layers) at the DFT level, with hybrid functionals, Gaussian-type orbitals and dispersion energy corrections. With the same methods, the various contributions to the solid stabilization energy have been discussed, separating electrostatic and dispersion energies, organic-organic intralayer interactions and H-bonding effects, when applicable. Then the electronic band gaps have been computed with plane waves, at the DFT level with scalar and full relativistic potentials, and including the correlation energy through the GW approximation. Spin orbit coupling and GW effects have been combined in an additive scheme, validated by comparing the computed gap with well known experimental and theoretical results for a model system. Finally, various contributions to the computed band gaps have been discussed on some of the studied systems, by varying some geometrical parameters and by substituting one cation in another’s place.

  6. Kraft pulping of industrial wood waste

    Science.gov (United States)

    Aziz. Ahmed; Masood. Akhtar; Gary C. Myers; Gary M. Scott

    1998-01-01

    Most of the approximately 25 to 30 million tons of industrial wood waste generated in the United States per year is burned for energy and/or landfilled. In this study, kraft pulp from industrial wood waste was evaluated and compared with softwood (loblolly pine, Douglas-fir) and hardwood (aspen) pulp. Pulp bleachability was also evaluated. Compared to loblolly pine...

  7. Ground beetle populations near a kraft mill

    Energy Technology Data Exchange (ETDEWEB)

    Freitag, R.; Hastings, L.; Mercer, W.R.; Smith, A.

    1973-02-01

    Twenty species of ground beetles (Family Carabidae) and one species of carrion beetle (Family Silphidae) were collected in six stations east of a kraft paper mill in Thunder Bay, Ontario, from May to August, 1971. The beetle population decreased markedly towards the mill. There was no apparent statistical difference in size variation of specimens near the mill and those further away.

  8. Biochemical methane potential of kraft bleaching effluent and codigestion with other in-mill streams

    DEFF Research Database (Denmark)

    Fitamo, Temesgen Mathewos; Dahl, Olli; Master, Emma

    2016-01-01

    A biochemical methane potential assay was conducted to investigate the anaerobic digestibility of bleaching effluent from hardwood kraft pulping and the potential of codigestion with other effluents from an integrated pulp and paper mill. Four in-mill streams were tested individually and in combi......A biochemical methane potential assay was conducted to investigate the anaerobic digestibility of bleaching effluent from hardwood kraft pulping and the potential of codigestion with other effluents from an integrated pulp and paper mill. Four in-mill streams were tested individually...... of anaerobic inhibitors such as adsorbable organic halogens (36 mg/L), total sulfur (170 mg/L), and resin and fatty acids (3.2 mg/L). Therefore, the total bleaching effluent from hardwood kraft pulping may be considered for full-scale anaerobic wastewater treatment, either as a singular stream or as part...... of a composite stream including other in-mill effluents....

  9. Superficial effects during the activation of zirconium AB2 alloys

    International Nuclear Information System (INIS)

    Zerbino, J; Visitin, A; Triaca, W

    2005-01-01

    The activation of zirconium nickel alloys with and without the addition of chromium and titanium is investigated through electrochemical and optical techniques.These alloys show high hydrogen absorption capacity and are extensively used in metal hydride batteries.Recent investigations in aqueous 1 M KOH indicate oxide layer growth and occlusion of hydrogen species in the alloys during the application of different cathodic potential programmes currently used in the activation process.In this research several techniques such as voltammetry, ellipsometry, energy dispersive analysis of X-rays EDAX, and scanning electron microscopy SEM are applied on the polished massive alloy Zr 1 -xTi x , x=0.36 y 0.43, and Zr 1 -xTi x CrNi, x=0.1,0.2 y 0.4.Data analysis shows that the stability, compactness and structure of the passive layers are strongly dependent on the applied potential programme.The alloy activation depends on the formation of deepen crevices that remain after a new polishing. Microscopic observation shows increase in the crevices thickness after the cathodic sweep potential cycling, which produces fragmentation of the grains and oxide growth during the activation process.This indicates metal breaking and intergranular dissolution that take place together with oxide and hydride formation.In some cases the resultant crevice thickness is one or two orders higher than that of the superficial oxide growth indicating intergranular localised corrosion

  10. IL-2/anti-IL-2 mAb immunocomplexes: A renascence of IL-2 in cancer immunotherapy?

    Czech Academy of Sciences Publication Activity Database

    Tomala, Jakub; Kovář, Marek

    2016-01-01

    Roč. 5, č. 3 (2016), e1102829 ISSN 2162-402X R&D Projects: GA ČR GA13-12885S; GA MŠk(CZ) ED1.1.00/02.0109 Institutional support: RVO:61388971 Keywords : Anti-IL-2 mAb * cancer immunotherapy * IL-2 Subject RIV: EE - Microbiology, Virology Impact factor: 7.719, year: 2016

  11. A comparative ab initio study of Br2*- and Br2 water clusters.

    Science.gov (United States)

    Pathak, A K; Mukherjee, T; Maity, D K

    2006-01-14

    The work presents ab initio results on structure and electronic properties of Br2*-.nH2O(n=1-10) and Br2.nH2O(n=1-8) hydrated clusters to study the effects of an excess electron on the microhydration of the halide dimer. A nonlocal density functional, namely, Becke's half-and-half hybrid exchange-correlation functional is found to perform well on the present systems with a split valence 6-31++G(d,p) basis function. Geometry optimizations for all the clusters are carried out with several initial guess structures and without imposing any symmetry restriction. Br2*-.nH2O clusters prefer to have symmetrical double hydrogen-bonding structures. Results on Br2.nH2O(n>or=2) cluster show that the O atom of one H2O is oriented towards one Br atom and the H atom of another H2O is directed to other Br atom making Br2 to exist as Br+-Br- entity in the cluster. The binding and solvation energies are calculated for the Br2*-.nH2O and Br2.nH2O clusters. Calculations of the vibrational frequencies show that the formation of Br2*- and Br2 water clusters induces significant shifts from the normal modes of isolated water. Excited-state calculations are carried out on Br2*-.nH2O clusters following configuration interaction with single electron excitation procedure and UV-VIS absorption profiles are simulated. There is an excellent agreement between the present theoretical UV-VIS spectra of Br2*-.10H2O cluster and the reported transient optical spectra for Br2*- in aqueous solution.

  12. VOC Control in Kraft Mills; FINAL

    International Nuclear Information System (INIS)

    Zhu, J.Y.; Chai, X.-S.; Edwards, L.L.; Gu, Y.; Teja, A.S.; Kirkman, A.G.; Pfromm, P.H.; Rezac, M.E.

    2001-01-01

    The formation of volatile organic compounds (VOCs), such as methanol, in kraft mills has been an environmental concern. Methanol is soluble in water and can increase the biochemical oxygen demand. Furthermore, it can also be released into atmosphere at the process temperatures of kraft mill-streams. The Cluster Rule of the EPA now requires the control of the release of methanol in pulp and paper mills. This research program was conducted to develop a computer simulation tool for mills to predict VOC air emissions. To achieve the objective of the research program, much effort was made in the development of analytical techniques for the analysis of VOC and determination of vapor liquid partitioning coefficient of VOCs in kraft mill-streams using headspace gas chromatography. With the developed analytical tool, methanol formation in alkaline pulping was studied in laboratory to provide benchmark data of the amount of methanol formation in pulping in kraft mills and for the validation of VOC formation and vapor-liquid equilibrium submodels. Several millwide air and liquid samplings were conducted using the analytical tools developed to validate the simulation tool. The VOC predictive simulation model was developed based on the basic chemical engineering concepts, i.e., reaction kinetics, vapor liquid equilibrium, combined with computerized mass and energy balances. Four kraft mill case studies (a continuous digester, two brownstock washing lines, and a pre-evaporator system) are presented and compared with mill measurements. These case studies provide valuable, technical information for issues related to MACT I and MACT II compliance, such as condensate collection and Clean-Condensate-Alternatives (CCA)

  13. Ab initio treatment of the chemical reaction precursor complex Br(2P)-HCN. 1. Adiabatic and diabatic potential surfaces

    NARCIS (Netherlands)

    Fishchuk, A.V.; Merritt, J.M.; Avoird, A. van der

    2007-01-01

    The three adiabatic potential surfaces of the Br(P-2)-HCN complex that correlate to the P-2 ground state of the Br atom were calculated ab initio. With the aid of a geometry-dependent diabatic mixing angle, also calculated ab initio, these adiabatic potential surfaces were transformed into a set of

  14. Utilization of the SLOWPOKE-2 research reactor

    International Nuclear Information System (INIS)

    Lalor, G.C.

    2001-01-01

    SLOWPOKEs are typically low power research reactors that have a limited number of applications. However, a significant range of NAA can be performed with such reactors. This paper describes a SLOWPOKE-based NAA program that is performing a valuable series of studies in Jamaica, including geological mapping and pollution assessment. (author)

  15. History of radiological characterisation in Studsvik - History of radiological characterisation in decommissioning projects in Studsvik

    International Nuclear Information System (INIS)

    Hedvall, Robert

    2012-01-01

    AB SVAFO is a nuclear waste technology and decommissioning company based in Sweden in the scenic surroundings of Studsvik on the Baltic coast. SVAFO is owned by the Swedish nuclear power industry. The company was created in 1992 by Sydsvenska Vaermekraft AB, Vattenfall AB, Forsmarks Kraftgrupp AB and Oskarshamns Kraftgrupp AB as a consequence of the Act on the Financing of the Management of Certain Radioactive Waste etc, from 1988. AB SVAFO's main business is to take care of formerly state-owned spent nuclear waste at the site, including small amounts of nuclear fuel. Buildings are also included, mainly nuclear waste storage buildings and a research reactor. Some buildings have already been decommissioned and all the fuel is treated. In the past 30 years, various decommissioning projects have been carried out, encompassing areas such as an underground research reactor, a Van de Graaff accelerator, 15,000 m 2 of nuclear laboratories, two 150 m 3 underground concrete sludge silos and several waste-storage buildings. Up till now only one or two persons did a simple characterisation before the project started to get the level of contamination. With the start of the decommissioning of the former uranium mine in Ranstad and the R2-reactor, more efforts have been put for the characterisation. The change in methods will be described. (author)

  16. Pressurized water reactor simulator. Workshop material. 2. ed

    International Nuclear Information System (INIS)

    2005-01-01

    The International Atomic Energy Agency (IAEA) has established an activity in nuclear reactor simulation computer programs to assist its Member States in education. The objective is to provide, for a variety of advanced reactor types, insight and practice in their operational characteristics and their response to perturbations and accident situations. To achieve this, the IAEA arranges for the development and distribution of simulation programs and educational material and sponsors courses and workshops. The workshops are in two parts: techniques and tools for reactor simulator development. And the use of reactor simulators in education. Workshop material for the first part is covered in the IAEA Training Course Series No. 12, 'Reactor Simulator Development' (2001). Course material for workshops using a WWER- 1000 reactor department simulator from the Moscow Engineering and Physics Institute, the Russian Federation is presented in the IAEA Training Course Series No. 21, 2nd edition, 'WWER-1000 Reactor Simulator' (2005). Course material for workshops using a boiling water reactor simulator developed for the IAEA by Cassiopeia Technologies Incorporated of Canada (CTI) is presented in the IAEA publication: Training Course Series No.23, 2nd edition, 'Boiling Water Reactor Simulator' (2005). This report consists of course material for workshops using a pressurized water reactor simulator

  17. Ab initio theory of the N2V defect in diamond for quantum memory implementation

    Science.gov (United States)

    Udvarhelyi, Péter; Thiering, Gergő; Londero, Elisa; Gali, Adam

    2017-10-01

    The N2V defect in diamond is characterized by means of ab initio methods relying on density functional theory calculated parameters of a Hubbard model Hamiltonian. It is shown that this approach appropriately describes the energy levels of correlated excited states induced by this defect. By determining its critical magneto-optical parameters, we propose to realize a long-living quantum memory by N2V defect, i.e., H 3 color center in diamond.

  18. Upgrading of the research reactors FRG-1 and FRG-2

    International Nuclear Information System (INIS)

    Krull, W.

    1981-01-01

    In 1972 for the research reactor FRG-2 we applied for a license to increase the power from 15 MW to 21 MW. During this procedure a public laying out of the safety report and an upgrading procedure for both research reactors - FRG-1 (5 MW) and FRG-2 - were required by the licensing authorities. After discussing the legal background for licensing procedures in the Federal Republic of Germany the upgrading for both research reactors is described. The present status and future licensing aspects for changes of our research reactors are discussed, too. (orig.) [de

  19. The SLOWPOKE-2 reactor with low enrichment uranium oxide fuel

    International Nuclear Information System (INIS)

    Townes, B.M.; Hilborn, J.W.

    1985-06-01

    A SLOWPOKE-2 reactor core contains less than 1 kg of highly enriched uranium (HEU) and the proliferation risk is very low. However, to overcome proliferation concerns a new low enrichment uranium (LEU) fuelled reactor core has been designed. This core contains approximately 180 fuel elements based on the Zircaloy-4 clad UOsub(2) CANDU fuel element, but with a smaller outside diameter. The physics characteristics of this new reactor core ensure the inherent safety of the reactor under all conceivable conditions and thus the basic SLOWPOKE safety philosophy which permits unattended operation is not affected

  20. Synthesis and characterization of kraft lignin-based epoxy resins

    OpenAIRE

    El Mansouri, Nour-Eddine; Yuan, Qiaolong; Huang, Farong

    2011-01-01

    Epoxidization is an interesting way to develop a new application of lignin and therefore to improve its application potential. In this work, kraft lignin-based epoxy resins were obtained by the epoxidization reaction, using the kraft lignin recovered directly from pulping liquor and modified by a methylolation reaction. The methylolated lignins were obtained by the reaction of original kraft lignin with formaldehyde and glyoxal, which is a less volatile and less toxic aldehyde. 1H-NMR spectro...

  1. Preliminary Validation for the Adaptative Behavior Scale ABS-RC:2 in Spain

    OpenAIRE

    Medina-Gómez, Ma.; García-Alonso, Ma.; Cernuda, Virginia

    2017-01-01

    In this study, psychometric properties of scale ABS-RC:2 in a Spanish context are analyzed. This scale assesses adaptive behavior in adults with intellectual disabilities to determine their diagnosis, classification and supportive needs. The scale was applied to 198 Spanish with intellectual disabilities between the ages of 18-69 (M=41, 8 DE=11, 7). First, the internal consistency was analyzed by Cronbachs Alpha. Pearsons correlation to obtain test-raters indexes, inter-raters, the criterion ...

  2. Anticomplementary Activity of Horse IgG and F(ab')2 Antivenoms

    OpenAIRE

    Squaiella-Baptistão, Carla Cristina; Marcelino, José Roberto; Ribeiro da Cunha, Luiz Eduardo; Gutiérrez, José María; Tambourgi, Denise V.

    2014-01-01

    2094-01 Embargo por política editorial Envenomation by poisonous animals is a neglected condition according to the World Health Organization (WHO). Antivenoms are included in the WHO Essential Medicines List. It has been assumed that immunoglobulin G (IgG) antivenoms could activate the complement system through Fc and induce early adverse reactions (EARs). However, data in the literature indicate that F(ab')2 fragments can also activate the complement system. Herein, we show that several b...

  3. Production and purification of polyclonal antibody against F(ab')2 fragment of human immunoglobulin G

    OpenAIRE

    Nasiri, Hadi; Valedkarimi, Zahra; Aghebati-Maleki, Leili; Abdolalizadeh, Jalal; Kazemi, Tohid; Esparvarinha, Mojghan; Majidi, Jafar

    2017-01-01

    Antibodies are essential tools of biomedical and biochemical researches. Polyclonal antibodies are produced against different epitopes of antigens. Purified F(ab')2 can be used for animal’s immunization to produce polyclonal antibodies. Human immunoglobulin G (IgG) was purified by ion exchange chromatography method. In all stages verification method of the purified antibodies was sodium dodecyl sulfate-polyacrylamide gel electrophoresis (SDS-PAGE). Purified IgG was digested by pepsin enzyme a...

  4. Annual report on JEN-1 and JEN-2 Reactors

    International Nuclear Information System (INIS)

    Montes Ponce de Leon, J.

    1974-01-01

    In the annual report on the JEN-1 and JEN-2 reactors the main fractures of the reactor operations and maintenance are described. The reactor has been in operation for 2188 hours, what means 74% of the total working time. Maintenance and periodical tests have occupied the rest of the time. Maintenance operations are shown according to three main subjects, the main failures so as the reactor scrams are also described. Different date relating with radiation level and health Physics are also included. (Author)

  5. Polyoxometalate delignification of birch kraft pulp and effect on residual lignin

    Science.gov (United States)

    Biljana Bujanovic; Richard S. Reiner; Sally A. Ralph; Rajai H. Atalla

    2011-01-01

    To advance the understanding of delignification with polyoxometalates (POMs) that have been explored for use in bleaching of chemical pulps, the transformation of lignin during anaerobic treatment of birch kraft pulp with an equilibrated POM mixture composed of Na5(+2)[SiV1(-0.1)MoW10(+0.1)O

  6. Catalysis: A Potential Alternative to Kraft Pulping

    Science.gov (United States)

    Alan W. Rudie; Peter W. Hart

    2014-01-01

    A thorough analysis of the kraft pulping process makes it obvious why it has dominated for over a century as an industrial process with no replacement in sight. It uses low-cost raw materials; collects and regenerates over 90% of the chemicals needed in the process; and is indifferent to wood raw material and good at preserving the cellulose portion of the wood, the...

  7. Dry Kraft Pulping at Ambient Pressure for Cost Effective Energy Saving and Pollution Deduction

    Energy Technology Data Exchange (ETDEWEB)

    Yulin Deng; Art Ragauskas

    2012-08-28

    evaporated first under vacuum condition at low temperature. Then, the dry woodchips were baked at high temperature (120-130 C) at atmospheric pressure. The qualities of the pulp made with this method were improved compared to that made with method one. The pulp shows higher brightness and lower bulk than Kraft pulping. The tensile strength is significantly higher than the pulp made from the first method. Although the pulp is stronger than that of TMP pulp, it is still lower than conventional Kraft fiber. Method Three: The third dry method was done in a Kraft pulping digester at elevated pressure but without free liquid in the digester. With this method, pulp that has almost the same qualities as conventional Kraft pulp could be produced. The screen yield, Kappa number, fiber brightness, pulp strength and pulp bulk are almost identical to the conventional Kraft pulp. The key advantages of this dry pulping method include ca. 55 % of cooking energy saved during the pulping process, as high as 50 wt% of NaOH saving as well as 3 wt% of Na2S saving comparing to Kraft one. By analyzing fiber properties, yields, chemical and energy consumptions, we concluded that the dry pulping method based on Liquid Free Chemical Pulping, LFCP, could be very attractive for the pulp and paper industry. More fundamental studies and scale up trials are needed to fully commercialize the technology. We expect to conduct pilot trials between 12 to 24 months of period if the DOE or industry can provide continual research funding. Based on the technology we demonstrated in this report, several pilot trial facilities in the United States will be available after small modifications. For example, the Herty Foundation in Savannah, Georgia is one of these potential locations. DOE funding for continuous study and final lead to commercialization of the technique is important.

  8. HYLIFE-2 inertial confinement fusion reactor design

    Energy Technology Data Exchange (ETDEWEB)

    Moir, R.W.

    1990-10-04

    The HYLIFE-II inertial fusion power plant design study uses a liquid fall, in the form of jets to protect the first structural wall from neutron damage, x-rays, and blast to provide a 30-y lifetime. HYLIFE-I used liquid lithium. HYLIFE-II avoids the fire hazard of lithium by using a molten salt composed of fluorine, lithium, and beryllium (Li{sub 2}BeF{sub 4}) called Flibe. Access for heavy-ion beams is provided. Calculations for assumed heavy-ion beam performance show a nominal gain of 70 at 5 MJ producing 350 MJ, about 5.2 times less yield than the 1.8 GJ from a driver energy of 4.5 MJ with gain of 400 for HYLIFE-I. The nominal 1 GWe of power can be maintained by increasing the repetition rate by a factor of about 5.2, from 1.5 to 8 Hz. A higher repetition rate requires faster re-establishment of the jets after a shot, which can be accomplished in part by decreasing the jet fall height and increasing the jet flow velocity. Multiple chambers may be required. In addition, although not considered for HYLIFE-I, there is undoubtedly liquid splash that must be forcibly cleared because gravity is too slow, especially at high repetition rates. Splash removal can be accomplished by either pulsed or oscillating jet flows. The cost of electricity is estimated to be 0.09$/kW{center dot}h in constant 1988 dollars, about twice that of future coal and light water reactor nuclear power. The driver beam cost is about one-half the total cost. 12 refs., 9 figs., 5 tabs.

  9. Simple synthesis, structure and ab initio study of 1,4-benzodiazepine-2,5-diones

    Science.gov (United States)

    Jadidi, Khosrow; Aryan, Reza; Mehrdad, Morteza; Lügger, Thomas; Ekkehardt Hahn, F.; Ng, Seik Weng

    2004-04-01

    A simple procedure for the synthesis of pyrido[2,1-c][1,4] benzodiazepine-6,12-dione ( 1) and 1,4-benzodiazepine-2,5-diones ( 2a- 2d), using microwave irradiation and/or conventional heating is reported. The configuration of 1 was determined by single-crystal X-ray diffraction. A detailed ab initio B3LYP/6-31G* calculation of structural parameters and substituent effects on ring inversion barriers (Δ G#) and also free energy differences (Δ G0) for benzodiazepines are reported.

  10. ESTUDO DA ADIÇÃO DA LIGNINA KRAFT NAS PROPRIEDADES MECÂNICAS DOS BRIQUETES DE RESÍDUOS DA INDÚSTRIA MOVELEIRA

    Directory of Open Access Journals (Sweden)

    Adriana de Fátima Gomes Gouvêa

    2017-01-01

    Full Text Available In order to improve global effectiveness of energy production, a strategy is the model of bio-refineries in which all the components of biomass are totally used to produce a range of products with aggregated value. The kraft lignin is one of the products originated in the process of cellulose production that can be used in making densified products. The objective of this work was to evaluate the behavior of the addition of extracted kraft lignin of black kraft liquor in briquette manufactures with furniture industry waste, in the form of shavings and panel particles in different proportions. The briquettes were produced in laboratory briquetting, using the temperatures of 60, 75 and 90 o C. The pressing and cooling time was 5 minutes and pressure 68,9 x 10 5 N.m -2 (1000 PSI. The briquette quality was evaluated through determining the mechanical properties. The kraft lignin in adequate proportions and temperature showed advantages in the increase of resistance and the durability of the briquettes. The kraft lignin presented advantages such as agglutinative in briquette productions from wood waste at a pressing temperature of 90 o C with addition of 20% of kraft lignin, and at pressing temperatures of 60 and 75 o C at a proportion of addition of 40 and 60% of kraft lignin to wood waste, respectively.

  11. Ramsdellite-structured LiTiO 2: A new phase predicted from ab initio calculations

    Science.gov (United States)

    Koudriachova, M. V.

    2008-06-01

    A new phase of highly lithiated titania with potential application as an anode in Li-rechargeable batteries is predicted on the basis of ab initio calculations. This phase has a composition LiTiO2 and may be accessed through electrochemical lithiation of ramsdellite-structured TiO2 at the lowest potential reported for titanium dioxide based materials. The potential remains constant over a wide range of Li-concentrations. The new phase is metastable with respect to a tetragonally distorted rock salt structure, which hitherto has been the only known polymorph of LiTiO2.

  12. Comparative bacterial degradation and detoxification of model and kraft lignin from pulp paper wastewater and its metabolites

    Science.gov (United States)

    Abhishek, Amar; Dwivedi, Ashish; Tandan, Neeraj; Kumar, Urwashi

    2017-05-01

    Continuous discharge of lignin containing colored wastewater from pulp paper mill into the environment has resulted in building up their high level in various aquatic systems. In this study, the chemical texture of kraft lignin in terms of pollution parameters (COD, TOC, BOD, etc.) was quite different and approximately twofold higher as compared to model lignin at same optical density (OD 3.7 at 465 nm) and lignin content (2000 mg/L). For comparative bacterial degradation and detoxification of model and kraft lignin two bacteria Citrobacter freundii and Serratia marcescens were isolated, screened and applied in axenic and mixed condition. Bacterial mixed culture was found to decolorize 87 and 70 % model and kraft lignin (2000 mg/L), respectively; whereas, axenic culture Citrobacter freundii and Serratia marcescens decolorized 64, 60 % model and 50, 55 % kraft lignin, respectively, at optimized condition (34 °C, pH 8.2, 140 rpm). In addition, the mixed bacterial culture also showed the removal of 76, 61 % TOC; 80, 67 % COD and 87, 65 % lignin from model and kraft lignin, respectively. High pollution parameters (like TOC, COD, BOD, sulphate) and toxic chemicals slow down the degradation of kraft lignin as compared to model lignin. The comparative GC-MS analysis has suggested that the interspecies collaboration, i.e., each bacterial strain in culture medium has cumulative enhancing effect on growth, and degradation of lignin rather than inhibition. Furthermore, toxicity evaluation on human keratinocyte cell line after bacterial treatment has supported the degradation and detoxification of model and kraft lignin.

  13. 40 CFR 174.519 - Bacillus thuringiensis Cry2Ab2 protein in corn and cotton; exemption from the requirement of a...

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 23 2010-07-01 2010-07-01 false Bacillus thuringiensis Cry2Ab2 protein... Bacillus thuringiensis Cry2Ab2 protein in or on corn or cotton are exempt from the requirement of a... REQUIREMENTS FOR PLANT-INCORPORATED PROTECTANTS Tolerances and Tolerance Exemptions § 174.519 Bacillus...

  14. Acetalization of 2-Hydroxybenzaldehyde mechanism using halogen acid catalysts based on ab initio methods

    Science.gov (United States)

    Yusuf, Muhammad; Roza, Destria; Nasution, Ahmad Kamil

    2017-11-01

    The computational calculation was performed on the acetalization of 2-hydroxybenzaldehyde by using ab initio method. Ab initio method is derived directly from theoretical principles with no inclusion of experimental data and this is an approximate quantum mechanical calculation. The aim of this research was to studies the acetalization of 2-hydroxybenzaldehyde mechanism using halogen acid catalysts. Computational calculation which was applied on the acetalization of 2-hydroxybenzaldehyde using halogen acid catalysts provided possible reaction steps. The first step was formation of a labile hemiacetal because it is essentially tetrahedral intermediates containing a leaving group. The second step was formation of a stable acetal. The results of computational calculation of acetalization of 2-hydroxybenzaldehyde provided possible energy change in the each step of the reaction process. A labile hemiacetal showed higher energy (481.04 kJ/mol) than 2-hydroxybenzaldehyde dimethyl acetal (65.32 kJ/mol) and 2-hydroxybenzaldehyde (0 kJ/mol) due to its instability. In general, acetalization of 2-hydroxybenzaldehyde reaction is a reversible reaction. The effect of Lewis acidity on halogen acid catalysts was also studied in this research. Based on the Mulliken charge on the H atom, it is found that HF has the highest Lewis acidity compared to other halogen acids with order HF> HCl> HBr> HI. As a result, HF was the efficient catalysts for acetalization of 2-Hydroxybenzaldehyde.

  15. The 2nd reactor core of the NS Otto Hahn

    International Nuclear Information System (INIS)

    Manthey, H.J.; Kracht, H.

    1979-01-01

    Details of the design of the 2nd reactor core are given, followed by a brief report summarising the operating experience gained with this 2nd core, as well as by an evaluation of measured data and statements concerning the usefulness of the knowledge gained for the development of future reactor cores. Quite a number of these data have been used to improve the concept and thus the specifications for the fuel elements of the 3rd core of the reactor of the NS Otto Hahn. (orig./HP) [de

  16. Reactor

    International Nuclear Information System (INIS)

    Toyama, Masahiro; Kasai, Shigeo.

    1978-01-01

    Purpose: To provide a lmfbr type reactor wherein effusion of coolants through a loop contact portion is reduced even when fuel assemblies float up, and misloading of reactor core constituting elements is prevented thereby improving the reactor safety. Constitution: The reactor core constituents are secured in the reactor by utilizing the differential pressure between the high-pressure cooling chamber and low-pressure cooling chamber. A resistance port is formed at the upper part of a connecting pipe, and which is connect the low-pressure cooling chamber and the lower surface of the reactor core constituent. This resistance part is formed such that the internal sectional area of the connecting pipe is made larger stepwise toward the upper part, and the cylinder is formed larger so that it profiles the inner surface of the connecting pipe. (Aizawa, K.)

  17. Reactor

    International Nuclear Information System (INIS)

    Ikeda, Masaomi; Kashimura, Kazuo; Inoue, Kazuyuki; Nishioka, Kazuya.

    1979-01-01

    Purpose: To facilitate the construction of a reactor containment building, whereby the inspections of the outer wall of a reactor container after the completion of the construction of the reactor building can be easily carried out. Constitution: In a reactor accommodated in a container encircled by a building wall, a space is provided between the container and the building wall encircling the container, and a metal wall is provided in the space so that it is fitted in the building wall in an attachable or detatchable manner. (Aizawa, K.)

  18. Set of rules SOR 2 reactor site criteria

    International Nuclear Information System (INIS)

    1976-06-01

    The purpose of this set of rules is to describe criteria which guide the Director in his evaluation of the suitability of proposed sites for stationary power and testing reactors subject to SOR 2. (B.G.)

  19. Jupiter models with improved ab initio hydrogen EOS (H-REOS.2)

    OpenAIRE

    Nettelmann, Nadine; Becker, Andreas; Holst, Bastian; Redmer, Ronald

    2011-01-01

    The amount and distribution of heavy elements in Jupiter gives indications on the process of its formation and evolution. Core mass and metallicity predictions however depend on the equations of state used, and on model assumptions. We present an improved ab initio hydrogen equation of state, H-REOS.2 and compute the internal structure and thermal evolution of Jupiter within the standard three-layer approach. The advance over our previous Jupiter models with H-REOS.1 by Nettelmann et al.(2008...

  20. Ab initio calculations on 2-imidazolyl-2-thiazolyl azo compounds - an investigation of potential near-infrared absorbing structures

    DEFF Research Database (Denmark)

    Åstrand, P.-O.; Bak, K.L.; Sauer, S.P.A.

    2001-01-01

    The two lowest singlet excitation energies of 26 2-imidazolyl-2-thiazolylazo compounds have been investigated by ab initio methods within the second-order polarization propagator approximation (SOPPA). Various combinations of 4- and 5-substituents at both the imidazole and thiazole units have bee...... included in this study, the longest wavelength was calculated to be 1049 nm. (C) 2001 Elsevier Science B.V. All rights reserved....

  1. Current progress on zeolite membrane reactor for CO2 hydrogenation

    Science.gov (United States)

    Makertiharta, I. G. B. N.; Dharmawijaya, P. T.; Wenten, I. G.

    2017-01-01

    Carbon capture and storage via catalytic hydrogenation into methanol have been recognized as the most promising solution to not only global warming issue but also high fuel and methanol demand worldwide. However, methanol synthesis from CO2 involves equilibrium limited reaction that can be optimized using membrane reactor (MR). Among all selective membrane layer, the zeolite is the most promising material because it can selectively remove water and methanol from reaction mixture component, especially H2. To present a clear background of zeolite membrane reactor, this paper will bring the brief discussion on the recent progress towards utilization of zeolite membrane reactor for CO2 hydrogenation. The progress of selective layer used in said MR will be examined in detail. Critical issues related to zeolite membrane reactor will also be discussed to develop it further.

  2. Driving nuclei with resonant electrons: Ab initio study of (e+H2) 2Σu+

    International Nuclear Information System (INIS)

    Robicheaux, F.

    1991-01-01

    We have calculated the cross sections for vibrational excitation and dissociative attachment in H 2 below 5 eV scattering energy. This completely ab initio calculation uses the frame-transformation method of Greene and Jungen [Adv. At. Mol. Phys. 21, 51 (1985)] for electron-vibronic coupling in resonant scattering from a neutral molecule. We found it necessary to modify their method to obtain good agreement with previous theory and experiment for v=0→v f with v f =1--3; for larger v f and for dissociative attachment we obtained good agreement with previous theory and qualitative agreement with experiment. The fixed-nuclei phase shifts were derived from a fully ab initio calculation in prolate spheroidal coordinates and then transformed to spherical l=1 phase shifts. The vibrational structure of H 2 - becomes evident for excitation from higher vibrational states of H 2 as well as for larger Δv's, confirming previous theory and experiment

  3. Operation of the SLOWPOKE-2 reactor in Jamaica

    Energy Technology Data Exchange (ETDEWEB)

    Grant, C.N.; Lalor, G.C.; Vuchkov, M.K. [University of the West Indies, Kingston (Jamaica)

    2001-07-01

    Over the past sixteen years lCENS has operated a SLOWPOKE 2 nuclear reactor almost exclusively for the purpose of neutron activation analysis. During this period we have adopted a strategy of minimum irradiation times while optimizing our output in an effort to increase the lifetime of the reactor core and to maintaining fuel integrity. An inter-comparison study with results obtained with a much larger reactor at IPEN has validated this approach. The parameters routinely monitored at ICENS are also discussed and the method used to predict the next shim adjustment. (author)

  4. Operation of the SLOWPOKE-2 reactor in Jamaica

    International Nuclear Information System (INIS)

    Grant, C.N.; Lalor, G.C.; Vuchkov, M.K.

    2001-01-01

    Over the past sixteen years lCENS has operated a SLOWPOKE 2 nuclear reactor almost exclusively for the purpose of neutron activation analysis. During this period we have adopted a strategy of minimum irradiation times while optimizing our output in an effort to increase the lifetime of the reactor core and to maintaining fuel integrity. An inter-comparison study with results obtained with a much larger reactor at IPEN has validated this approach. The parameters routinely monitored at ICENS are also discussed and the method used to predict the next shim adjustment. (author)

  5. Evolution of local atomic structure during solidification of Al2Au liquid: An ab initio study

    Energy Technology Data Exchange (ETDEWEB)

    Xiong, L H; Lou, H B; Wang, X D; Debela, T T; Cao, Q P; Zhang, D X; Wang, S Y; Wang, C Z; Jiang, J Z

    2014-04-01

    The local atomic structure evolution in Al2Au alloy during solidification from 2000 K to 400 K was studied by ab initio molecular dynamics simulations and analyzed using the structure factor, pair correlation functions, bond angle distributions, the Honeycutt-Anderson (HA) index and Voronoi tessellation methods. It was found that the icosahedral-like clusters are negligible in the Al2Au stable liquid and supercooled liquid states, and the most abundant clusters are those having HA indices of 131 and 120 or Voronoi indices of < 0,4,4,0 >, < 0,3, 6,0 > and < 0,4,4,2 > with coordination numbers of 8, 9 and 10, respectively. These clusters are similar to the local atomic structures in the CaF2-type Al2Au crystal, revealing the existence of structure heredity between liquid and crystalline phase in Al2Au alloy. (C) 2014 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  6. Air pollution control in kraft pulp mills.

    Science.gov (United States)

    Bhatia, S P; de Souza, T L; Azarniouch, M K; Prahacs, S

    1978-02-01

    A patented gas scrubbing process, whereby the emissions of malodorous reduced sulphur compounds are effectively and economically reduced, is described. Stack gases are scrubbed with an alkaline suspension of activated carbon. Reduced sulphur compounds as well as sulphur oxides are converted to sodium salts which are subsequently recovered and utilized for pulping. The process also reduces particulate emissions. It does not produce subsequent waste disposal problems and has little or, in some cases, zero net cost, on account of the simultaneous recovery of heat and chemicals. Furthermore, the paper also reviews some innovations made in gas chromatography techniques, for the measurement of trace quantities of sulphur compounds present in kraft mill emissions.

  7. Incipient resistance of Helicoverpa punctigera to the Cry2Ab Bt toxin in Bollgard II cotton.

    Directory of Open Access Journals (Sweden)

    Sharon Downes

    Full Text Available Combinations of dissimilar insecticidal proteins ("pyramids" within transgenic plants are predicted to delay the evolution of pest resistance for significantly longer than crops expressing a single transgene. Field-evolved resistance to Bacillus thuringiensis (Bt transgenic crops has been reported for first generation, single-toxin varieties and the Cry1 class of proteins. Our five year data set shows a significant exponential increase in the frequency of alleles conferring Cry2Ab resistance in Australian field populations of Helicoverpa punctigera since the adoption of a second generation, two-toxin Bt cotton expressing this insecticidal protein. Furthermore, the frequency of cry2Ab resistance alleles in populations from cropping areas is 8-fold higher than that found for populations from non-cropping regions. This report of field evolved resistance to a protein in a dual-toxin Bt-crop has precisely fulfilled the intended function of monitoring for resistance; namely, to provide an early warning of increases in frequencies that may lead to potential failures of the transgenic technology. Furthermore, it demonstrates that pyramids are not 'bullet proof' and that rapid evolution to Bt toxins in the Cry2 class is possible.

  8. Ab initio calculation of oxygen self-diffusion coefficient in uranium dioxide UO2

    Science.gov (United States)

    Dorado, Boris; Garcia, Philippe; Torrent, Marc

    Uranium dioxide UO2 is the most widely used nuclear fuel worldwide and its atomic transport properties are relevant to practically all engineering aspects of the material. Although transport properties have already been studied in UO2 by means of first-principles calculations, the ab initio determination of self-diffusion coefficients has up to now remained unreachable because the relevant computational tools were neither available or adapted. The present work reports our results related to the ab initio calculation of the oxygen self-diffusion coefficient in UO2. We first determine the Gibbs free energies of formation of oxygen charged defects by calculating both the electronic and vibrational (hence entropic) contributions. Then, we use the transition state theory in order to compute the effective jump frequency of the defects, which in turn provides us with the value of the pre-exponential factor. The results are compared to self-diffusion data obtained experimentally with a careful monitoring of the relevant thermodynamic conditions (oxygen partial pressure, temperature, impurity content).

  9. Improved parametric fits for the HeH2 ab initio energy surface

    International Nuclear Information System (INIS)

    Muchnick, P.

    1992-01-01

    A brief history of the development of ab initio calculations for the HeH 2 quasi-molecule energy surface, and the parametric fits to these ab initio calculations, is presented. The concept of 'physical reasonableness' of the parametric fit is discussed. Several new improved parametric fits for the energy surface, meeting these requirements, are then proposed. One fit extends the Russek-Garcia parametric fit for the deep repulsion region to include r-dependent parameters, resulting in a more physically reasonable fit with smaller average error. This improved surface fit is applied to quasi-elastic collisions of He on H 2 in the impulse approximation. Previous classical calculations of the scaled inelastic vibrorotational excitation energy distributions are improved with this more accurate parametric fit of the energy surface and with the incorporation of quantum effects in vibrational excitation. It is shown that Sigmund's approach in developing his scaling law is incomplete in the contribution of the three-body interactions to vibrational excitation of the H 2 molecule is concerned. The Sigmund theory is extended to take into account for r-dependency of three-body interactions. A parametric fit for the entire energy surface from essentially 0 ≤R≤∞ and 1.2≤r≤1.6 a.u., where R is the intermolecular spacing and r is the hydrogen bonding length, is also presented. This fit is physically reasonable in all asymptotic limits. This first, full surface parametric fit is based primarily upon a composite of ab initio studies by Russek and Garcia and Meyer, Hariharan and Kutzelnigg. Parametric fits for the H 2 (1sσ g ) 2 , H 2 + (1sσ g ), H 2 + (2pσ u ) and (LiH 2 ) + energy surfaces are also presented. The new parametric fits for H 2 , H 2 + (1sσ g ) are shown to be improvements over the well-known Morse potentials for these surfaces

  10. Safety analysis of a homogeneous SLOWPOKE reactor (part 2)

    International Nuclear Information System (INIS)

    Gagnon, R.L.

    2007-01-01

    An opportunity is presented with the approaching end of some of the SLOWPOKE-2 research reactors' design life, which consists of replacing the current heterogeneous core with a homogeneous assembly that would allow the extraction of radioisotopes (such as 99 Mo) for nuclear medicine and other applications. Preliminary investigation has demonstrated the feasibility of this concept and produced an initial design of a Homogeneous SLOWPOKE reactor that demonstrates the potential for inherent safety based on calculations of a strong negative reactivity coefficient due to temperature. The present research aims at continuing the safety analysis of the proposed homogeneous assembly, most notably in assessing its inherent safety characteristics with respect to factors such as void fraction of the moderator and additional thermalhydraulic effects. Modelling of the reactor is accomplished using both the deterministic WIMS-AECL and the probabilistic MCNP 5 for the determination of the reactor's reactivity and flux shape, while COMSOL Multiphysics is used for thermalhydraulics modelling. In pursuing the safety analysis, the design of the reactor is improved. One example of the improvements is the proposed substitution of the required additional reflector material in the initial design with graphite instead of beryllium. Another improvement is the replacement of the unique control rod in the core centre with a cluster of control rods within the radial reflector. This would not only simplify the construction of the reactor vessel, but increase the core volume for added radioisotope production capacity. The latest results of reactor simulations and the safety analysis will be presented. (author)

  11. Intrinsic Channeling of Vortices along the ab Plane in Vicinal YBa2Cu3O7-δ Films

    International Nuclear Information System (INIS)

    Berghuis, P.; Di Bartolomeo, E.; Wagner, G.A.; Evetts, J.E.

    1997-01-01

    We have measured the critical current density j c as a function of the orientation of a magnetic field in vicinal YBa 2 Cu 3 O 7-δ films. When both field and Lorentz force lie within the ab plane, we observe a minimum in j c . At high temperatures, as the c -axis coherence length approaches the ab -plane distance, the minimum in j c could not be observed, indicating that this effect is related to the breakdown of the rectilinear vortex state for fields at a small angle to the ab planes. Our results are the first demonstration of intrinsic channeling of vortex strings along the ab planes. copyright 1997 The American Physical Society

  12. The Importance of Rare-Earth Additions in Zr-Based AB2 Metal Hydride Alloys

    Directory of Open Access Journals (Sweden)

    Kwo-Hsiung Young

    2016-07-01

    Full Text Available Effects of substitutions of rare earth (RE elements (Y, La, Ce, and Nd to the Zr-based AB2 multi-phase metal hydride (MH alloys on the structure, gaseous phase hydrogen storage (H-storage, and electrochemical properties were studied and compared. Solubilities of the RE atoms in the main Laves phases (C14 and C15 are very low, and therefore the main contributions of the RE additives are through the formation of the RENi phase and change in TiNi phase abundance. Both the RENi and TiNi phases are found to facilitate the bulk diffusion of hydrogen but impede the surface reaction. The former is very effective in improving the activation behaviors. −40 °C performances of the Ce-doped alloys are slightly better than the Nd-doped alloys but not as good as those of the La-doped alloys, which gained the improvement through a different mechanism. While the improvement in ultra-low-temperature performance of the Ce-containing alloys can be associated with a larger amount of metallic Ni-clusters embedded in the surface oxide, the improvement in the La-containing alloys originates from the clean alloy/oxide interface as shown in an earlier transmission electron microscopy study. Overall, the substitution of 1 at% Ce to partially replace Zr gives the best electrochemical performances (capacity, rate, and activation and is recommended for all the AB2 MH alloys for electrochemical applications.

  13. Formation of insoluble particulates in a spray-dried F(ab')(2) fragment.

    Science.gov (United States)

    Lassner, Peter; Adler, Michael; Lee, Geoffrey

    2014-04-01

    An F(ab')2 fragment of an IgG has been spray-dried on a bench-top machine to examine the presence of insoluble particulates in the redissolved powder product. Preliminary experiments showed that treatment of the F(ab')2 in aqueous solution in a water bath at 65°C for 1 h produced fragmentation and also insoluble particulates, but no alteration in soluble aggregates. On spray drying, there was, however, no fragmentation but rather formation of soluble aggregates and insoluble particulates. There is therefore a strong difference between isothermal heat-induced damage in solution and during spray drying. The insoluble particulates were detected using a particle counter as a number distribution that was converted to a weight distribution. Addition of trehalose to the liquid feed strongly reduced the formation of the insoluble particulates, indicating that these are insoluble aggregates of the protein and not particulate contamination from the spray dryer. Trehalose (100 mM) was required to suppress formation of the insoluble aggregates, whereas 10 mM was sufficient to prevent formation of soluble aggregates. The particle counter and also isoelectric focusing gave consistent detection of the insoluble particles, whereas photon correlation spectroscopy gave inconsistent results. Spray-drying of small volumes of liquid feed on the bench-top scale can be performed without introducing nonproteinaceous insoluble particulates. © 2014 Wiley Periodicals, Inc. and the American Pharmacists Association.

  14. Maximum credible accident analysis for TR-2 reactor conceptual design

    International Nuclear Information System (INIS)

    Manopulo, E.

    1981-01-01

    A new reactor, TR-2, of 5 MW, designed in cooperation with CEN/GRENOBLE is under construction in the open pool of TR-1 reactor of 1 MW set up by AMF atomics at the Cekmece Nuclear Research and Training Center. In this report the fission product inventory and doses released after the maximum credible accident have been studied. The diffusion of the gaseous fission products to the environment and the potential radiation risks to the population have been evaluated

  15. Lapatinib and 17AAG reduce 89Zr-trastuzumab-F(ab')2 uptake in SKBR3 tumor xenografts.

    Science.gov (United States)

    Oude Munnink, Thijs H; de Vries, Elisabeth G E; Vedelaar, Silke R; Timmer-Bosscha, Hetty; Schröder, Carolina P; Brouwers, Adrienne H; Lub-de Hooge, Marjolijn N

    2012-11-05

    Human epidermal growth factor receptor-2 (HER2) directed therapy potentially can be improved by insight in drug effects on HER2 expression. This study evaluates the effects of the EGFR/HER2 tyrosine kinase inhibitor lapatinib, the heat shock protein-90 inhibitor 17AAG, and their combination, on HER2 expression with in vivo HER2-PET imaging. Lapatinib and 17AAG effects on EGFR and HER2 membrane expression were determined in vitro using flow cytometry of human SKBR3 tumor cells. Effect of lapatinib on HER2 internalization was studied in vitro by (89)Zr-trastuzumab-F(ab')(2) internalization. For in vivo evaluation, (89)Zr-trastuzumab-F(ab')(2) μPET imaging was performed two times with a 7 day interval. Lapatinib was administered for 6 days, starting 1 day after the baseline scan. 17AAG was given 1 day before the second (89)Zr-trastuzumab-F(ab')(2) injection. Imaging data were compared with ex vivo biodistribution analysis and HER2 immunohistochemical staining. 17AAG treatment lowered EGFR expression by 41% (P = 0.016) and HER2 by 76% (P = 0.022). EGFR/HER2 downregulation by 17AAG was inhibited by lapatinib pretreatment. Lapatinib reduced internalization of (89)Zr-trastuzumab-F(ab')(2) with 25% (P = 0.0022). (89)Zr-trastuzumab-F(ab')(2) tumor to blood ratio was lowered 32% by lapatinib (P = 0.00004), 34% by 17AAG (P = 0.0022) and even 53% by the combination (P = 0.011). Lapatinib inhibits HER2 internalization and 17AAG lowers HER2 membrane expression. Both drugs reduce (89)Zr-trastuzumab-F(ab')(2) tumor uptake. Based on our findings, supported by previous preclinical data indicating the antitumor potency of lapatinib in combination with HSP90 inhibition, combination of these drugs deserves further investigation.

  16. Ab initio study of thermoelectric properties of doped SnO2 superlattices

    International Nuclear Information System (INIS)

    Borges, P.D.; Silva, D.E.S.; Castro, N.S.; Ferreira, C.R.; Pinto, F.G.; Tronto, J.; Scolfaro, L.

    2015-01-01

    Transparent conductive oxides, such as tin dioxide (SnO 2 ), have recently shown to be promising materials for thermoelectric applications. In this work we studied the thermoelectric properties of Fe-, Sb- and Zn-uniformly doping and co-doping SnO 2 , as well as of Sb and Zn planar (or delta)-doped layers in SnO 2 forming oxide superlattices (SLs). Based on the semiclassical Boltzmann transport equations (BTE) in conjunction with ab initio electronic structure calculations, the Seebeck coefficient (S) and figure of merit (ZT) are obtained for these systems, and are compared with available experimental data. The delta doping approach introduces a remarkable modification in the electronic structure of tin dioxide, when compared with the uniform doping, and colossal values for ZT are predicted for the delta-doped oxide SLs. This result is a consequence of the two-dimensional electronic confinement and the strong anisotropy introduced by the doped planes. In comparison with the uniformly doped systems, our predictions reveal a promising use of delta-doped SnO 2 SLs for enhanced S and ZT, which emerge as potential candidates for thermoelectric applications. - Graphical abstract: Band structure and Figure of merit for SnO2:Sb superlattice along Z direction, P. D. Borges, D. E. S. Silva, N. S. Castro, C. R. Ferreira, F. G. Pinto, J. Tronto and L. Scolfaro, Ab initio study of thermoelectric properties of doped SnO2 superlattices. - Highlights: • Thermoelectric properties of SnO 2 -based alloys and superlattices. • High figure of merit is predicted for planar-doped SnO 2 superlattices. • Nanotechnology has an important role for the development of thermoelectric devices.

  17. Ab initio study of thermoelectric properties of doped SnO{sub 2} superlattices

    Energy Technology Data Exchange (ETDEWEB)

    Borges, P.D., E-mail: pdborges@gmail.com [Instituto de Ciências Exatas e Tecnológicas, Universidade Federal de Viçosa, 38810-000 Rio Paranaíba, MG (Brazil); Silva, D.E.S.; Castro, N.S.; Ferreira, C.R.; Pinto, F.G.; Tronto, J. [Instituto de Ciências Exatas e Tecnológicas, Universidade Federal de Viçosa, 38810-000 Rio Paranaíba, MG (Brazil); Scolfaro, L. [Department of Physics, Texas State University, 78666 San Marcos, TX (United States)

    2015-11-15

    Transparent conductive oxides, such as tin dioxide (SnO{sub 2}), have recently shown to be promising materials for thermoelectric applications. In this work we studied the thermoelectric properties of Fe-, Sb- and Zn-uniformly doping and co-doping SnO{sub 2}, as well as of Sb and Zn planar (or delta)-doped layers in SnO{sub 2} forming oxide superlattices (SLs). Based on the semiclassical Boltzmann transport equations (BTE) in conjunction with ab initio electronic structure calculations, the Seebeck coefficient (S) and figure of merit (ZT) are obtained for these systems, and are compared with available experimental data. The delta doping approach introduces a remarkable modification in the electronic structure of tin dioxide, when compared with the uniform doping, and colossal values for ZT are predicted for the delta-doped oxide SLs. This result is a consequence of the two-dimensional electronic confinement and the strong anisotropy introduced by the doped planes. In comparison with the uniformly doped systems, our predictions reveal a promising use of delta-doped SnO{sub 2} SLs for enhanced S and ZT, which emerge as potential candidates for thermoelectric applications. - Graphical abstract: Band structure and Figure of merit for SnO2:Sb superlattice along Z direction, P. D. Borges, D. E. S. Silva, N. S. Castro, C. R. Ferreira, F. G. Pinto, J. Tronto and L. Scolfaro, Ab initio study of thermoelectric properties of doped SnO2 superlattices. - Highlights: • Thermoelectric properties of SnO{sub 2}-based alloys and superlattices. • High figure of merit is predicted for planar-doped SnO{sub 2} superlattices. • Nanotechnology has an important role for the development of thermoelectric devices.

  18. Dynamic simulation of the 2 MWt slowpoke heating reactor

    International Nuclear Information System (INIS)

    Tseng, C.M.; Lepp, R.M.

    1982-04-01

    A 2 MWt SLOWPOKE reactor, intended for commercial space heating, is being developed at the Chalk River Nuclear Laboratories. A small-signal dynamic simulation of this reactor, without closed-loop control, was developed. Basic equations were used to describe the physical phenomena in each kf the eight reactor subsystems. These equations were then linearized about the normal operation conditions and rearranged in a dimensionless form for implementation. The overall simulation is non-linear. Slow transient responses (minutes to days) of the simulation to both reactivity and temperature perturbations were measured at full power. In all cases the system reached a new steady state in times varying from 12 h to 250 h. These results illustrate the benefits of the inherent negative reactivity feedback of this reactor concept. The addition of closed-loop control using core outlet temperature as the controlled variable to move a beryllium reflector is also examined

  19. Corrosion testing in flash tanks of kraft pulp mills

    Energy Technology Data Exchange (ETDEWEB)

    Clarke, S.J.; Stead, N.J.

    1999-11-01

    The corrosion observed in the first flash tanks in kraft pulp mills with modified cooking practices was characterized. Coupons of carbon steel (CS), several stainless steels (SS), and Ti were exposed at two mills. At one mill, identical sets of coupons were exposed in the No. 1 and No. 2 flash tank. At the other mill, three identical sets of coupons were placed in flash tank No. 1. The results of the exposures showed that both CS and Ti suffered high rates of general corrosion, while the SS suffered varying degrees of localized attack. The ranking of the corrosion resistance in the flash tank was the same that would be expected in a reducing acid environment. Attack by organic acids was concluded to be the most likely cause of corrosion of the flash tanks.

  20. Comparative study of intact A7 MoAc and F(ab')2 fragments for radioimmunoimaging of human colon cancer in nude mice

    International Nuclear Information System (INIS)

    Kojima, Shuji; Suzuki, Naomi; Shimura, Noriko; Kubodera, Akiko; Kubota, Kazuhiko; Yamaguchi, Toshiharu; Takahashi, Toshio; Oyamada, Hiyoshimaru

    1993-01-01

    Differences of pharmacokinetics and tumor imaging ability between intact monoclonal antibody A7 (A7 MoAb) and F(ab) 2 fragments were studied in human colon cancer (LS-174T)-bearing nude mice. The authors examined the yield and the immunoreactivity of F(ab) 2 fragments after treatment with ficin as a function of time. The yield of F(ab) 2 fragments reached about 50% after ficin treatment for 8 h, and the F(ab) 2 retained about 80% of the immunoreactivity of the corresponding MoAb. Longer digestion with ficin produced smaller fragments (less than 92 kDa) with a lower yield and most of the immunoreactivity was lost. In pharmacokinetics studies, the F(ab') 2 was preferentially taken up by the tumor, cleared more rapidly from the blood circulation and seemed to have less non-specific tissue binding than intact A7 MoAb. The tumor image obtained at an early time using 131 I-F(ab') 2 was much superior in quality to that with intact 131 I-A7 MoAb. The use of F(ab') 2 fragments may be effective for tumor diagnosis and therapy. (author)

  1. FMDP Reactor Alternative Summary Report: Volume 2 - CANDU heavy water reactor alternative

    Energy Technology Data Exchange (ETDEWEB)

    Greene, S.R.; Spellman, D.J.; Bevard, B.B. [and others

    1996-09-01

    The Department of Energy Office of Fissile Materials Disposition (DOE/MD) initiated a detailed analysis activity to evaluate each of ten plutonium disposition alternatives that survived an initial screening process. This document, Volume 2 of a four volume report, summarizes the results of these analyses for the CANDU reactor based plutonium disposition alternative.

  2. Ab-initio Hartree-Fock study of tritium desorption from Li{sub 2}O

    Energy Technology Data Exchange (ETDEWEB)

    Taniguchi, Masaki; Tanaka, Satoru [Tokyo Univ. (Japan). Faculty of Engineering

    1998-03-01

    Dissociative adsorption of hydrogen on Li{sub 2}O (110) surface has been investigated with ab-initio Hartree-Fock quantum chemical calculation technique. Heat of adsorption and potential energy surface for H{sub 2} dissociative adsorption was evaluated by calculating the total energy of the system. Calculation results on adsorption heat indicated that H{sub 2} adsorption is endothermic. However, when oxygen vacancy exists adjacent to the adsorption sites, heat of adsorption energy became less endothermic and the activation energy required to dissociate the H-H bonding was smaller than that for the terrace site. This is considered to be caused by the excess charge localized near the defect. (author)

  3. Compact tokamak reactors part 2 (numerical results)

    International Nuclear Information System (INIS)

    Wiley, J.C.; Wootton, A.J.; Ross, D.W.

    1996-01-01

    The authors describe a numerical optimization scheme for fusion reactors. The particular application described is to find the smallest copper coil spherical tokamak, although the numerical scheme is sufficiently general to allow many other problems to be solved. The solution to the steady state energy balance is found by first selecting the fixed variables. The range of all remaining variables is then selected, except for the temperature. Within the specified ranges, the temperature which satisfies the power balance is then found. Tests are applied to determine that remaining constraints are satisfied, and the acceptable results then stored. Results are presented for a range of auxiliary current drive efficiencies and different scaling relationships; for the range of variables chosen the machine encompassing volume increases or remains approximately unchanged as the aspect ratio is reduced

  4. Compact tokamak reactors part 2 (numerical results)

    Energy Technology Data Exchange (ETDEWEB)

    Wiley, J.C.; Wootton, A.J.; Ross, D.W.

    1996-10-21

    The authors describe a numerical optimization scheme for fusion reactors. The particular application described is to find the smallest copper coil spherical tokamak, although the numerical scheme is sufficiently general to allow many other problems to be solved. The solution to the steady state energy balance is found by first selecting the fixed variables. The range of all remaining variables is then selected, except for the temperature. Within the specified ranges, the temperature which satisfies the power balance is then found. Tests are applied to determine that remaining constraints are satisfied, and the acceptable results then stored. Results are presented for a range of auxiliary current drive efficiencies and different scaling relationships; for the range of variables chosen the machine encompassing volume increases or remains approximately unchanged as the aspect ratio is reduced.

  5. IGORR 2: Proceedings of the 2. meeting of the International Group On Research Reactors

    International Nuclear Information System (INIS)

    1992-01-01

    The International group on Research Reactors was formed to facilitate the sharing of knowledge and experience among those institutions and individuals who are actively working to design, build, and promote new research reactors or to make significant upgrades to existing facilities. Sessions during this second meeting were devoted to research reactor reports (GRENOBLE reactor, FRM-II, HIFAR, PIK, reactors at JAERI, MAPLE, ANS, NIST, MURR, TRIGA, BR-2, SIRIUS 2); other neutron sources; and two workshops were dealing with research and development results and needs and reports on progress in needed of R and D areas identified at IGORR 1

  6. AB INITIO STUDY OF AMMONIA CLUSTERS: (NH3n (n = 2-6

    Directory of Open Access Journals (Sweden)

    Herudi Kandau

    2010-06-01

    Full Text Available Hydrogen bonded neutral clusters of ammonia, (NH3n (n = 2-6, have been theoretically investigated employing the D95++(d,p (and wherever necessary, higher basis sets at the Hartree-Fock (HF level as well as with second-order Møller-Plesset (MP2 perturbation theory. While the ammonia trimer and tetramer exhibit perfect molecular symmetries and are nonpolar, the pentamer and hexamer both optimize with slight deviations from perfect symmetries and are seen to posses marginal, but nonzero dipole moments. The (NH3n linear clusters are seen to be chemically softer than the corresponding cyclic ones.   Keywords: ab initio calculation, ammonia clusters, Hartree-Fock, Møller-Plesset

  7. {ital Ab initio} electronic structure, magnetism, and magnetocrystalline anisotropy of UGa{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Divis, M. [Department of Metal Physics, Charles University, Ke Karlovu 5, 121 16 Prague 2 (Czech Republic)]|[Max-Planck-Gesellschaft, Research Group ``Electron Systems,`` University of Technology, D-01062 Dresden (Germany); Richter, M.; Eschrig, H.; Steinbeck, L. [Max-Planck-Gesellschaft, Research Group ``Electron Systems,`` University of Technology, D-01062 Dresden (Germany)

    1996-04-01

    {ital Ab} {ital initio} electronic structure calculations for the intermetallic compound UGa{sub 2} were performed using an optimized linear combination of atomic orbitals method based on the local spin density approximation. Three separate calculations were done treating the uranium 5{ital f} states as band states and as localized states with occupation two and three, respectively. In the itinerant approach, spin and orbital moments, magnetocrystalline anisotropy, and the Sommerfeld constant were calculated and found to deviate significantly from the related experimental data. In the localized approach, crystal field parameters were obtained for the 5{ital f} states, which have been treated by self-interaction corrected local-density theory. This approach with 5{ital f}{sup 2} occupation is shown to provide reasonable results for the anisotropy of the susceptibility, for the field dependence of the magnetic moments, and for the Sommerfeld constant. {copyright} {ital 1996 The American Physical Society.}

  8. Rotational Energy Transfer of N2 Determined Using a New Ab Initio Potential Energy Surface

    Science.gov (United States)

    Huo, Winifred M.; Stallcop, James R.; Partridge, Harry; Langhoff, Stephen R. (Technical Monitor)

    1997-01-01

    A new N2-N2 rigid-rotor surface has been determined using extensive Ab Initio quantum chemistry calculations together with recent experimental data for the second virial coefficient. Rotational energy transfer is studied using the new potential energy surface (PES) employing the close coupling method below 200 cm(exp -1) and coupled state approximation above that. Comparing with a previous calculation based on the PES of van der Avoird et al.,3 it is found that the new PES generally gives larger cross sections for large (delta)J transitions, but for small (delta)J transitions the cross sections are either comparable or smaller. Correlation between the differences in the cross sections and the two PES will be attempted. The computed cross sections will also be compared with available experimental data.

  9. Molecular simulation of homogeneous crystal nucleation of AB2 solid phase from a binary hard sphere mixture

    Science.gov (United States)

    Bommineni, Praveen Kumar; Punnathanam, Sudeep N.

    2017-08-01

    Co-crystal formation from fluid-mixtures is quite common in a large number of systems. The simplest systems that show co-crystal (also called substitutionally ordered solids) formation are binary hard sphere mixtures. In this work, we study the nucleation of AB2 type solid compounds using Monte Carlo molecular simulations in binary hard sphere mixtures with the size ratio of 0.55. The conditions chosen for the study lie in the region where nucleation of an AB2 type solid competes with that of a pure A solid with a face-centered-cubic structure. The fluid phase composition is kept equal to that of the AB2 type solid. The nucleation free-energy barriers are computed using the seeding technique of Sanz et al. [J. Am. Chem. Soc. 135, 15008 (2013)]. Our simulation results show that the nucleation of the AB2 type solid is favored even under conditions where the pure A solid is more stable. This is primarily due to the similarity in the composition of the fluid phase and the AB2 type solid which in turn leads to much lower interfacial tension between the crystal nucleus and the fluid phase. This system is an example of how the fluid phase composition affects the structure of the nucleating solid phase during crystallization and has relevance to crystal polymorphism during crystallization processes.

  10. Carryover of liquid CO2 during filling of reactor 1

    International Nuclear Information System (INIS)

    1996-01-01

    Formation of ice was noticed on the surface of Reactor 1 Gas Bypass Circuit Filter. At the time the Reactor was being pressurized to design density after a statutory outage. Investigations showed that approximately 22Te of liquid CO2 was inadvertently transferred from the CO2 Storage Plant to the ring main on the previous day. The liquid had been depressurized to nominally atmospheric pressure at an office plate local to the Reactor filling valves. The depressurization of the liquid CO2 resulted in solid and vapour being formed at -79 deg C. The majority of the solid vapour mix entered the Reactor via the CO2 penetration. The remainder passed into the Gas Bypass Circuit and into the Reactor via the Man Access penetration. Solid CO2 was retained within the Bypass Filter. Severe ''chilling'' of the Penetrations and the Bypass Filter resulted. Despite a number of abnormalities during the relevant 30 minute filling operation and the recording of certain facts, the event was undetected until the formation of ice some two days later at the bypass circuit. 1 fig

  11. On the Labile Memory Buffer in the Attentional Blink: Masking the T2 Representation by Onset Transients Mediates the AB

    Science.gov (United States)

    Jannati, Ali; Spalek, Thomas M.; Di Lollo, Vincent

    2011-01-01

    Report of a second target (T2) is impaired when presented within 500 ms of the first (T1). This attentional blink (AB) is known to cause a delay in T2 processing during which T2 must be stored in a labile memory buffer. We explored the buffer's characteristics using different types of masks after T2. These characteristics were inferred by…

  12. Mechanistic Aspects of the Reversible Binding of SO2 on Arylplatinum Complexes: Experimental and ab Initio Studies

    NARCIS (Netherlands)

    Koten, G. van; Albrecht, M.A.; Gossage, R.A.; Frey, H.; Ehlers, A.W.; Baerends, E.J.; Merbach, A.E.

    2001-01-01

    The detailed mechanism of the reversible binding and fast exchange of SO2 on the organoplatinum(II) complex [PtI(NCN)], 1, has been studied experimentally in solution (C2F4Br2) using low-temperature NMR spectroscopy and theoretically by ab initio calculations. Direct bonding of SO2 and formation of

  13. PROCESS FOR THE PRODUCTION OF DISSOLVING PULP FROM TREMA ORIENTALIS (NALITA) BY PREHYDROLYSIS KRAFT AND SODA-ETHYLENEDIAMINE (EDA) PROCESS

    OpenAIRE

    M. A. Quaiyyum; A. Noori; Labooni Ahsan; M. Sarwar Jahan

    2008-01-01

    This paper presents a preliminary study for the production of dissolving pulp from Trema orientalis (Nalita). Water prehydrolysis kraft and soda-ethylenediamine (EDA) pulping for the production of dissolving pulp from T. orientalis was investigated. Prehydrolysis at 150 and 170 oC did not produce pulp with high α-cellulose content when using the kraft process. But addition of 0.25 % H2SO4 in prehydrolysis liquor increased the purity of the pulp with the sacrifice of pulp yield and viscosity. ...

  14. Cross-resistance to purified Bt proteins, Bt corn and Bt cotton in a Cry2Ab2-corn resistant strain of Spodoptera frugiperda.

    Science.gov (United States)

    Yang, Fei; Kerns, David L; Head, Graham P; Price, Paula; Huang, Fangneng

    2017-12-01

    Gene-pyramiding by combining two or more dissimilar Bacillus thuringiensis (Bt) proteins into a crop has been used to delay insect resistance. The durability of gene-pyramiding can be reduced by cross-resistance. Fall armyworm, Spodoptera frugiperda, is a major target pest of the Cry2Ab2 protein used in pyramided Bt corn and cotton. Here, we provide the first experimental evaluation of cross-resistance in S. frugiperda selected with Cry2Ab2 corn to multiple Bt sources including purified Bt proteins, Bt corn and Bt cotton. Concentration - response bioassays showed that resistance ratios for Cry2Ab2-resistant (RR) relative to Cry2Ab2-susceptible (SS) S. frugiperda were -1.4 for Cry1F, 1.2 for Cry1A.105, >26.7 for Cry2Ab2, >10.0 for Cry2Ae and -1.1 for Vip3A. Larvae of Cry2Ab2-heterozygous (RS), SS and RR S. frugiperda were all susceptible to Bt corn and Bt cotton containing Cry1 (Cry1F or Cry1A.105) and/or Vip3A proteins. Pyramided Bt cotton containing Cry1Ac + Cry2Ab2 or Cry1Ab + Cry2Ae were also effective against SS and RS, but not RR. These findings suggest that Cry2Ab2-corn-selected S. frugiperda is not cross-resistant to Cry1F, Cry1A.105 or Vip3A protein, or corn and cotton plants containing these Bt proteins, but it can cause strong cross-resistance to Cry2Ae and Bt crops expressing similar Bt proteins. © 2017 Society of Chemical Industry. © 2017 Society of Chemical Industry.

  15. Ab initio study on the reaction between uranium and O2

    International Nuclear Information System (INIS)

    Shuai Maobing; Zhao Pengji; Tian Anmin

    2000-08-01

    Optimized geometries, total energies and electronic structures of some gaseous atoms and molecules of uranium-oxygen system are calculated with harmonic vibration analysis using ab initio method. The potential energy surfaces (PESs) of the uranium oxidation process are also constructed. The calculated optimized geometries, infrared vibrational frequencies and the first ionized potential energies are in well accordance with available experimental data. Although U6p, U7s and U6d valence orbital electrons take part in the formation of U - O bond, the U5f electrons play an dominant role in this process and because the energies of U5f, U6d, U7s and Uds atomic orbitals are close to each other, these orbitals may hybrid and interact with O2p orbital, simultaneously, to form molecular orbitals of uranium oxides. The PESs show that different reaction modes result in different product geometries

  16. Immunomodulatory effects of intravenous bis-1 f(ab')(2) administration in renal-cell cancer-patients

    NARCIS (Netherlands)

    Janssen, R. A. J.; Kroesen, B. J.; Mesander, G.; Sleijfer, D. T.; The, T. Hauw; Mulder, N. H.; de Leij, L

    We report the immunomodulatory effects of an intravenous treatment with F(ab')(2) fragments of the bispecific monoclonal antibody BIS-1 during subcutaneous recombinant interleukin 2 (rIL-2) therapy of renal cell cancer (RCC) patients. BIS-1 is directed against both the CD3 antigen on T cells and the

  17. Pulp and paper production from Spruce wood with kraft and ...

    African Journals Online (AJOL)

    Picea orientalis) wood collected from the Black Sea Region of Turkey. Fiber properties, carbohydrate contents, strength and optical properties of resultant paper were included to determine the properties of these pulp samples. Optimum kraft ...

  18. Alcohol Dehydrogenation on Kraft Lignin-Derived Chars with Surface Basicity

    Directory of Open Access Journals (Sweden)

    Francisco J. García-Mateos

    2017-10-01

    Full Text Available The properties of lignin and its potential as a renewable source make it an ideal precursor for carbon products. Specifically, the high content of Na observed in Kraft lignin makes this industrial by-product an interesting precursor for the preparation of catalysts for different applications. In this work, basic activated carbons with different textural properties and surface chemistry were obtained from Kraft lignin by direct carbonization at various temperatures. The influence of a further washing treatment and partial gasification with CO2 was also evaluated. The carbon catalysts were tested as catalysts for the alcohol decomposition reaction. In this sense, 2-propanol, a molecule widely used for testing the acidic-basic character of heterogeneous catalysts, was selectively transformed into acetone, meanwhile, ethanol and methanol yielded mainly acetaldehyde and formaldehyde, respectively.

  19. Digital, remote control system for a 2-MW research reactor

    International Nuclear Information System (INIS)

    Battle, R.E.; Corbett, G.K.

    1988-01-01

    A fault-tolerant programmable logic controller (PLC) and operator workstations have been programmed to replace the hard-wired relay control system in the 2-MW Bulk Shielding Reactor (BSR) at Oak Ridge National Laboratory. In addition to the PLC and remote and local operator workstations, auxiliary systems for remote operation include a video system, an intercom system, and a fiber optic communication system. The remote control station, located at the High Flux Isotope Reactor 2.5 km from the BSR, has the capability of rector startup and power control. The system was designed with reliability and fail-safe features as important considerations. 4 refs., 3 figs

  20. The FhaB/FhaC two-partner secretion system is involved in adhesion of Acinetobacter baumannii AbH12O-A2 strain.

    Science.gov (United States)

    Pérez, A; Merino, M; Rumbo-Feal, S; Álvarez-Fraga, L; Vallejo, J A; Beceiro, A; Ohneck, E J; Mateos, J; Fernández-Puente, P; Actis, L A; Poza, M; Bou, G

    2017-08-18

    Acinetobacter baumannii is a hospital-acquired pathogen that shows an extraordinary capacity to stay in the hospital environment. Adherence of the bacteria to eukaryotic cells or to abiotic surfaces is the first step for establishing an infection. The A. baumannii strain AbH12O-A2 showed an exceptional ability to adhere to A549 epithelial cells. The AbFhaB/FhaC 2-partner secretion (TPS) system involved in adhesion was discovered after the screening of the recently determined A. baumannii AbH12O-A2 strain genome (CP009534.1). The AbFhaB is a large exoprotein which transport to the bacterial surface is mediated by the AbFhaC protein. In the present study, the role of this TPS system in the AbH12O-A2 adherence phenotype was investigated. The functional inactivation of this 2-partner secretion system was addressed by analyzing the outer membrane vesicles (OMV) proteomic profile from the wild-type strain and its derivative mutant AbH12O-A2ΔfhaC demonstrating that AbFhaB is no longer detected in the absence of AbFhaC. Scanning electron microscopy (SEM) and adhesion experiments demonstrated that inactivation of the AbFhaB/FhaC system significantly decreases bacterial attachment to A549 alveolar epithelial cells. Moreover, it has been demonstrated that this 2-partner secretion system is involved in fibronectin-mediated adherence of the A. baumannii AbH12O-A2 isolate. Finally, we report that the AbFhaB/FhaC system is involved in virulence when tested using invertebrate and vertebrate hosts. These data suggest the potential role that this AbFhaB/FhaC secretion system could play in the pathobiology of A. baumannii.

  1. Safety analysis of a homogeneous SLOWPOKE reactor (part 2)

    Energy Technology Data Exchange (ETDEWEB)

    Gagnon, R.L. [Royal Military College of Canada, Dept. of Chemistry and Chemical Engineering, Kingston, Ontario (Canada)

    2007-07-01

    An opportunity is presented with the approaching end of some of the SLOWPOKE-2 research reactors' design life, which consists of replacing the current heterogeneous core with a homogeneous assembly that would allow the extraction of radioisotopes (such as {sup 99}Mo) for nuclear medicine and other applications. Preliminary investigation has demonstrated the feasibility of this concept and produced an initial design of a Homogeneous SLOWPOKE reactor that demonstrates the potential for inherent safety based on calculations of a strong negative reactivity coefficient due to temperature. The present research aims at continuing the safety analysis of the proposed homogeneous assembly, most notably in assessing its inherent safety characteristics with respect to factors such as void fraction of the moderator and additional thermalhydraulic effects. Modelling of the reactor is accomplished using both the deterministic WIMS-AECL and the probabilistic MCNP 5 for the determination of the reactor's reactivity and flux shape, while COMSOL Multiphysics is used for thermalhydraulics modelling. In pursuing the safety analysis, the design of the reactor is improved. One example of the improvements is the proposed substitution of the required additional reflector material in the initial design with graphite instead of beryllium. Another improvement is the replacement of the unique control rod in the core centre with a cluster of control rods within the radial reflector. This would not only simplify the construction of the reactor vessel, but increase the core volume for added radioisotope production capacity. The latest results of reactor simulations and the safety analysis will be presented. (author)

  2. Loss of coolant analysis for the tower shielding reactor 2

    International Nuclear Information System (INIS)

    Radcliff, T.D.; Williams, P.T.

    1990-06-01

    The operational limits of the Tower Shielding Reactor-2 (TSR-2) have been revised to account for placing the reactor in a beam shield, which reduces convection cooling during a loss-of-coolant accident (LOCA). A detailed heat transfer analysis was performed to set operating time limits which preclude fuel damage during a LOCA. Since a LOCA is survivable, the pressure boundary need not be safety related, minimizing seismic and inspection requirements. Measurements of reactor component emittance for this analysis revealed that aluminum oxidized in water may have emittance much higher than accepted values, allowing higher operating limits than were originally expected. These limits could be increased further with analytical or hardware improvements. 5 refs., 7 figs

  3. Shadow corrosion evaluation in the Studsvik R2 reactor

    International Nuclear Information System (INIS)

    Sanders, Ch.; Lysell, G.

    2000-01-01

    Post-irradiation examination has shown that increased corrosion occurs when zirconium alloys are in contact with or in proximity to other metallic objects. The observations indicate an influence of irradiation from the adjacent component as the enhanced corrosion occurs as a 'shadow' of the metallic object on the zirconium surface. This phenomenon could ultimately limit the lifetime of certain zirconium alloy components in the reactor. The Studsvik R2 materials test reactor has an In-Core Autoclave (INCA) test facility especially designed for water chemistry and materials research. The INCA facility has been evaluated and found suitable for shadow corrosion studies. The R2 reactor core containing the INCA facility was modeled with the Monte Carlo N-Particle (MCNP) code in order to evaluate the electron deposition in various materials and to develop a hypothesis of the shadow corrosion mechanism. (authors)

  4. Bio-based polyurethane prepared from Kraft lignin and modified castor oil

    OpenAIRE

    L. B. Tavares; C. V. Boas; G. R. Schleder; A. M. Nacas; D. S. Rosa; D. J. Santos

    2016-01-01

    Current challenges highlight the need for polymer research using renewable natural sources as a substitute for petroleum-based polymers. The use of polyols obtained from renewable sources combined with the reuse of industrial residues such as lignin is an important agent in this process. Different compositions of polyurethane-type materials were prepared by combining technical Kraft lignin (TKL) with castor oil (CO) or modified castor oil (MCO1 and MCO2) to increase their reactivity towards d...

  5. AB{sub 2} metal hydrides for high-pressure and narrow temperature interval applications

    Energy Technology Data Exchange (ETDEWEB)

    Hagstroem, M.T.; Vanhanen, J.P.; Lund, P.D. [Helsinki Univ. of Technol., Hut (Finland). Dept. of Eng. Phys. and Math.

    1998-05-01

    AB{sub 2}-based metal hydrides have been studied in order to find high-capacity, low-hysteresis alloy-hydrogen systems for high-pressure applications with strict thermal boundary conditions. TiCrMn{sub 1-3x}Fe{sub 2x}V{sub x} (x=0, 0.05, 0.1, 0.15 or 0.2) and Ti{sub 1-y}Zr{sub y}(Cr{sub z}Mn{sub 1-z}){sub 2} (y=0.05 or 0.15 and z=0.5 or 0.6) alloys have been synthesized and characterised by XRD, ICP spectrometry and volumetric PCI measurements. In addition, the PCIs of two commercial (GfE) alloys, Hydralloy C2 and Hydralloy C0, have been measured and a PDSC study on Hydralloy C2 has been performed, in order to assess the feasibility of their basic hydriding properties for narrow temperature interval applications. In the Fe and V containing alloy-hydrogen systems, hysteresis can be overcome at the cost of reduced hydriding capacity, while in the Zr-containing hydrides, at the temperatures of this study (-80 to 60 C), hysteresis is not completely eliminated but the hydriding capacity remains good also at high temperatures. The interplay between these properties of hydrides is discussed, as well as the role of materials characteristics in specially constrained applications. (orig.) 17 refs.

  6. Reproduction of the PSBR reactor with Exterminator-2; Reproduccion del reactor PSBR con exterminador-2

    Energy Technology Data Exchange (ETDEWEB)

    Aguilar H, F. [ININ, 52045 Ocoyoacac, Estado de Mexico (Mexico)

    1983-08-15

    To reproduce the reactor PSBR reported in (1), with the available version of the Exterminator-II in the ININ, they took the dimensions, composition specifications, effective sections of the different compositions (excepting those of the central thimble and of the moderator), the K{sub eff} and the factors of power (FP) for the different burners. Based on the comparison of the K{sub eff} and of the FP obtained with those reported the precision it is determined before in the reproduction of the reactor mentioned. (Author)

  7. Comparison of the osteogenesis and fusion rates between activin A/BMP-2 chimera (AB204) and rhBMP-2 in a beagle's posterolateral lumbar spine model.

    Science.gov (United States)

    Zheng, Guang Bin; Yoon, Byung-Hak; Lee, Jae Hyup

    2017-10-01

    Activin A/BMP-2 chimera (AB204) could promote bone healing more effectively than recombinant bone morphogenetic protein 2 (rhBMP-2) with much lower dose in a rodent model, but there is no report about the effectiveness of AB204 in a large animal model. The purpose of this study was to compare the osteogenesis and fusion rate between AB204 and rhBMP-2 using biphasic calcium phosphate (BCP) as a carrier in a beagle's posterolateral lumbar fusion model. This is a randomized control animal study. Seventeen male beagle dogs were included. Bilateral posterolateral fusion was performed at the L1-L2 and L4-L5 levels. Biphasic calcium phosphate (2 cc), rhBMP-2 (50 µg)+BCP (2 cc), or AB204 (50 µg)+BCP (2 cc) were implanted into the intertransverse space randomly. X-ray was performed at 4 and 8 weeks. After 8 weeks, the animals were sacrificed, and new bone formation and fusion rate were evaluated by manual palpation, computed tomography (CT), and undecalcified histology. The AB204 group showed significantly higher fusion rate (90%) than the rhBMP-2 group (15%) or the Osteon group (6.3%) by manual palpation. On x-ray and CT assessment, fusion rate and the volume of newly formed bone were also significantly higher in AB204 group than other groups. In contrast, more osteolysis was found in rhBMP-2 group (40%) than in AB204 group (10%) on CT study. In histologic results, new bone formation was sufficient between transverse processes in AB204 group, and obvious trabeculation and bone remodeling were observed. But in rhBMP-2 group, new bone formation was less than AB204 group and osteolysis was observed between the intertransverse spaces. A low dose of AB204 with BCP as a carrier significantly promotes the fusion rate in a large animal model when compared with the rhBMP-2. These findings demonstrate that AB204 could be an alternative to rhBMP-2 to improve fusion rate. Copyright © 2017 Elsevier Inc. All rights reserved.

  8. Ab initio study of the Br(2P)-HBr van der Waals complex.

    Science.gov (United States)

    Toboła, R; Chałasiński, G; Kłos, J; Szcześniak, M M

    2009-05-14

    This study reports an ab initio characterization of a prereactive van der Waals complex between an open-shell atom Br((2)P) and a closed shell molecule HBr. The three adiabatic potential surfaces 1 (2)A('), 2 (2)A('), and 1 (2)A("), which result from the splitting of degenerate P state of Br are obtained from coupled cluster calculations. The coupling between same-symmetry states is calculated by multireference configuration-interaction method. A transformation to a diabatic representation and inclusion of the spin-orbit coupling effects on the interactions are also discussed. Bound states are calculated using an adiabatic bender model. The global minimum on the lowest adiabatic potential surface corresponds to a T-shaped geometry and has a well depth of D(e)=762.5 cm(-1) at R(e)=3.22 A. A secondary minimum occurs for a hydrogen-bonded geometry with D(e)=445.3 cm(-1) at R(e)=4.24 A. Upon inclusion of spin-orbit coupling the hydrogen-bonded minimum remains at the same depth, but the T-shaped minimum washes out to less than half of its spin-free value. The lowest bound state is localized in the linear minimum. The spin-orbit coupling plays a very important role in shaping of the potential energy surfaces of Br-HBr.

  9. A conceptual design of LIB fusion reactor: UTLIF(2)

    International Nuclear Information System (INIS)

    Madarame, Haruki; Kondo, Shunsuke; Iwata, Shuichi; Oka, Yoshiaki; Miya, Kenzo.

    1984-01-01

    UTLIF(2) is a conceptual design study on a light ion beam driven fusion reactor based on a concept of rod-bundle blanket. Survivability and maintainability of the first wall and the blanket are regarded as of major importance in the design. The blanket rod is composed of a thick tube which has enough stiffness, a thin wrapping wall which receives high heat flux, and liquid lithium which breeds tritium and removes generated heat. The rod can be pulled out from the outside of the reactor vessel, hence the replacement is very easy. Nuclear and thermal analysis have been made and the performance of the reactor has been shown to be satisfactory. (author)

  10. Optimized Control Rods of the BR2 Reactor

    Energy Technology Data Exchange (ETDEWEB)

    Kalcheva, Silva; Koonen, E.

    2007-09-15

    At the present time the BR-2 reactor uses control elements with cadmium as neutron absorbing part. The lower section of the control element is a beryllium assembly cooled by light water. Due to the burn up of the lower end of the cadmium section during the reactor operation, the presently used rods for reactivity control of the BR-2 reactor have to be replaced by new ones. Considered are various types Control Rods with full active part of the following materials: cadmium (Cd), hafnium (Hf), europium oxide (Eu2O3) and gadolinium (Gd2O3). Options to decrease the burn up of the control rod material in the hot spot, such as use of stainless steel in the lower active part of the Control Rod are discussed. Comparison with the characteristics of the presently used Control Rods types is performed. The changing of the characteristics of different types Control Rods and the perturbation effects on the reactor neutronics during the BR-2 fuel cycle are investigated. The burn up of the Control Rod absorbing material, total and differential control rods worth, macroscopic and effective microscopic absorption cross sections, fuel and reactivity evolution are evaluated during approximately 30 operating cycles.

  11. Optimized Control Rods of the BR2 Reactor

    International Nuclear Information System (INIS)

    Kalcheva, Silva; Koonen, E.

    2007-01-01

    At the present time the BR-2 reactor uses control elements with cadmium as neutron absorbing part. The lower section of the control element is a beryllium assembly cooled by light water. Due to the burn up of the lower end of the cadmium section during the reactor operation, the presently used rods for reactivity control of the BR-2 reactor have to be replaced by new ones. Considered are various types Control Rods with full active part of the following materials: cadmium (Cd), hafnium (Hf), europium oxide (Eu2O3) and gadolinium (Gd2O3). Options to decrease the burn up of the control rod material in the hot spot, such as use of stainless steel in the lower active part of the Control Rod are discussed. Comparison with the characteristics of the presently used Control Rods types is performed. The changing of the characteristics of different types Control Rods and the perturbation effects on the reactor neutronics during the BR-2 fuel cycle are investigated. The burn up of the Control Rod absorbing material, total and differential control rods worth, macroscopic and effective microscopic absorption cross sections, fuel and reactivity evolution are evaluated during approximately 30 operating cycles.

  12. Ab initio potential and rotational spectra of the CO-N2 complex

    Science.gov (United States)

    Surin, L. A.; Tarabukin, I. V.; Schlemmer, S.; Kalugina, Y. N.; van der Avoird, A.

    2018-01-01

    Ab initio calculations of the intermolecular potential energy surface (PES) of CO-N2 have been carried out using the closed-shell single- and double-excitation coupled cluster approach with a non-iterative perturbative treatment of triple excitations method and the augmented correlation-consistent quadruple-zeta (aug-cc-pVQZ) basis set supplemented with midbond functions. The global minimum (De = 117.35 cm-1) of the four-dimensional PES corresponds to an approximately T-shaped structure with the N2 subunit forming the leg and CO the top. The bound rovibrational levels of the CO-N2 complex were calculated for total angular momenta J = 0-8 on this intermolecular potential surface. The calculated dissociation energies D0 are 75.60 and 76.79 cm-1 for the ortho-N2 (A-symmetry) and para-N2 (B-symmetry) nuclear spin modifications of CO-N2, respectively. Guided by these bound state calculations, a new millimeter-wave survey for the CO-N2 complex in the frequency range of 110-145 GHz was performed using the intracavity OROTRON jet spectrometer. Transitions not previously observed were detected and assigned to the subbands connecting the K = 0 and 1, (jCO, jN2) = (1, 0) states with a new K = 1, (jCO, jN2) = (2, 0) state. Finally, the measured rotational energy levels of the CO-N2 complex were compared to the theoretical bound state results, thus providing a critical test of the quality of the PES presented. The computed rovibrational wave functions were analyzed to characterize the nature of the different bound states observed for the two nuclear spin species of CO-N2.

  13. Foxa2 and Hif1ab regulate maturation of intestinal goblet cells by modulating agr2 expression in zebrafish embryos.

    Science.gov (United States)

    Lai, Yun-Ren; Lu, Yu-Fen; Lien, Huang-Wei; Huang, Chang-Jen; Hwang, Sheng-Ping L

    2016-07-15

    Mammalian anterior gradient 2 (AGR2), an endoplasmic reticulum (ER) protein disulfide-isomerase (PDI), is involved in cancer cell growth and metastasis, asthma and inflammatory bowel disease (IBD). Mice lacking Agr2 exhibit decreased Muc2 protein in intestinal goblet cells, abnormal Paneth cell development, ileitis and colitis. Despite its importance in cancer biology and inflammatory diseases, the mechanisms regulating agr2 expression in the gastrointestinal tract remain unclear. In the present study, we investigated the mechanisms that control agr2 expression in the pharynx and intestine of zebrafish by transient/stable transgenesis, coupled with motif mutation, morpholino knockdown, mRNA rescue and ChIP. A 350 bp DNA sequence with a hypoxia-inducible response element (HRE) and forkhead-response element (FHRE) within a region -4.5 to -4.2 kbp upstream of agr2 directed EGFP expression specifically in the pharynx and intestine. No EGFP expression was detected in the intestinal goblet cells of Tg(HREM:EGFP) or Tg(FHREM:EGFP) embryos with mutated HRE or FHRE, whereas EGFP was expressed in the pharynx of Tg(HREM:EGFP), but not Tg(FHREM:EGFP), embryos. Morpholino knockdown of foxa1 (forkhead box A1) reduced agr2 levels in the pharynx, whereas knockdown of foxa2 or hif1ab decreased intestinal agr2 expression and affected the differentiation and maturation of intestinal goblet cells. These results demonstrate that Foxa1 regulates agr2 expression in the pharynx, whereas both Foxa2 and Hif1ab control agr2 expression in intestinal goblet cells to regulate maturation of these cells. © 2016 The Author(s). published by Portland Press Limited on behalf of the Biochemical Society.

  14. Distribution and dosimetry of indium-111 labeled F(ab')2 fragments in humans

    International Nuclear Information System (INIS)

    Doherty, P.; Schwinger, R.; King, M.; Gionet, M.

    1986-01-01

    The purpose of this study was to obtain quantitative biodistribution data in patients injected with the indium-111 labeled F(ab') 2 fragments of mouse monoclonal antibody. From this data dosimetric calculations were made for the individual organs. The authors also evaluated the quantitative properties of SPECT in this application and compared it with the more conventional two view planar technique in both phantom and patient studies. For one antibody (19-9) the mean dose in rads/mCi for the organs of highest accumulation, namely, the liver and kidneys was 3.2 and 2.6 respectively. Preliminary data from another antibody (OC 125) showed much higher blood levels and a significantly lower liver dose of 2.3 indicating that antibody type is another significant determinant in dosimetry. The SPECT approach particularly in the presence of background activity, was more accurate in the phantom studies and resulted in larger estimated doses in the patient studies. Also, SPECT has the added advantage of providing an index of organ volume, which has to be balanced with the fact the planar is more rapid, and does not require special hardware. 24 references, 5 figures, 1 table

  15. Ab initio prediction of electronic, transport and bulk properties of Li2S

    Science.gov (United States)

    Malozovsky, Yuriy; Franklin, Lashounda; Ekuma, Chinedu; Bagayoko, Diola

    2015-08-01

    In this paper, we present results from ab initio, self-consistent, local density approximation (LDA) calculations of electronic and related properties of cubic antifluorite (anti-CaF2) lithium sulfide (Li2S). Our nonrelativistic computations implemented the linear combination of atomic orbital (LCAO) formalism following the Bagayoko, Zhao and Williams method, as enhanced by Ekuma and Franklin (BZW-EF). Consequently, using several self-consistent calculations with increasing basis sets, we searched for the smallest basis set that yields the absolute minima of the occupied energies. The outcomes of the calculation with this basis set, called the optimal basis set, have the full physical content of density functional theory (DFT). Our calculated indirect band gap, from Γ to X, is 3.723 eV, for the low temperature experimental lattice constant of 5.689 Å. The predicted indirect band gap of 3.702 eV is obtained for the computationally determined equilibrium lattice constant of 5.651 Å. We have also calculated the total density of states (DOS) and partial densities of states (pDOS), electron and hole effective masses and the bulk modulus of Li2S. Due to a lack of experimental results, most of the calculated ones reported here are predictions for this material suspected of exhibiting a high temperature superconductivity similar to that of MgB2.

  16. Training strategies and outcomes of ab interno trabeculectomy with the trabectome [version 2; referees: 2 approved

    Directory of Open Access Journals (Sweden)

    Katherine Fallano

    2017-05-01

    Full Text Available Plasma-mediated ab interno trabeculectomy with the trabectome was first approved by the US Food and Drug Administration in 2004 for use in adult and pediatric glaucomas. Since then, increased clinical experience and updated outcome data have led to its expanded use, including a range of glaucomas and angle presentations, previously deemed to be relatively contraindicated. The main benefits are a high degree of safety, ease, and speed compared to traditional filtering surgery and tube shunts. The increasing burden of glaucoma and expanding life expectancy has resulted in demand for well-trained surgeons. In this article, we discuss the results of trabectome surgery in standard and nonstandard indications. We present training strategies of the surgical technique that include a pig eye model, and visualization exercises that can be performed before and at the conclusion of standard cataract surgery in patients who do not have glaucoma. We detail the mechanism of enhancing the conventional outflow pathway and describe methods of visualization and function testing.

  17. Degradation mechanisms of high-energy bipolar nickel metal hydride battery with AB5 and A2B7 alloys

    International Nuclear Information System (INIS)

    Zhou, X.; Young, K.; West, J.; Regalado, J.; Cherisol, K.

    2013-01-01

    Highlights: •Failure modes of NiMH battery with AB 5 and A 2 B 7 alloys were reported. •Stable gamma-NiOOH was formed with the incorporation of Al from negative electrode. •The formation of gamma-NiOOH caused capacity degradation in AB 5 -containing battery. •Pulverization of the main A 2 B 7 phase is the main failure mode for A 2 B 7 -containing battery. -- Abstract: The failure modes of nickel/metal hydride batteries made from conventional AB 5 and La-only Mg-containing A 2 B 7 metal hydride alloys were studied at the end of 70% state-of-charge cycle life testing (reaching below 3.1 Ah capacity in a 5.5 Ah design cell) by the combination of inductively coupled plasma, scanning electron microscope, X-ray energy dispersive spectroscopy and composition mapping, and X-ray diffraction analysis. The capacity degradation of cell with AB 5 alloy was found to have been caused by the combination of metal hydride alloy oxidation and non-reversible γ-NiOOH phase formation, which was promoted by the incorporation of Al leached out from the oxidation product of the Al-containing negative electrode. In the cell with Al-free A 2 B 7 alloy, the end of cycle life was the result of pulverization in the main A 2 B 7 phase

  18. Quality assurance in the project of RECH-2 research reactor

    International Nuclear Information System (INIS)

    Goycolea Donoso, C.; Nino de Zepeda Schele, A.

    1989-01-01

    The implantation of a Quality Assurance Program for the design, supply, construction, installation, and testing of the RECH-2 research reactor, is described in this paper. The obtained results, demonstrate that a Quality Assurance Program constitutes a suitable mean to assure that the installation complies with the safety and reliability requirements. (author)

  19. High pressure behaviour of uranium dicarbide (UC{sub 2}): Ab-initio study

    Energy Technology Data Exchange (ETDEWEB)

    Sahoo, B. D., E-mail: bdsahoo@barc.gov.in; Mukherjee, D.; Joshi, K. D.; Kaushik, T. C. [Applied Physics Division, Bhabha Atomic Research Centre, Mumbai 400085 (India)

    2016-08-28

    The structural stability of uranium dicarbide has been examined under hydrostatic compression employing evolutionary structure search algorithm implemented in the universal structure predictor: evolutionary Xtallography (USPEX) code in conjunction with ab-initio electronic band structure calculation method. The ab-initio total energy calculations involved for this purpose have been carried out within both generalized gradient approximations (GGA) and GGA + U approximations. Our calculations under GGA approximation predict the high pressure structural sequence of tetragonal → monoclinic → orthorhombic for this material with transition pressures of ∼8 GPa and 42 GPa, respectively. The same transition sequence is predicted by calculations within GGA + U also with transition pressures placed at ∼24 GPa and ∼50 GPa, respectively. Further, on the basis of comparison of zero pressure equilibrium volume and equation of state with available experimental data, we find that GGA + U approximation with U = 2.5 eV describes this material better than the simple GGA approximation. The theoretically predicted high pressure structural phase transitions are in disagreement with the only high experimental study by Dancausse et al. [J. Alloys. Compd. 191, 309 (1993)] on this compound which reports a tetragonal to hexagonal phase transition at a pressure of ∼17.6 GPa. Interestingly, during lowest enthalpy structure search using USPEX, we do not see any hexagonal phase to be closer to the predicted monoclinic phase even within 0.2 eV/f. unit. More experiments with varying carbon contents in UC{sub 2} sample are required to resolve this discrepancy. The existence of these high pressure phases predicted by static lattice calculations has been further substantiated by analyzing the elastic and lattice dynamic stability of these structures in the pressure regimes of their structural stability. Additionally, various thermo-physical quantities such as

  20. Ab initio study of the EFG tensor at Cd impurities in Sc2O3 semiconductor

    International Nuclear Information System (INIS)

    Munoz, E.L.; Richard, D.; Errico, L.A.; Renteria, M.

    2009-01-01

    We present an ab initio study of diluted Cd impurities localized at both cation sites of the semiconductor Sc 2 O 3 . The electric-field-gradient (EFG) tensor at Cd impurities located at both cationic sites of the host structure was determined from the calculation of the electronic structure of the doped system. Calculations were performed with the full-potential augmented-plane wave plus local orbitals (APW+lo) method within the framework of the density functional theory. We studied the atomic structural relaxations and the perturbation of the electronic charge density induced by the impurities in the host system in a fully self-consistent way. We showed that the Cd impurity introduces an increase of 8% in the nearest oxygen neighbors bond-lengths, changing the EFG sign for probes located at the asymmetric cation site. The APW+lo predictions for the charged state of the Cd impurity were compared with EFG results existent in the literature, coming from time-differential γ-γ perturbed-angular-correlations experiments performed on 111 Cd-implanted Sc 2 O 3 powder samples. From the excellent agreement between theory and experiment, we can strongly suggest that the Cd acceptor impurities are ionized at room temperature. Finally, we showed that simple calculations like those performed within the point-charge model with antishielding factors do not correctly describe the problem of a Cd impurity in Sc 2 O 3 .

  1. Ab initio ro-vibronic spectroscopy of SiCCl (X{sup ~2}Π)

    Energy Technology Data Exchange (ETDEWEB)

    Brites, Vincent [Université d’Evry Val d’Essonne, Laboratoire Analyse et Modélisation pour la Biologie et l’Environnement, LAMBE CNRS UMR 8587, Boulevard F. Mitterrand, 91025 Evry Cedex (France); Mitrushchenkov, Alexander O.; Léonard, Céline, E-mail: celine.leonard@u-pem.fr [Université Paris-Est, Laboratoire Modélisation et Simulation Multi Echelle, MSME UMR 8208 CNRS, 5 bd Descartes, 77454 Marne-la-Vallée (France); Peterson, Kirk A. [Department of Chemistry, Washington State University, Pullman, Washington 99164 (United States)

    2014-07-21

    The full dimensional potential energy surfaces of the {sup 2}A{sup ′} and {sup 2}A{sup ′′} electronic components of X{sup ~2}Π SiCCl have been computed using the explicitly correlated coupled cluster method, UCCSD(T)-F12b, combined with a composite approach taking into account basis set incompleteness, core-valence correlation, scalar relativity, and higher order excitations. The spin-orbit and dipole moment surfaces have also been computed ab initio. The ro-vibronic energy levels and absorption spectrum at 5 K have been determined from variational calculations. The influence of each correction on the fundamental frequencies is discussed. An assignment is proposed for bands observed in the LIF experiment of Smith et al. [J. Chem. Phys. 117, 6446 (2002)]. The overall agreement between the experimental and calculated ro-vibronic levels is better than 7 cm{sup −1} which is comparable with the 10–20 cm{sup −1} resolution of the emission spectrum.

  2. Electronic and magnetic properties of α-MnO2 from ab initio calculations

    Science.gov (United States)

    Crespo, Y.; Seriani, N.

    2013-10-01

    α-MnO2, an active catalyst for oxygen reduction and evolution reactions, has been investigated using ab initio calculations with different exchange-correlation functionals: the generalized-gradient approximation in the version of Perdew, Burke, and Ernzerhof (PBE), PBE+U, and hybrid functionals. Both hybrid functionals and PBE+U (U≥2.0 eV) fail to capture the antiferromagnetic (AFM) ground state found experimentally, and a ferromagnetic configuration has the lowest energy. An AFM ground state is then recovered when using PBE or PBE+U (U≤1.6 eV). Interestingly, a reduction of the gap is observed at increasing values of the U parameter. We offer a qualitative explanation for the change in the calculated ground state employing the results for the electronic structure and physical arguments similar to those exposed in the Goodenough-Kanamori-Anderson rules. It is argued that the pz orbital of oxygen atoms with sp2 hybridization plays a fundamental role in the superexchange AFM interaction and in the reduction of the gap.

  3. Ab initio thermodynamic evaluation of Pd atom interaction with CeO(2) surfaces.

    Science.gov (United States)

    Mayernick, Adam D; Janik, Michael J

    2009-08-28

    Palladium supported on ceria is an effective catalytic material for three-way automotive catalysis, catalytic combustion, and solid-oxide fuel cell (SOFC) anodes. The morphology, oxidation state, and particle size of Pd on ceria affect catalytic activity and are a function of experimental conditions. This work utilizes ab initio thermodynamics using density functional theory (DFT) (DFT+U) methods to evaluate the stability of Pd atoms, PdO(x) species, and small Pd particles in varying configurations on CeO(2) (111), (110), and (100) single crystal surfaces. Over specific oxygen partial pressure and temperature ranges, palladium incorporation to form a mixed surface oxide is thermodynamically favorable versus other single Pd atom states on each ceria surface. For example, Pd atoms may incorporate into Ce fluorite lattice positions in a Pd(4+) oxidation state on the CeO(2) (111) surface. The ceria support shifts the transition between formal Pd oxidation states (Pd(0), Pd(2+), Pd(4+)) relative to bulk palladium and stabilizes certain oxidized palladium species on each surface. We show that temperature, oxygen pressure, and cell potential in a SOFC can influence the stable states of palladium supported on ceria surfaces, providing insight into structural stability during catalytic operation.

  4. Vibrational spectrum, ab initio calculations, conformational stabilities and assignment of fundamentals of 1,2-dibromopropane

    Science.gov (United States)

    LaPlante, Arthur J.; Stidham, Howard D.

    2009-10-01

    The mid and far infrared and the Raman spectrum of 1,2-dibromopropane is reported in solid, liquid and gas. Several bands reported by earlier workers are not present in the spectrum of the purified material. Ab initio calculations of optimized geometry, energy, dipole moment, molar volume, vibrational spectrum and normal coordinate calculation were performed using the density functional B3LYP/6-311++g(3df,2pd), and the results used to assist a complete assignment of the 81 fundamental modes of vibrations of the three conformers of 1,2-dibromopropane. Relative energies found conformer A the lowest with G and G' at 815.6 and 871.4 cm -1 higher. The temperature dependence of the Raman spectrum of the liquid was investigated in the CCC bending region and the relative energies determined. It was found that the G' and G conformers lie 236 ± 11 and 327 ±11 cm -1, respectively above the A conformer, leading to the room temperature composition of the liquid as A, 65 ± 1; G', 21 ± 1; G, 14 ± 1%. It is apparent that the calculated highest energy conformer G' is stabilized more than the G conformer in the liquid. The G' conformer has the lowest molar volume effectively changing the interaction distance between conformers in the liquid, and enhancing the effect of its dipole moment.

  5. Kraft Pulp Bleaching and Delignification by Dikaryons and Monokaryons of Trametes versicolor

    Science.gov (United States)

    Addleman, Katherine; Archibald, Frederick

    1993-01-01

    The ability of 10 dikaryotic and 20 monokaryotic strains of Trametes (Coriolus) versicolor to bleach and delignify hardwood and softwood kraft pulps was assessed. A dikaryon (52P) and two of its mating-compatible monokaryons (52J and 52D) derived via protoplasting were compared. All three regularly bleached hardwood kraft pulp more than 20 brightness points (International Standards Organization) in 5 days and softwood kraft pulp the same amount in 12 days. Delignification (kappa number reduction) by the dikaryon and the monokaryons was similar, but the growth of the monokaryons was slower. Insoluble dark pigments were commonly found in the mycelium, medium, and pulp of the dikaryon only. Laccase and manganese peroxidase (MnP) but not lignin peroxidase activities were secreted during bleaching by all three strains. Their laccase and MnP isozyme patterns were compared on native gels. No segregation of isozyme bands between the monokaryons was found. Hardwood kraft pulp appeared to adsorb several laccase isozyme bands. One MnP isozyme (pI, 3.2) was secreted in the presence of pulp by all three strains, but a second (pI, 4.9) was produced only by 52P. A lower level of soluble MnP activity in one monokaryon (52D) was associated with reduced bleaching ability and a lower level of methanol production. Since monokaryon 52J bleached pulp better than its parent dikaryon 52P, especially per unit of biomass, this genetically simpler monokaryon will be the preferred subject for further genetic manipulation and improvement of fungal pulp biological bleaching. Images PMID:16348851

  6. Kinetics of liquid-solid reactions in naphthenic acid conversion and Kraft pulping

    Science.gov (United States)

    Yang, Ling

    Two liquid-solid reactions, in which the morphology of the solid changes as the reactions proceeds, were examined. One is the NA conversion in oil by decarboxylation on metal oxides and carbonates, and the other is the Kraft pulping in which lignin removal by delignification reaction. In the study of the NA conversion, CaO was chosen as the catalyst for the kinetic study from the tested catalysts based on NA conversion. Two reaction mixtures, carrier oil plus commercial naphthenic acids and heavy vacuum gas oil (HVGO) from Athabasca bitumen, were applied in the kinetic study. The influence of TAN, temperature, and catalyst loading on the NA conversion and decarboxylation were studied systematically. The results showed that the removal rate of TAN and the decarboxylation of NA were both independent of the concentration of NA over the range studied, and significantly dependent on reaction temperature. The data from analyzing the spent catalyst demonstrated that calcium naphthenate was an intermediate of the decarboxylation reaction of NA, and the decomposition of calcium naphthenate was a rate-determining step. In the study on the delignification of the Kraft pulping, a new mechanism was proposed for the heterogeneous delignification reaction during the Kraft pulping process. In particular, the chemical reaction mechanism took into account the heterogeneous nature of Kraft pulping. Lignin reacted in parallel with sodium hydroxide and sodium sulfide. The mechanism consists of three key kinetic steps: (1) adsorption of hydroxide and hydrosulfide ions on lignin; (2) surface reaction on the solid surface to produce degraded lignin products; and (3) desorption of degradation products from the solid surface. The most important step for the delignification process is the surface reaction, rather than the reactions occurring in the liquid phase. A kinetic model has, thus, been developed based on the proposed mechanism. The derived kinetic model showed that the mechanism

  7. A new safety principle for the SLOWPOKE-2 reactor

    Energy Technology Data Exchange (ETDEWEB)

    Yue, S., E-mail: yues@aecl.ca [Atomic Energy of Canada Limited, Chalk River, Ontario (Canada); Polugari, S. [Atomic Energy of Canada Limited, Chalk River, Ontario (Canada); Ryerson Univ., Toronto, Ontario (Canada); Anghel, V. [Atomic Energy of Canada Limited, Chalk River, Ontario (Canada); Hilborn, J. [Deep River, Ontario (Canada); Sur, B. [Atomic Energy of Canada Limited, Chalk River, Ontario (Canada)

    2013-06-15

    SLOWPOKE-2 (LEU core) is a pool-type nuclear reactor with a maximum nominal thermal power of 20 kW. It uses a pelletized uranium oxide fuel (19.9% enrichment) and provides a useful high neutron flux in the order of 10{sup 12} n{center_dot}cm{sup 2}s{sup -1}. The key safety features built into the reactor design are the strictly limited amount of excess reactivity and the negative reactivity feedback characteristics, which provide a demonstrably safe self-limiting power excursion response to large reactivity insertions. However, the limited amount of excess reactivity also limits continuous prolonged reactor operation at full power. With a 4 mk excess reactivity, the reactor can operate for about one day at full power, 20 kW, before criticality is lost due to temperature effects and xenon poisoning. A new safety concept is proposed in this paper that enables the continuous operation to a few months by increasing the excess reactivity from 4 mk to 8 mk. A Matlab/simulink model of SLOWPOKE-2 has demonstrated that core operation life can be extended to several months without adding a beryllium shim. (author)

  8. A new safety principle for the SLOWPOKE-2 reactor

    International Nuclear Information System (INIS)

    Yue, S.; Polugari, S.; Anghel, V.; Hilborn, J.; Sur, B.

    2013-01-01

    SLOWPOKE-2 (LEU core) is a pool-type nuclear reactor with a maximum nominal thermal power of 20 kW. It uses a pelletized uranium oxide fuel (19.9% enrichment) and provides a useful high neutron flux in the order of 10 12 n·cm 2 s -1 . The key safety features built into the reactor design are the strictly limited amount of excess reactivity and the negative reactivity feedback characteristics, which provide a demonstrably safe self-limiting power excursion response to large reactivity insertions. However, the limited amount of excess reactivity also limits continuous prolonged reactor operation at full power. With a 4 mk excess reactivity, the reactor can operate for about one day at full power, 20 kW, before criticality is lost due to temperature effects and xenon poisoning. A new safety concept is proposed in this paper that enables the continuous operation to a few months by increasing the excess reactivity from 4 mk to 8 mk. A Matlab/simulink model of SLOWPOKE-2 has demonstrated that core operation life can be extended to several months without adding a beryllium shim. (author)

  9. Efficacy of IgG, Fab, and F(ab')2 fragments of horse antivenom in the ...

    African Journals Online (AJOL)

    The ability of horse antivenoms, consisting of immunoglobulin G (IgG) and its fragments F(ab')2 and Fab were comparatively studied in mice to neutralize several effects of Cerastes cerastes venom. The three antivenoms were produced from the same batch of hyperimmune horse plasma. Neutralization was only partial ...

  10. 2,3-Dehydrosilybin A/B as a pro-longevity and anti-aggregation compound

    Czech Academy of Sciences Publication Activity Database

    Filippopoulou, K.; Papaevgeniou, N.; Lefakia, M.; Paraskevopoulou, A.; Biedermann, David; Křen, Vladimír; Chondrogianni, N.

    2017-01-01

    Roč. 103, FEB 2017 (2017), s. 256-267 ISSN 0891-5849 R&D Projects: GA MŠk(CZ) LD15081 Institutional support: RVO:61388971 Keywords : 2,3-dehydrosilybin A/B * Anti-aging * Anti-aggregation Subject RIV: CE - Biochemistry OBOR OECD: Biochemistry and molecular biology Impact factor: 5.606, year: 2016

  11. Post-treatment of anaerobic effluent by ozone and ozone/UV of a kraft cellulose pulp mill.

    Science.gov (United States)

    Chaparro, T R; Pires, E C

    2015-01-01

    Pulp and paper mill effluents represent a challenge when treatment technologies are considered, not only to reduce organic matter, but also to reduce the toxicological effects. Although anaerobic treatment has shown promising results, as well as advantages when compared with an aerobic system, this process alone is not sufficient to reduce recalcitrant compounds. Thus, an advanced oxidation process was applied. This experiment was performed to determine the effect of ozone and ozone/UV treating a horizontal anaerobic immobilized biomass reactor effluent from a kraft cellulose pulp mill for 306 days with an organic volumetric load of 2.33 kgCOD/m³/day. The removal of organic compounds was measured by the following parameters: adsorbable organically bound halogens (AOX), total phenols, chemical oxygen demand (COD), dissolved organic carbon and absorbance values in the UV-visible spectral region. Moreover, ecotoxicity and genotoxicity tests were conducted before and after treatment with ozone and ozone/UV. At an applied ozone dosage of 0.76 mgO₃/mgCOD and an applied UV dosage of 3.427 Wh/m(3), the organochlorine compounds measured as AOX reached removal efficiencies of 40%. Although the combination of ozone/UV showed better results in colour (79%) and total phenols (32%) compared with only ozone, the chronic toxicity and the genotoxicity that had already been removed in the anaerobic process were slightly increased.

  12. Ab-Initio Computations of Electronic and Related Properties of cubic Lithium Selenide (Li2Se)

    Science.gov (United States)

    Goita, Abdoulaye; Nwigboji, Ifeanyi H.; Malozovsky, Yuriy; Bagayoko, Diola

    We present theoretical predictions, from ab-initio, self-consistent calculations, of electronic and related properties of cubic lithium selenide (Li2Se). We employed a local density approximation (LDA) potential and the linear combination of atomic orbitals (LCAO). We performed the computations following the Bagayoko, Zhao, and Williams (BZW) method, as enhanced by Ekuma and Franklin (BZW-EF). Our results include electronic energies, total and partial densities of states, effective masses, and the bulk modulus. The theoretical equilibrium lattice constant is 5.882 Å. We found cubic Li2Se to have a direct band gap of 4.363 eV (prediction), at Γ. This gap is 4.065 eV for a room temperature lattice constant of 6.017 Å. The calculated bulk modulus is 31.377 GPa. Acknowledgments: This work was funded in part by the National Science Foundation (NSF) and the Louisiana Board of Regents, through LASiGMA [Award Nos. EPS- 1003897, NSF (2010-15)-RII-SUBR] and NSF HRD-1002541, the US Department of Energy - National, Nuclear Security Administration (NNSA) (Award No. DE- NA0002630), LaSPACE, and LONI-SUBR.

  13. Ab initio study of basal slip in Nb2AlC

    International Nuclear Information System (INIS)

    Music, Denis; Sun, Zhimei; Voevodin, Andrey A; Schneider, Jochen M

    2006-01-01

    Using ab initio calculations, we have studied shearing in Nb 2 AlC, where NbC and Al layers are interleaved. The stress-strain analysis of this deformation mode reveals Nb-Al bond breaking, while the Nb-C bond length decreases by 4.1%. Furthermore, there is no evidence for phase transformation during deformation. This is consistent with basal slip and may be understood on the basis of the electronic structure: bands below the Fermi level are responsible for the dd bonding between NbC basal planes and only a single band with a weak dd interaction is not resistant to shearing, while all other bands are unaffected. The Al-Nb bonding character can be described as mainly metallic with weak covalent-ionic contributions. Our study demonstrates that Al layers move with relative ease under shear strain. Phase conservation upon shearing is unusual for carbides and may be due to the layered nature of the phase studied. Here, we describe the electronic origin of basal slip in Nb 2 AlC, the atomic mechanism which enables reversible plasticity in this class of materials

  14. Radioimmunotherapy of human colon cancer xenografts by using 131I labeled-CAb1 F(ab')2

    International Nuclear Information System (INIS)

    Li Ling; Xu Huiyun; Mi Li; Bian Huijie; Qin Jun; Xiong Hua; Feng Qiang; Wen Ning; Tian Rong; Xu Liqing; Shen Xiaomei; Tang Hao; Chen Zhinan

    2006-01-01

    Purpose: Therapeutic efficacy, suitable dose, and administration times of 131 I-CAb 1 F(ab') 2 , a new monoclonal antibody therapeutics specifically directed against a cell surface-associated glycoprotein of colon cancer, were investigated in this article. Methods and Materials: In human colon cancer xenografts, 131 I-CAb 1 F(ab') 2 at the dose of 125 μCi, 375 μCi, and 1125 μCi were administrated intraperitoneally on Days 6 and 18 after implantation of HR8348 cells with CAb 1 high reactivity. Survival time and tumor growth inhibition rate were used to evaluate the efficacy and safety of 131 I-CAb 1 F(ab') 2 in treatment of colon cancer xenografts. Results: Treatment of 125, 375, and 1125 μCi 131 I-CAb1 F(ab') 2 did not significantly decrease the mean survival time of nude mice when compared with nontreated groups (p = 0.276, 0.865, 0.582, respectively). Moreover, the mean survival times of nude mice receiving 375 μCi and 1125 μCi 131 I-CAb1 F(ab') 2 were significantly longer than that of 5-FU-treated groups (p 0.018 and 0.042). Tumor growth inhibition rates of the first therapy were 35.67% and 41.37%, with corresponding 131 I-labeled antibody dosage of 375 μCi and 1125 μCi. After single attack dosage, second reinforcement therapy may rise efficacy significantly. Tumor growth inhibition rates of 125 μCi, 375 μCi, and 1125 μCi 131 I-labeled antibody on Day 20 posttherapy were 42.65%, 56.56%, and 84.41%, respectively. Histopathology examination revealed that tissue necrosis of various degrees was found in 131 I-CAb1 F(ab') 2 -treated groups. Conclusion: 131 I-CAb 1 F(ab') 2 is safe and effective for colon cancer. It may be a novel and potentially adjuvant therapeutics for colon cancer

  15. Ab Initio Description of Disordered Sr1−xKxFe2As2 Using the Coherent Potential Approximation

    KAUST Repository

    Pulikkotil, J. J.

    2010-04-29

    The electronic structure of disordered Sr1−xKxFe2As2 is studied by ab initio density functional theory. As no superstructure and/or atomic short range ordering is reported for Sr1−xKxFe2As2, the coherent potential approximation can be used to describe the effects of chemical disorder. We find clear deviations from the rigid band model characteristics. Nonmagnetic calculations show an enhancement of the density of states at the Fermi energy in the range 0.4≤x≤0.65, which coincides with the region where experiments observe an enhanced superconducting transition temperature, and antiferromagnetic calculations indicate a significant renormalization of states at Fermi energy. Analyzing the distribution of the Fe 3d states over the range 0≤x≤1 we propose an effective three band model.

  16. Laboratory and clinical evaluation of the radiation-potentiating activity of ethyl-N-bis (2,2-dimethylethylamidinophosphoro) carbamate (AB-132)

    International Nuclear Information System (INIS)

    Regelson, W.; Hananian, J.; Bozzini, M.; Ambrus, C.M.; Bardos, T.J.; Ambrus, J.L.

    1975-01-01

    Ethyl-N-bis (2,2(dimethylethylamidinophosphoro) carbamate (AB-132) has been shown to potentiate the effect of whole-body radiation on inhibition of splenomegaly induced by Friend leukemia virus in ICR/H Swiss mice. The combined effect of AB-132 and radiation does not appear to be related to Friend virus inhibition but seems to act on the proliferating tumor in the spleen. Nine children with advanced cancer were treated with combined adminstration of local radiation and systemic AB-132. Although regression of tumor was seen, no dramatic effect on survival was apparent. One case of metastatic Ewing's sarcoma showed systemic tumor response to AB-132 in addition to localized response to radiation. Bone marrow depression appeared to be the main side effect of combination therapy

  17. Immunoscintigraphy of human pancreatic carcinoma in nude mice with I-131-F(ab')/sub 2/-fragments of monoclonal antibodies

    International Nuclear Information System (INIS)

    Senekowitsch, R.; Maul, F.D.; Wenisch, H.J.C.; Kriegel, H.; Hor, G.

    1985-01-01

    In the present study radioiodinated F(ab')/sub 2/-fragments of CA19-9 and antibody that reacts specifically with human gastrointestinal cancer were examined for their ability to detect human pancreatic carcinoma hosted in nude mice. Tumor-bearing mice received 80μCi of I-131-F(ab')/sub 2/ with a specific activity of 1.8μCi/μg. All mice were imaged after the injection and every 24hr up to 6 days. The retained radioactivity was also registered with a whole-body counter immediately after imaging. As a control F(ab's)/sub 2/ of a nonspecific antibody were administered in parallel to another group of animals bearing the same tumor. Three animals of each group were killed at 1,2,4 and 8 days for determination of the distribution of both labeled antibody-fragments. On scintigraphic images obtained with the CA19-9-F(ab')/sub 2/ the tumors could be visualized 24hr after injection, the best dilineation however was achieved 96hr p.i.. The biodistribution data exhibited a more rapid blood clearance for the specific fragments compared to that for the unspecific ones. Tumors showed an increase in uptake up to 48hr reaching 1.7% of the injected dose per gram, declining to values of 0.08%/g at day 6 p.i.. The highest tumor-to-blood ratios were found after 96h. They were 7 for the CA19-9-fragments compared to 1.5 for the unspecific fragments. The whole body counting revealed a more rapid excretion for the fragments of the specific monoclonal antibodies than for the unspecific ones. In summary the authors were able to show that CA19-9-F(ab')/sub 2/-fragments can be used for immunodetection of human pancreatic carcinoma hosted in nude mice

  18. Planned Scientific programs around the Triga Mark 2 Reactor

    International Nuclear Information System (INIS)

    Majah, M Ibn.

    2007-01-01

    Full text: Nuclear techniques have been introduced to Morocco since the sixties. After the energy crisis of 1973, Morocco decides to create the National Center for Energy Sciences and Nuclear Techniques (CNESTEN) under the supervision of the Ministry of high Education and Research, with a research commercial and support vocation. CNESTEN is in charge of promoting nuclear application, to act as technical support for the authorities and to prepare the technological basis for nuclear power option. In 1998, CNESTEN started the construction of Nuclear Research Centre. The on going activities cover many sectors : earth and environmental sciences, high energy physics, safety and security, waste management. In 2001, CNESTEN started the construction of a 2MW TRiga Mark 2 Reactor, with the possibility to increase the power to 3 MW. The construction was achieved in January 2007. The operation of the reactor is expected for April 2007. The program of the utilization of the reactor was established with th contribution of the university and with the assistance of IAEA. Some of the experimental set-up installed around the reactor have been designed. CNESTEN has developed cooperation with Nuclear research centres from other countries and is receiving visitors and trainees mainly through the IAEA [fr

  19. Ab-initio Calculation of Optoelectronic and Structural Properties of Cubic Lithium Oxide (Li2O)

    Science.gov (United States)

    Ziegler, Joshua; Polin, Daniel; Malozovsky, Yuriy; Bagayoko, Diola

    Using the Bagayoko, Zhao, and Williams (BZW) method, as enhanced by Ekuma and Franklin (BZW-EF), we performed ab-initio, density functional theory (DFT) calculations of optoelectronic, transport, and bulk properties of Li2S. In so doing, we avoid ``band gap'' and problems plaguing many DET calculations [AIP Advances 4, 127104 (2014)]. We employed a local density approximation (LDA) potential and the linear combination of atomic orbitals (LCAO). With the BZW-EF method, our results possess the full, physical content of DFT and agree with available, corresponding experimental ones. In particular, we found a room temperature indirect band gap of 6.659 eV that compares favorably with experimental values ranging from 5 to 7.99 eV. We also calculated total and partial density of states (DOS and PDOS), effective masses of charge carriers, the equilibrium lattice constant, and the bulk modulus. Acknowledgments: This work was funded in part by the National Science Foundation (NSF) and the Louisiana Board of Regents, through LASiGMA [Award Nos. EPS- 1003897, NSF (2010-15)-RII-SUBR] and NSF HRD-1002541, the US Department of Energy - National, Nuclear Security Administration (NNSA) (Award Nos. DE-NA0001861 and DE- NA0002630), LaSPACE, and LONI-SUBR.

  20. Operation of the BR2 Reactor

    International Nuclear Information System (INIS)

    Gubel, P.

    2005-01-01

    The BR2 is still SCK-CEN's most important nuclear facility. After an extensive refurbishment of 22 months to compensate for the ageing of the installations, to enhance the reliability of operation and to comply with modern safety standards, it was restarted in April 1997. The facility is mainly used for the irradiation and testing of fuels and materials and for commercial productions - including radioisotopes for the medical and industrial uses, and NTD-Silicon. The article describes the main activities and achievements in 2004

  1. Cloning and characterization of TaPP2AbB"-α, a member of the PP2A regulatory subunit in wheat.

    Directory of Open Access Journals (Sweden)

    Dan Liu

    Full Text Available Protein phosphatase 2A (PP2A, a major Serine/Threonine protein phosphatase, consists of three subunits; a highly conserved structural subunit A, a catalytic subunit C, and a highly variable regulatory subunit B which determines the substrate specificity. Although the functional mechanism of PP2A in signaling transduction in Arabidopsis is known, their physiological roles in wheat remain to be characterized. In this study, we identified a novel regulatory subunit B, TaPP2AbB"-α, in wheat (Triticum aestivum L.. Subcellular localization indicated that TaPP2AbB"-α is located in the cell membrane, cytoplasm and nucleus. It interacts with both TaPP2Aa and TaPP2Ac. Expression pattern analyses revealed that TaPP2AbB"-α is strongly expressed in roots, and responds to NaCl, polyethylene glycol (PEG, cold and abscisic acid (ABA stresses at the transcription level. Transgenic Arabidopsis plants overexpressing TaPP2AbB"-α developed more lateral roots, especially when treated with mannitol or NaCl. These results suggest that TaPP2AbB"-α, in conjunction with the other two PP2A subunits, is involved in multi-stress response, and positively regulates lateral root development under osmotic stress.

  2. An Ab Initio MP2 Study of HCN-HX Hydrogen Bonded Complexes

    Directory of Open Access Journals (Sweden)

    Araújo Regiane C.M.U.

    1998-01-01

    Full Text Available An ab initio MP2/6-311++G** study has been performed to obtain geometries, binding energies and vibrational properties of HCN-HX H-bonded complexes with X = F, Cl, NC, CN and CCH. These MP2/6-311++G** results have revealed that: (i the calculated H-bond lengths are in very good agreement with the experimental ones; (ii the H-bond strength is associated with the intermolecular charge transfer and follows the order: HCN-HNC ~ HCN-HF > HCN-HCl ~ HCN-HCN > HCN-HCCH; (iii BSSE correction introduces an average reduction of 2.4 kJ/mol on the MP2/6-311++G** binding energies, i.e. 11% of the uncorrected binding energy; (iv the calculated zero-point energies reduce the stability of these complexes and show a good agreement with the available experimental values; (v the H-X stretching frequency is shifted downward upon H-bond formation. This displacement is associated with the H-bond length; (vi The more pronounced effect on the infrared intensities occurs with the H-X stretching intensity. It is much enhanced after complexation due to the charge-flux term; (vii the calculated intermolecular stretching frequencies are in very good agreement with the experimental ones; and, finally, (viii the results obtained for the HCN-HX complexes follow the same profile as those found for the acetylene-HX series but, in the latter case, the effects on the properties of the free molecules due to complexation are less pronounced than those in HCN-HX.

  3. Radioimmunoimaging of human colon carcinoma grafted into nudemice using 131I-labeled monoclonal anticea antibody and its F(ab')2 fragments

    International Nuclear Information System (INIS)

    Liu Guangda

    1988-01-01

    131 I-labeled monoclonal anti-CEA antibody and its F(ab') 2 fragments were injected into nude mice bearing human colon carcinoma xenografts for tumor localization and radioimmunoimaging studies. Transplanted tumors were visualized in 12 hours after injection of the labeled anti-CEA or its F(ab') 2 by gamma camera. Biodistribution data indicated that F(ab') 2 fragments were cleared more rapidly from blood (T 1/2 = 13.3 h for F(ab') 2 , T 1/2 = 21.1 h for intact antibody) over 6-24 h and had higher tumor blood ratios. The intact antibody was concentrated in the tumor better than F(ab') 2 . In double-label experiments, a nonspecific localization of the control ( 125 I-labeled anti-HCG) in the tumor was also observed

  4. Structural characterization of Mg substituted on A/B sites in NiFe2O4 ...

    Indian Academy of Sciences (India)

    2017-06-19

    Jun 19, 2017 ... In the present paper, we are reporting the synthesis of pure nickel and magnesium ferrite [ N i F e 2 O 4 , M g F e 2 O 4 ] and magnesium-substituted nickel ferrite ( N i 1 − x M g x / y F e 2 − y O 4 ; x = y = 0.60 ) on A/B sites withparticles size in nanometer range using autocombustion technique. In this study, it ...

  5. The strength of small: Improved targeting of Insulin-like Growth Factor-1 Receptor (IGF-1R) with F(ab')2-R1507 fragments in Ewing sarcomas

    NARCIS (Netherlands)

    Fleuren, Emmy D. G.; Versleijen-Jonkers, Yvonne M. H.; Heskamp, Sandra; Roeffen, Melissa H. S.; Bouwman, Wilbert H.; Molkenboer-Kuenen, Janneke D. M.; van Laarhoven, Hanneke W. M.; Oyen, Wim J. G.; Boerman, Otto C.; van der Graaf, Winette T. A.

    2013-01-01

    To investigate whether F(ab')2-fragments of the monoclonal Insulin-like Growth Factor-1 Receptor (IGF-1R) antibody R1507 (F(ab')2-R1507) can successfully target IGF-1R in Ewing sarcomas (ES). BALB/c nude mice were subcutaneously implanted with IGF-1R-expressing human ES xenografts (EW-5 and EW-8)

  6. Insect Resistance to Bacillus thuringiensis Toxin Cry2Ab Is Conferred by Mutations in an ABC Transporter Subfamily A Protein.

    Directory of Open Access Journals (Sweden)

    Wee Tek Tay

    2015-11-01

    Full Text Available The use of conventional chemical insecticides and bacterial toxins to control lepidopteran pests of global agriculture has imposed significant selection pressure leading to the rapid evolution of insecticide resistance. Transgenic crops (e.g., cotton expressing the Bt Cry toxins are now used world wide to control these pests, including the highly polyphagous and invasive cotton bollworm Helicoverpa armigera. Since 2004, the Cry2Ab toxin has become widely used for controlling H. armigera, often used in combination with Cry1Ac to delay resistance evolution. Isolation of H. armigera and H. punctigera individuals heterozygous for Cry2Ab resistance in 2002 and 2004, respectively, allowed aspects of Cry2Ab resistance (level, fitness costs, genetic dominance, complementation tests to be characterised in both species. However, the gene identity and genetic changes conferring this resistance were unknown, as was the detailed Cry2Ab mode of action. No cross-resistance to Cry1Ac was observed in mutant lines. Biphasic linkage analysis of a Cry2Ab-resistant H. armigera family followed by exon-primed intron-crossing (EPIC marker mapping and candidate gene sequencing identified three independent resistance-associated INDEL mutations in an ATP-Binding Cassette (ABC transporter gene we named HaABCA2. A deletion mutation was also identified in the H. punctigera homolog from the resistant line. All mutations truncate the ABCA2 protein. Isolation of further Cry2Ab resistance alleles in the same gene from field H. armigera populations indicates unequal resistance allele frequencies and the potential for Bt resistance evolution. Identification of the gene involved in resistance as an ABC transporter of the A subfamily adds to the body of evidence on the crucial role this gene family plays in the mode of action of the Bt Cry toxins. The structural differences between the ABCA2, and that of the C subfamily required for Cry1Ac toxicity, indicate differences in the

  7. Dalhousie SLOWPOKE-2 reactor: A nuclear analytical chemistry facility

    International Nuclear Information System (INIS)

    Chatt, A.; Holzbecher, J.

    1990-01-01

    SLOWPOKE is an acronym for Safe Low POwer Kritical Experiment. The SOWPOKE-2 is a compact, inherently safe, swimming-pool-type reactor designed by the Atomic Energy of Canada Limited for neutron activation analysis (NAA) and isotope production. The Dalhousie University SLOWPOKE-2 reactor (DUSR) has been operating since 1976; a large beryllium reflector was added in 1986 to extend its lifetime by another 8 to 10 yr. The DUSR is generally operated at half-power with a maximum thermal flux of 1.1 x 10 12 n/cm 2 ·s in the inner pneumatic sites and that of 5.4 x 10 11 n/cm 2 ·s in the outer sites. Despite this comparatively low flux, SLOWPOKE-2 reactors have many beneficial features that are continuously being exploited at the DUSR facility for developing nuclear analytical methods for fundamental as well as applied studies. Although NAA is a well-established analytical technique, much of the activation analysis being performed in most facilities has been limited to methods using fairly long-lived nuclides. The approach at the DUSR facility has been to utilize the highly homogeneous, stable, and reproducible neutron flux to develop NAA methods based on short-lived nuclides. SLOWPOKE reactors have a fairly high epithermal neutron flux, which is being advantageously used for determining several trace elements in complex matrices. Radiochemical NAA (RNAA) methods using coprecipitation, distillation, and ion-exchange separations have been used for the determination of very low levels of several elements in biological materials

  8. Effect of Fe2O3 and Binder on the Electrochemical Properties of Fe2O3/AB (Acetylene Black) Composite Electrodes

    Science.gov (United States)

    Anh, Trinh Tuan; Thuan, Vu Manh; Thang, Doan Ha; Hang, Bui Thi

    2017-06-01

    In an effort to find the best anode material for Fe/air batteries, a Fe2O3/AB (Acetylene Black) composite was prepared by dry-type ball milling using Fe2O3 nanoparticles and AB as the active and additive materials, respectively. The effects of various binders and Fe2O3 content on the electrochemical properties of Fe2O3/AB electrodes in alkaline solution were investigated. It was found that the content of Fe2O3 strongly affected the electrochemical behavior of Fe2O3/AB electrodes; with Fe2O3 nanopowder content reaching 70 wt.% for the electrode and showing improvement of the cyclability. When the electrode binder polytetrafluoroethylene (PTFE) was used, clear redox peaks were observed via cyclic voltammetry (CV), while polyvinylidene fluoride-containing electrodes provided CV curves with unobservable redox peaks. Increasing either binder content in the electrode showed a negative effect in terms of the cyclability of the Fe2O3/AB electrode.

  9. TA-2 water boiler reactor decommissioning (Phase 1)

    International Nuclear Information System (INIS)

    Elder, J.C.; Knoell, C.L.

    1986-12-01

    Removal of external structures and underground piping associated with the gaseous effluent (stack) line from the TA-2 Water Boiler Reactor was performed as Phase I of reactor decommissioning. Six concrete structures were dismantled and 435 ft of contaminated underground piping was removed. Extensive soil contamination by 137 Cs was encountered around structure TA-2-48 and in a suspected leach field near the stream flowing through Los Alamos Canyon. Efforts to remove all contaminated soil were hampered by infiltrating ground water and heavy rains. Methods, cleanup guidelines, and ALARA decisions used to successfully restore the area are described. The cost of the project was approximately $320K; 970 m 3 of low-level solid radioactive waste resulted from the cleanup operations

  10. DRAGON modelling of the SLOWPOKE-2 reactor at Ecole Polytechnique

    International Nuclear Information System (INIS)

    Marleau, G.; Noceir, S.; Roy, R.; Rozon, D.

    1997-01-01

    Predicting the behaviour of the SLOWPOKE-2 reactor at Ecole Polytechnique de Montreal poses a major challenge from the point of view of transport calculations since it has properties which forbid the use of such simple schemes as those considered for power reactor analysis. For example, the use of a totally reflected 2-D cell containing a single fuel pin with its associated coolant is not good enough to generate the fuel averaged properties required in a full core diffusion calculation. Here we present the DRAGON cell model which was used to generate the fewgroup macroscopic cross sections needed for full core diffusion calculations. We also discuss how DRAGON can be used to evaluate and explain the effect on reactivity of temperature and local voiding perturbations. (author)

  11. Therapeutic relevance of the PP2A-B55 inhibitory kinase MASTL/Greatwall in breast cancer.

    Science.gov (United States)

    Álvarez-Fernández, Mónica; Sanz-Flores, María; Sanz-Castillo, Belén; Salazar-Roa, María; Partida, David; Zapatero-Solana, Elisabet; Ali, H Raza; Manchado, Eusebio; Lowe, Scott; VanArsdale, Todd; Shields, David; Caldas, Carlos; Quintela-Fandino, Miguel; Malumbres, Marcos

    2017-12-11

    PP2A is a major tumor suppressor whose inactivation is frequently found in a wide spectrum of human tumors. In particular, deletion or epigenetic silencing of genes encoding the B55 family of PP2A regulatory subunits is a common feature of breast cancer cells. A key player in the regulation of PP2A/B55 phosphatase complexes is the cell cycle kinase MASTL (also known as Greatwall). During cell division, inhibition of PP2A-B55 by MASTL is required to maintain the mitotic state, whereas inactivation of MASTL and PP2A reactivation is required for mitotic exit. Despite its critical role in cell cycle progression in multiple organisms, its relevance as a therapeutic target in human cancer and its dependence of PP2A activity is mostly unknown. Here we show that MASTL overexpression predicts poor survival and shows prognostic value in breast cancer patients. MASTL knockdown or knockout using RNA interference or CRISPR/Cas9 systems impairs proliferation of a subset of breast cancer cells. The proliferative function of MASTL in these tumor cells requires its kinase activity and the presence of PP2A-B55 complexes. By using a new inducible CRISPR/Cas9 system in breast cancer cells, we show that genetic ablation of MASTL displays a significant therapeutic effect in vivo. All together, these data suggest that the PP2A inhibitory kinase MASTL may have both prognostic and therapeutic value in human breast cancer.

  12. Reactor

    International Nuclear Information System (INIS)

    Fujibayashi, Toru.

    1976-01-01

    Object: To provide a boiling water reactor which can enhance a quake resisting strength and flatten power distribution. Structure: At least more than four fuel bundles, in which a plurality of fuel rods are arranged in lattice fashion which upper and lower portions are supported by tie-plates, are bundled and then covered by a square channel box. The control rod is movably arranged within a space formed by adjoining channel boxes. A spacer of trapezoidal section is disposed in the central portion on the side of the channel box over substantially full length in height direction, and a neutron instrumented tube is disposed in the central portion inside the channel box. Thus, where a horizontal load is exerted due to earthquake or the like, the spacers come into contact with each other to support the channel box and prevent it from abnormal vibrations. (Furukawa, Y.)

  13. Reactor

    International Nuclear Information System (INIS)

    Evans, R.M.

    1976-01-01

    Disclosed is a neutronic reactor having a moderator, coolant tubes traversing the moderator from an inlet end to an outlet end, bodies of material fissionable by neutrons of thermal energy disposed within the coolant tubes, and means for circulating water through said coolant tubes characterized by the improved construction wherein the coolant tubes are constructed of aluminum having an outer diameter of 1.729 inches and a wall thickness of 0.059 inch, and the means for circulating a liquid coolant through the tubes includes a source of water at a pressure of approximately 350 pounds per square inch connected to the inlet end of the tubes, and said construction including a pressure reducing orifice disposed at the inlet ends of the tubes reducing the pressure of the water by approximately 150 pounds per square inch. 1 claim, 16 figures

  14. TMI-2 reactor vessel and balance of plant status

    International Nuclear Information System (INIS)

    Kuehn, G.A.

    1990-01-01

    In the fall of 1988 a corporate decision was made which concentrated effort on support of reactor vessel defueling and minimized activity in balance-of-plant areas. The auxiliary and fuel handling building are in a safe/stable state but final preparations for monitored storage won't be pursued until defueling and fuel shipping are complete. In addition to dispositioning fuel, the project is actively preparing for disposal of the Accident Generated Water (2.3 million gallons) by evaporation

  15. Investigation on electronic and magnetic properties of Mn2NiAl by ab initio calculations and Monte Carlo simulations

    International Nuclear Information System (INIS)

    Masrour, R.; Jabar, A.; Hlil, E.K.; Hamedoun, M.; Benyoussef, A.; Hourmatallah, A.; Rezzouk, A.; Bouslykhane, K.; Benzakour, N.

    2017-01-01

    Self-consistent ab initio calculations, based on Density Functional Theory (DFT) approach and using Full potential Linear Augmented Plane Wave (FLAPW) method, are performed to investigate both electronic and magnetic properties of the Mn 2 NiAl. Magnetic moment considered to lie along (001) axes are computed. Obtained data from ab initio calculations are used as input for Monte Carlo simulations to compute other magnetic parameters. Also, the magnetic properties of Mn 2 NiAl are studied using the Monte Carlo simulations. The variation of magnetization and magnetic susceptibility with the reduced temperature of Mn 2 NiAl are investigated. The transition temperature of this system is deduced for different values exchange interaction and crystal field. The thermal total magnetization has been obtained, and the magnetic hysteresis cycle is established. The total magnetic moment is superior to those obtained by the other method and is mainly determined by the antiparallel aligned Mn I , Mn II and Ni spin moments. The superparamagnetic phase is found at the neighborhood of transition temperature. - Highlights: • Ab initio calculations are used to study magnetic and electronic properties of Mn 2 NiX. • The transition temperature of Mn 2 NiX is established. • The magnetic hysteresis cycle of M n2 NiX (X = Al, Ga, In, Sn) is deduced. • The magnetic coercive field of Mn 2 NiX (X = Al, Ga, In, Sn) is given.

  16. Study on the relationship between changes of serum true insulin (Tl) C-peptide, GAD-Ab, INS-Ab contents and age, course of disease, degree of obesity in patients with DM2

    International Nuclear Information System (INIS)

    Du Tongxin; Wang Zizheng; Cao Jiwei; Wu Jindan; Tao Xiaojun

    2009-01-01

    Objective: To study the changes of serum TI, C-peptide, GAD-Ab and INS-Ab in different groups of patients with DM2 (age,course of disease and degree of obesity). Methods: Serum C-peptide(with CLIA), INS-Ab(with RIA) and TI, GAD-Ab(with ELISA) contents were measured in altogether 428 patients with DM2. Relationship between changes of the above parameters and different groups of patients was studide in accordance with age, course of disease and degree of obesity respectively. Results: 1)Relationship among different age groups:(below 50, n=86, 51-70, n=216, over 71 n=126). The serum levels of the 4 parameters were significantly higher in all age group than those in the controls(n=40). Among the various age groups, the levels of all parameters were significantly lower in age group below 50 than the levels,in the other 2 groups with the only exception of INS-Ab, which was not significantly different from that in age group 51-70.The levels were significantly different between age-group 51-70 and age groups over 70, with the only exception of GAD-Ab, which was about the same in the two age-groups. 2)Relationship between changes of serum levels and course of disease(below 5yrs n=157, 6-10yrs n=168,over 1yrs,n=103). The serum levels in patients with disease less than 5years were significantly lower than those in other groups with the exception of GAD-Ab, which was not significantly different from that in patients with disease 6-10 years. 3) Relationship among different degree of obesity(non-obese, BMI BMI≥25, n=202, super-obese BMI≥32 n=50): The serum levels of all the parameters were significantly lower in the non-obese subjects than those in the other two groups.The levels in the super-obese group were also significantly higher than those in the obese group (P<0.01, P<0.05). Conclusion: Serum levels of the 4 parameters (TI, C-peptide, GAD-Ab, INS-Ab)were significantly increased in patients with DM2, especially in the older patients with prolonged course of disease as

  17. Neutronic study using oxide and nitride fuels for the Super Phenix 2 reactor

    International Nuclear Information System (INIS)

    Batista, J.L.; Renke, C.A.C.

    1991-11-01

    This report presents a neutronic analysis and a description of the Super Phenix 2 reactor, taken as reference. We present the methodology and results for cell and global reactor calculations for oxide (U O 2 - Pu O 2 ) and nitride (U N - Pu N) fuels. To conclude we compare the performance of oxide and nitride fuels for the reference reactor. (author)

  18. Fungal-specific transcription factor AbPf2 activates pathogenicity in Alternaria brassicicola

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Yangrae; Ohm, Robin A. [US Department of Energy Joint Genome Institute, 2800 Mitchell Drive, Walnut Creek, CA, 94598, USA; Grigoriev, Igor V. [US Department of Energy Joint Genome Institute, 2800 Mitchell Drive, Walnut Creek, CA, 94598, USA; Srivastava, Akhil [Plant and Environmental Protection Sciences, University of Hawaii at Manoa, 3190 Maile Way, St John 317, Honolulu, HI, 96822, USA

    2013-05-24

    Alternaria brassicicola is a successful saprophyte and necrotrophic plant pathogen. To identify molecular determinants of pathogenicity, we created non-pathogenic mutants of a transcription factor-encoding gene, AbPf2. The frequency and timing of germination and appressorium formation on host plants were similar between the non-pathogenic abpf2 mutants and wild-type A. brassicicola. The mutants were also similar in vitro to wild-type A. brassicicola in terms of vegetative growth, conidium production, and responses to a phytoalexin, reactive oxygen species and osmolites. The hyphae of the mutants grew slowly but did not cause disease symptoms on the surface of host plants. Transcripts of the AbPf2 gene increased exponentially soon after wild-type conidia contacted their host plants . A small amount of AbPf2 protein, as monitored using GFP fusions, was present in young, mature conidia. The protein level decreased during saprophytic growth, but increased and was located primarily in fungal nuclei during pathogenesis. Levels of the proteins and transcripts sharply decreased following colonization of host tissues beyond the initial infection site. When expression of the transcription factor was induced in the wild-type during early pathogenesis, 106 fungal genes were also induced in the wild-type but not in the abpf2 mutants. Notably, 33 of the 106 genes encoded secreted proteins, including eight putative effector proteins. Plants inoculated with abpf2 mutants expressed higher levels of genes associated with photosynthesis, the pentose phosphate pathway and primary metabolism, but lower levels of defense-related genes. Our results suggest that AbPf2 is an important regulator of pathogenesis, but does not affect other cellular processes in A. brassicicola.

  19. Dimensionality and magnetic interactions in CaFe2As2: An ab initio study

    International Nuclear Information System (INIS)

    Tompsett, D.A.; Lonzarich, G.G.

    2010-01-01

    We present detailed electronic structure calculations for CaFe 2 As 2 . We investigate in particular the 'collapsed' tetragonal and orthorhombic regions of the temperature-pressure phase diagram and find properties that distinguish CaFe 2 As 2 from other Fe-pnictide compounds. In contrast to the tetragonal phase of other Fe-pnictides the electronic structure in the 'collapsed' tetragonal phase of CaFe 2 As 2 is found to be strongly 3D. By an analysis of the non-interacting susceptibility, χ 0 (q), of CaFe 2 As 2 and LaFePO we discuss the role of magnetic interactions in iron-pnictides. From this we propose an intuitive explanation for the outstanding question relating to why the predicted antiferromagnetic moment depends strongly on coordinate relaxation and the choice of correlation functional.

  20. Pharmacokinetics and tumor targeting of 131I-labeled F(ab')2 fragments of the chimeric monoclonal antibody G250: preclinical and clinical pilot studies.

    NARCIS (Netherlands)

    Brouwers, A.H.; Mulders, P.F.A.; Oosterwijk, E.; Buijs, W.C.A.M.; Corstens, F.H.M.; Boerman, O.C.; Oyen, W.J.G.

    2004-01-01

    INTRODUCTION: Clinical and animal studies of chimeric monoclonal antibody G250 (moAb cG250) for the targeting of clear-cell renal cell carcinoma (RCC), to date, have been with the intact IgG form. To determine whether F(ab')2 fragments are more suited for radioimmunotherapy (RIT) than intact IgG,

  1. Ole Bjørn Kraft 1893-1980

    DEFF Research Database (Denmark)

    Skov, Christian Houlberg

    2010-01-01

    Ole Bjørn Kraft (1893-1980) var en central konservativ politiker i årene før og efter anden verdenskrig. Han markerede sig som udpræget idépolitiker og opnåede ad flere omgange at blive minister.......Ole Bjørn Kraft (1893-1980) var en central konservativ politiker i årene før og efter anden verdenskrig. Han markerede sig som udpræget idépolitiker og opnåede ad flere omgange at blive minister....

  2. Quantal Study of the Exchange Reaction for N + N2 using an ab initio Potential Energy Surface

    Science.gov (United States)

    Wang, Dunyou; Stallcop, James R.; Huo, Winifred M.; Dateo, Christopher E.; Schwenke, David W.; Partridge, Harry; Kwak, Dochan (Technical Monitor)

    2002-01-01

    The N + N2 exchange rate is calculated using a time-dependent quantum dynamics method on a newly determined ab initio potential energy surface (PES) for the ground A" state. This ab initio PES shows a double barrier feature in the interaction region with the barrier height at 47.2 kcal/mol, and a shallow well between these two barriers, with the minimum at 43.7 kcal/mol. A quantum dynamics wave packet calculation has been carried out using the fitted PES to compute the cumulative reaction probability for the exchange reaction of N + N2(J=O). The J - K shift method is then employed to obtain the rate constant for this reaction. The calculated rate constant is compared with experimental data and a recent quasi-classical calculation using a LEPS PES. Significant differences are found between the present and quasiclassical results. The present rate calculation is the first accurate 3D quantal dynamics study for N + N2 reaction system and the ab initio PES reported here is the first such surface for N3.

  3. A Renewable and Ultrasensitive Electrochemiluminescence Immunosenor Based on Magnetic RuL@SiO2-Au~RuL-Ab2 Sandwich-Type Nano-Immunocomplexes

    Directory of Open Access Journals (Sweden)

    Ning Gan

    2011-08-01

    Full Text Available An ultrasensitive and renewable electrochemiluminescence (ECL immunosensor was developed for the detection of tumor markers by combining a newly designed trace tag and streptavidin-coated magnetic particles (SCMPs. The trace tag (RuL@SiO2-Au~RuL-Ab2 was prepared by loading Ru(bpy32+(RuL-conjuged secondary antibodies (RuL-Ab2 on RuL@SiO2 (RuL-doped SiO2 doped Au (RuL@SiO2-Au. To fabricate the immunosensor, SCMPs were mixed with biotinylated AFP primary antibody (Biotin-Ab1, AFP, and RuL@SiO2-Au~RuL-Ab2 complexes, then the resulting SCMP/Biotin-Ab1/AFP/RuL@SiO2-Au~RuL-Ab2 (SBAR sandwich-type immunocomplexes were absorbed on screen printed carbon electrode (SPCE for detection. The immunocomplexes can be easily washed away from the surface of the SPCE when the magnetic field was removed, which made the immunosensor reusable. The present immunosensor showed a wide linear range of 0.05–100 ng mL–1 for detecting AFP, with a low detection limit of 0.02 ng mL–1 (defined as S/N = 3. The method takes advantage of three properties of the immunosensor: firstly, the RuL@SiO2-Au~RuL-Ab2 composite exhibited dual amplification since SiO2 could load large amount of reporter molecules (RuL for signal amplification. Gold particles could provide a large active surface to load more reporter molecules (RuL-Ab2. Accordingly, through the ECL response of RuL and tripropylamine (TPA, a strong ECL signal was obtained and an amplification analysis of protein interaction was achieved. Secondly, the sensor is renewable because the sandwich-type immunocomplexes can be readily absorbed or removed on the SPCE’s surface in a magnetic field. Thirdly, the SCMP modified probes can perform the rapid separation and purification of signal antibodies in a magnetic field. Thus, the present immunosensor can simultaneously realize separation, enrichment and determination. It showed potential application for the detection of AFP in human sera.

  4. The Effect Of Beryllium Interaction With Fast Neutrons On the Reactivity Of ETRR-2 Research Reactor

    International Nuclear Information System (INIS)

    Aziz, M.; El Messiry, A.M.

    2000-01-01

    The effect of beryllium interactions with fast neutrons is studied for Etrr 2 research reactors. Isotope build up inside beryllium blocks is calculated under different irradiation times. a new model for the Etrr 2 research reactor is designed using MCNP code to calculate the reactivity and flux change of the reactor due to beryllium poison

  5. Ab Initio f values for Fe II J=9/2 ->9/2^o transitions

    Science.gov (United States)

    Beck, Donald

    2005-05-01

    Relativistic configuration interaction f values have been obtained for 264 transitions between the lowest 12 J=9/2 and the 22 J=9/2^o levels. Length and velocity gauges agree to 3.8% for in-shell transitions and 10.0% for shell jump transitions. Two J=9/2^o levels are so nearly degenerate that it was necessary to introduce a semi-empirical correction to produce the correct level ordering. The results are in overall good agreement with the semi-empirical results of Kurucz ootnotetextR. L. Kurucz, http://kurucz.harvard.edu/atoms/2601/ and Raassen ootnotetextA. J. J. Raasen, ftp://ftp.wins.uva.nl/pub/orth/iron/FeII.E1 (1999). An efficient method of including magnetic Breit effects in the energy matrix is presented.

  6. Fourfold Clusters of Rovibrational Energies in H2Te Studied With an Ab Initio Potential Energy Function

    Science.gov (United States)

    Jensen, Per; Li, Yan; Hirsch, Gerhard; Buenker, Robert J.; Lee, Timothy J.; Arnold, James O. (Technical Monitor)

    1994-01-01

    We report an ab initio investigation of the cluster effect (i.e., the formation of nearly degenerate, four member groups of rotation-vibration energy levels at higher J and K(sub a). values) in the H2Te molecule. The potential energy function has been calculated ab initio at a total of 334 molecular geometries by means of the CCSD(T) method where the (1s-4f) core electrons of Te were described by an effective core potential. The values of the potential energy function obtained cover the region up to around 10,000/cm above the equilibrium energy. On the basis of the ab initio potential, the rotation-vibration energy spectra of H2Te-130 and its deuterated isotopomers have been calculated with the MORBID (Morse Oscillator Rigid Bender Internal Dynamics) Hamiltonian and computer program. In particular, we have calculated the rotational energy manifolds for J less than or = 40 in the vibrational ground state, the upsilon(sub 2) state, the "first triad" (the upsilon(sub l)/upsilon(sub 3)/2upsilon(sub 2) interacting vibrational states), and the "second triad" (the upsilon(sub 1) + upsilon(sub 2/upsilon(sub 2) + upsilon(sub 3)/3upsilon(sub 2) states) of H2Te-130. We find that the cluster formation in H2Te is very similar to those of of H2Se and H2S, which we have studied previously. However, contrary to semiclassical predictions, we do not determine any significant displacement of the clusters towards lower J values relative to H2Se. Hence the experimental observation of the cluster states in H2Te will be at least as difficult as in H2Se.

  7. Molecular analysis of a GM2-activator deficiency in two patients with GM2-gangliosidosis AB variant

    Energy Technology Data Exchange (ETDEWEB)

    Schepers, U.; Glombitza, G.; Lemm, T. [Institut fuer Organische Chemie und Biochemie der Universitaet, Bonn (Germany)] [and others

    1996-11-01

    Lysosomal degradation of ganglioside GM2 by {beta}-hexosaminidase A (hex A) requires the presence of the GM2 activator protein (GM2AP) as an essential cofactor. A deficiency of the GM2 activator causes the AB variant of GM2 gangliosidosis, a recessively inherited disorder characterized by excessive neuronal accumulation of GM2 and related glycolipids. Two novel mutations in the GM2 activator gene (GM2A) have been identified by the reverse-transcriptase-PCR method - a three-base deletion, AAG{sup 262-264}, resulting in a deletion of Lys{sup 88}, and a single-base deletion, A{sup 410}, that causes a frameshift. The latter results in substitution of 33 amino acids and the loss of another 24 amino acid residues. Both patients are homoallelic for their respective mutations inherited from their parents, who are heteroallelic at the GM2A locus. Although the cultured fibroblasts of both patients produce normal levels of activator mRNA, they lack a lysosomal form of GM2AP. Pulse/chase labeling of cultured fibroblasts of the patients, in presence and absence of brefeldin A, indicates a premature degradation of both-mutant and truncated-GM2APs in the endoplasmic reticulum or Golgi. These results were supported by in vitro translation experiments and expression of the mutated proteins. When the mutated GM2APs were expressed in Escherichia coli, both mature GM2AP forms turned proved to exhibit only residual activities in an in vitro assay. 26 refs., 7 figs.

  8. Efeito do teor de lignina da madeira de Eucalyptus globulus Labill. no desempenho da polpação kraft

    Directory of Open Access Journals (Sweden)

    Gabriel Valim Cardoso

    2011-01-01

    Full Text Available In this research, it was analyzed the lignin content effect of Eucalyptus globulus Labill. wood in kraft pulping optimization. Seventy-two laboratory cooking were made with wood chips obtained from six Eucalyptus globulus trees selected from a group of 50 trees. The wood chips from three trees with the lowest lignin content, with average 20.53%, were mixed proportionally based on the tree weights, obtaining the sample of low lignin content wood. The same was made to obtain the sample for wood chips with the highest lignin content, with average 23.02%. The two lignin levels were statistically different. The two wood samples had basic densities statistically not different. Using three maximum temperatures levels (160, 165 and 170ºC, and three active alkali charged (17, 18.5 and 20%, the wood chips were converted to kraft pulps. The pulps were then characterized to analyze the influence of the distinct treatments employed in the cooking on their properties. The effect of the cooking conditions was expressed by mathematical models in order to determine the optimum points for each of the evaluated properties. The optimization process indicated maximum temperature of 168ºC, and active alkali of 19%, for maximum kraft pulping yield to achieve kappa number 18; this result was for woods with low lignin content. For woods containing the high lignin content, the optimization showed maximum cooking temperature of 169ºC and active alkali of 19% for kappa number of 18. The average reduction of 2.49% in wood lignin content resulted a correspondent gain of 2.2% in the kraft yield (o.d. basis and a reduction on the active alkali charge of 1.2% (o.d. basis to achieve kappa numbers from 16 to 19, preserving pulp properties. If the option is to work with kappa number 19 instead of 16, the gain in kraft yield is approximately 2%. Therefore, when working with low lignin content wood and kappa number 19 instead of 16, a substantial gain of approximately 4.2% is

  9. The binding parameters of radiolabelled monoclonal F (ab')2 and Fab' fragments relative to immunoglobulin G in reactions with surface-bound antigens

    International Nuclear Information System (INIS)

    Fjeld, J.G.; Nustad, K.; Michaelsen, T.E.

    1992-01-01

    The binding parameters of iodine-125-labelled intact monoclonal immunoglobulin G (IgG), F(ab') 2 and Fab' fragments were compared. The study was carried out with the two monoclonal antibodies (MoAbs) K13 and K16 specific for human Ig light chains κ and λ, respectively. When testing the 125 I-MoAbs against monodisperse polymer particles coated with the specific antigens, the K a for the F(ab') 2 fragments were similar to that for IgG, while the K a for the Fab' fragments were reduced to 10%-20% of that for IgG. The number N of effective target sites revealed with Fab' was higher than with F(ab') and IgG, presumably because less surface area is occupied by the small Fab' molecules. The immunoreactive fraction F ranged according to IgG>F(ab') 2 >Fab'. The explanation of the moderate difference between the K a of the monoclonal Fab' and the divalent IgG and F(ab') 2 was that the divalent molecules were not divalently attached to the particles. When testing the same antibody preparations against humanlymphoma cells producing Ig with light chains κ or λ, the binding results were less reliable than when particles were utilised, presumably due to antigen shedding. Different MoAbs vary in their loss of immunoreactivity due to enzymatic degradation and the radiolabelling procedure. The preparation of the radiolabelled fragments should therefore be optimized for each MoAb, and evaluation is necessary before injection. Artificial targets with a low leakage of antigen, like the monodisperse polymer particles here applied, are recommended for the in vitro evaluation of the immunoreactivity of labelled MoAb preparations. (orig.)

  10. Proceedings of 2. Yugoslav symposium on reactor physics, Part 2, Herceg Novi (Yugoslavia), 27-29 Sep 1966

    International Nuclear Information System (INIS)

    1966-01-01

    This Volume 2 of the Proceedings of 2. Yugoslav symposium on reactor physics includes eight papers dealing with the following topics: method for measuring high anti reactivities of a reactor system; integration method for thermal reaction rate calculation; Determination of initial core configuration for BHWR-200 MWe; safety shutdowns and failures of the RA reactor equipment; determining the reactivity of absorption rods; measurements of thermal and fast neutron fluxes at the TRIGA reactor and other measurements during operation of the TRIGA reactor; mathematical modelling of the reactor safety; review of problems and methods for radiation risk assessment in the environment of a nuclear power plant

  11. Fluorescence enhancement of CdTe quantum dots by HBcAb-HRP for sensitive detection of H2O2in human serum.

    Science.gov (United States)

    Gong, Tingting; Liu, Junfeng; Wu, Yiwei; Xiao, Yao; Wang, Xuehan; Yuan, Siqi

    2017-06-15

    A simple, high selective, ultra-sensitive and stable biosensor based on hepatitis B core antibody labeled with horseradish peroxidase (HBcAb-HRP) induced fluorescent enhancement of CdTe QDs for recognition of H 2 O 2 have been constructed. In this assay, sulfurs in HBcAb-HRP, which possess a strong affinity towards Cd 2+ , can improve greatly the recombination fluorescence of CdTe QDs by creating more radiative centers at CdTe/Cd-SR complex. Then, H 2 O 2 oxidizes Cd-S bonds in CdTe QDs to organic disulfide product (RS-SR), causing thioglycolic acid (TGA) and HBcAb-HRP detach from surface of CdTe QDs and thus leading to fluorescence quenching. Just with the addition of HBcAb-HRP, sensitivity of the new biosensor has been improved by near one order of magnitude as compared with CdTe QDs probe. Detection limit of HBcAb-HRP-CdTe QDs biosensor for determination of H 2 O 2 was 6.9×10 -8 mol L -1 (3σ/slope), and the excellent linear range was 1.0×10 -7 ~1.5×10 -4 molL -1 . By using sodium diethyldithiocarbamate (DDTC) and NH 4 OH as masking agents of Ag + , Hg 2+ and Cu 2+ , H 2 O 2 can be selectively detected in coexistence with Ag + , Hg 2+ and Cu 2+ , and the biosensor has been used to detect H 2 O 2 in human serum with satisfactory results. The superior properties of this biosensor showed great potential usage in more chemical and biological researches. Copyright © 2017 Elsevier B.V. All rights reserved.

  12. Development and validation of real-time PCR screening methods for detection of cry1a.105 and cry2ab2 genes in genetically modified organisms

    NARCIS (Netherlands)

    Dinon, A.Z.; Prins, T.W.; Dijk, van J.P.; Arisi, C.M.; Scholtens-Toma, I.M.J.; Kok, E.J.

    2011-01-01

    Primers and probes were developed for the element-specific detection of cry1A.105 and cry2Ab2 genes, based on their DNA sequence as present in GM maize MON89034. Cry genes are present in many genetically modified (GM) plants and they are important targets for developing GMO element-specific

  13. Rehe ja Kraft napsasid hiidudelt turuosa / Piret Reiljan

    Index Scriptorium Estoniae

    Reiljan, Piret, 1983-

    2007-01-01

    Nordea ja Sampo Pank on viimase aastaga uute ärilaenude mahtu kasvatanud 100 protsenti. Diagramm: Uute ärilaenudega esirinnas Nordea ja Sampo. Kommenteerivad: Priit Põldoja, Ahti Asmann, Aivar Rehe, Vahur Kraft ja Alo Lillepea. Vt. samas: Kodulaenude andmisel näpistab Sampo Ühispangalt turgu

  14. Võlakoorem tuhmistab Eesti võimalusi / Vahur Kraft

    Index Scriptorium Estoniae

    Kraft, Vahur, 1961-

    2003-01-01

    Eesti Panga president Vahur Kraft hoiatab liiga kergekäelise laenuvõtmise eest. Tema sõnul on Eesti Pank valmis vajaduse korral kasutama võimalusi nii laenuandjate kui ka -võtjate mõjutamiseks. Riigi stabiliseerimisreservist

  15. Delignification of wood and kraft pulp with polyoxometalates

    Science.gov (United States)

    Edward L. Springer; Richard S. Reiner; Ira A. Weinstock; Rajai H. Atalla; Michael W. Wemple; Elena M. G. Barbuzzi

    1998-01-01

    Finely divided aspen and spruce woods and a high lignin pine kraft pulp have been selectively delignified to low lignin levels using aqueous solutions of polyoxometalates under anaerobic conditions. The reduced polyoxometalates in the solutions can be reoxidized with oxygen and act as wet oxidation catalysts for the mineralization of the solubilized lignin and...

  16. Measurement of cellulose content, Kraft pulp yield and basic density ...

    African Journals Online (AJOL)

    Previous descriptions of multisite and multispecies near infra-red (NIR) spectroscopic calibrations for predicting cellulose content (CC) and Kraft pulp yield (KPY) in eucalypt woodmeal demonstrated that large, single calibrations provide precise predictions for a wide range of sites and species. These have since been used ...

  17. Kraft pulp from budworm-infested jack pine

    Science.gov (United States)

    J. Y. Zhu; Gary C. Myers

    2006-01-01

    This study evaluated the quality of kraft pulp from bud-worm-infested jack pine. The logs were classified as merchantable live, suspect, or merchantable dead. Raw materials were evaluated through visual inspection, analysis of the chemical composition, SilviScan measurement of the density, and measurement of the tracheid length. Unbleached pulps were then refined using...

  18. Recyclable zein-coated kraft paper and linerboard

    Science.gov (United States)

    Nicholas Parris; Marguerite Sykes; Leland C. Dickey; Jack L. Wiles; Thomas J. Urbanik; Peter H. Cooke

    2002-01-01

    Recyclability of kraft paper and linerboard coated with commercial zein and paraffin wax or a zein-lipid mixture was evaluated using conventional recycling processes. Zein, an alcohol-soluble protein from corn, exhibits both grease and water vapor barrier properties. Strength properties, grease resistance, and water vapor barrier proper-ties were measured on handsheets...

  19. Proceedings of the 1992 topical meeting on advances in reactor physics. Volume 2

    Energy Technology Data Exchange (ETDEWEB)

    1992-04-01

    This document, Volume 2, presents proceedings of the 1992 Topical Meeting on Advances in Reactor Physics on March 8--11, 1992 at Charleston, SC. Session topics were as follows: Transport Theory; Fast Reactors; Plant Analyzers; Integral Experiments/Measurements & Analysis; Core Computational Systems; Reactor Physics; Monte Carlo; Safety Aspects of Heavy Water Reactors; and Space-Time Core Kinetics. The individual reports have been cataloged separately. (FI)

  20. Administered activity and metastatic cure probability during radioimmunotherapy of ovarian cancer in nude mice with 211At-MX35 F(ab')2.

    Science.gov (United States)

    Elgqvist, Jörgen; Andersson, Håkan; Bernhardt, Peter; Bäck, Tom; Claesson, Ingela; Hultborn, Ragnar; Jensen, Holger; Johansson, Bengt R; Lindegren, Sture; Olsson, Marita; Palm, Stig; Warnhammar, Elisabet; Jacobsson, Lars

    2006-11-15

    To elucidate the therapeutic efficacy of alpha-radioimmunotherapy of ovarian cancer in mice. This study: (i) estimated the minimum required activity (MRA), giving a reasonable high therapeutic efficacy; and (ii) calculated the specific energy to tumor cell nuclei and the metastatic cure probability (MCP) using various assumptions regarding monoclonal-antibody (mAb) distribution in measured tumors. The study was performed using the alpha-particle emitter Astatine-211 (211At) labeled to the mAb MX35 F(ab')2. Animals were inoculated intraperitoneally with approximately 1 x 10(7) cells of the cell line NIH:OVCAR-3. Four weeks later animals were treated with 25, 50, 100, or 200 kBq 211At-MX35 F(ab')2 (n = 74). Another group of animals was treated with a nonspecific mAb: 100 kBq 211At-Rituximab F(ab')2 (n = 18). Eight weeks after treatment the animals were sacrificed and presence of macro- and microscopic tumors and ascites was determined. An MCP model was developed and compared with the experimentally determined tumor-free fraction (TFF). When treatment was given 4 weeks after cell inoculation, the TFFs were 25%, 22%, 50%, and 61% after treatment with 25, 50, 100, or 200 kBq (211)At-MX35 F(ab')2, respectively, the specific energy to irradiated cell nuclei varying between approximately 2 and approximately 400 Gy. As a significant increase in the therapeutic efficacy was observed between the activity levels of 50 and 100 kBq (TFF increase from 22% to 50%), the conclusion was that the MRA is approximately 100 kBq (211)At-MX35 F(ab')2. MCP was most consistent with the TFF when assuming a diffusion depth of 30 mum of the mAbs in the tumors.

  1. Annual report on JEN-1 and JEN-2 Reactors; Informe periodico de Reactores JEN-1 y JEN-2 correpondiente al ano 1972

    Energy Technology Data Exchange (ETDEWEB)

    Montes Ponce de Leon, J.

    1974-07-01

    In the annual report on the JEN-1 and JEN-2 reactors the main fractures of the reactor operations and maintenance are described. The reactor has been in operation for 2188 hours, what means 74% of the total working time. Maintenance and periodical tests have occupied the rest of the time. Maintenance operations are shown according to three main subjects, the main failures so as the reactor scrams are also described. Different date relating with radiation level and health Physics are also included. (Author)

  2. A study of the atmospherically important reactions between dimethyl selenide (DMSe) and molecular halogens (X2 = Cl2, Br2, and I2) with ab initio calculations.

    Science.gov (United States)

    Rhyman, Lydia; Armata, Nerina; Ramasami, Ponnadurai; Dyke, John M

    2012-06-14

    The atmospherically relevant reactions between dimethyl selenide (DMSe) and the molecular halogens (X(2) = Cl(2), Br(2), and I(2)) have been studied with ab initio calculations at the MP2/aug-cc-pVDZ level of theory. Geometry optimization calculations showed that the reactions proceed from the reagents to the products (CH(3)SeCH(2)X + HX) via three minima, a van der Waals adduct (DMSe:X(2)), a covalently bound intermediate (DMSeX(2)), and a product-like complex (CH(3)SeCH(2)X:HX). The computed potential energy surfaces are used to predict what molecular species are likely to be observed in spectroscopic experiments such as gas-phase photoelectron spectroscopy and infrared matrix isolation spectroscopy. It is concluded that, for the reactions of DMSe with Cl(2) and Br(2), the covalent intermediate should be seen in spectroscopic experiments, whereas, in the DMSe + I(2) reaction, the van der Waals adduct DMSe:I(2) should be observed. Comparison is made with previous related calculations and experiments on dimethyl sulfide (DMS) with molecular halogens. The relevance of the results to atmospheric chemistry is discussed. The DMSeX(2) and DMSe:X(2) intermediates are likely to be reservoirs of molecular halogens in the atmosphere which will lead on photolysis to ozone depletion.

  3. Evaluating autoimmunity markers (TPO Ab, Tg Ab and TM Ab in hypothyroid patients of Bushehr province

    Directory of Open Access Journals (Sweden)

    Iraj Nabipour

    2005-09-01

    Full Text Available Background: Chronic autoimmune thyroiditis (Hashimoto's Thyroiditis is the common cause of primary hypothyroidism in iodine sufficient countries. Iran is named an iodine sufficient country, in this century. Methods: A total of 88 hypothyroid patients, on suppressing dose of levothyroxine who were followed in a university endocrine disorder clinic were evaluated for serum thyroid autoimmunity markers: thyroid peroxidase antibody (TPO Ab, thyroglobulin antibody (Tg Ab and thyroid microsomal antibody (TM Ab using ELISA method. Results: The prevalence of TPO Ab, Tg Ab and TM Ab were 73.9%, 45.5% and 71.6%, respectively. Among the patients with high level of TPO Ab (> 75 u/ml, 45.3% had grade 1 or 2 of goiter (P< 0.05. Conclusion: Autoimmune thyroid disease (Hashimoto's thyroiditis is the most common cause of hypothyroidism in Bushehr province.

  4. Radioimmunoimaging of human breast carcinoma xenografts in nude mouse model with 111In-labeled new monoclonal antibody EBA-1 and F(ab')2 fragments

    International Nuclear Information System (INIS)

    Yemul, Shrishailam; Leon, J.A.; Pozniakoff, Ted; Esser, P.D.; Estabrook, Alison; Met-Path Inc., Teterboro, NJ

    1993-01-01

    Radioimmunoimaging characteristics of a new monoclonal antibody EBA-1 and its F(ab') 2 fragments utilizing nu/nu mice bearing human breast carcinoma xenografts are described. 111 In-DPTA conjugates of EBA-1 localized with tumor/blood ratios of 0.99 ± 0.10 (P 2 radioconjugates at 48 h. These results suggest that EBA-1 and its F(ab') 2 might be useful reagents in radioimmunoimaging and radioimmunotherapy. (author)

  5. Thrombus imaging with indium-111 and iodine-131-labeled fibrin-specific monoclonal antibody and its F(ab')2 and Fab fragments

    International Nuclear Information System (INIS)

    Rosebrough, S.F.; Grossman, Z.D.; McAfee, J.G.

    1988-01-01

    We have previously reported successful imaging of fresh (2-4 hr old) and aged (1-5 days old) canine thrombi with 131 I-labeled intact monoclonal antibody (MAb) specific for fibrin. We now report thrombus imaging with 131 I-labeled F(ab')2 and Fab and 111 In-labeled intact MAb, F(ab')2, and Fab. Indium-111-labeled F(ab')2 proved to be the best imaging agent due to less nonspecific binding in the liver than whole IgG. Image quality was improved by the higher administered dose permissible with 111 In and its better physical characteristics for imaging, compared to 131 I. Immunofluorescence of fresh human histologic sections showed intact MAb and F(ab')2 binding to thrombi, pulmonary emboli, and atherosclerotic plaques, strengthening the feasibility of clinical thrombus imaging

  6. Jüri Kraft : Eesti eksport nõuab Euroopa Liitu minekut / Jüri Kraft ; interv. Sulev Oll

    Index Scriptorium Estoniae

    Kraft, Jüri, 1935-

    2003-01-01

    Kahe kergetööstusettevõtte, Sangari ja Mivari nõukogu esimees, endine ENSV kergetööstusminister Jüri Kraft leiab, et kui Eesti ei astu EL-i ja loobub soodsast ekspordivõimalusest, kordub Eestis 1990. aastate alguse olukord

  7. European research activities within the project: High Performance Light Water Reactor phase 2 (HPLWR phase 2)

    Energy Technology Data Exchange (ETDEWEB)

    Starflinger, J.; Schulenberg, T. [Forschungszentrum Karlsruhe GmbH, Institute for Nuclear and Energy Technologies, Karlsruhe (Germany); Marsault, P. [CEA Cadarache (DER/SESI), 13 - Saint Paul lez Durance (France). Dept. d' Etudes des Reacteurs; Bittermann, D. [AREVA NP, NEPR-G, Erlangen (Germany); Maraczy, C. [AEKI-KFKI, Budapest (Hungary); Laurien, E. [Stuttgart Univ. IKE (Germany); Lycklama, J.A. [NRG Petten, NL (Netherlands); Anglart, H. [KTH Energy Technology, Stockholm (Sweden); Aksan, N. [Paul Scherrer Institut CH, Villigen PSI (Switzerland); Ruzickova, M. [UJV Rez plc, Husinec-Rez c.p. (Czech Republic); Heikinheimo, L. [VTT, FIN (Finland)

    2007-07-01

    The High Performance Light Water Reactor (HPLWR) is a Light Water Reactor (LWR) operating at supercritical pressure (25 MPa). It belongs to the six reactors currently being investigated under the framework of the Generation IV International Forum. The most visible advantage of the HPLWR shall be the low construction costs in the order of 1000 Euro/kWe, because of size reduction of components and buildings compared to current Light Water Reactors, and the low electricity production costs which are targeted at 3-4 cents/kWh. In Europe, investigations on the HPLWR have been integrated into a joint research project, called High Performance Light Water Reactor Phase 2 (HPLWR Phase 2), which is co-funded by the European Commission. Within 42 months, ten partners from eight European countries working on critical scientific issues shall show the feasibility of the HPLWR concept. This paper reports on 5 points relevant for HPLWR: 1) design and integration, 2) core design, 3) safety, 4) materials, and 5) heat transfer. The final goal is to assess the future potential of this reactor in the electricity market.

  8. Energetics and bonding study of hexamethylenetetramine and fourteen related cage molecules: An ab initio G3(MP2 investigation

    Directory of Open Access Journals (Sweden)

    HO-ON HO

    2005-04-01

    Full Text Available The ab initio G3(MP2method has been applied to hexamethylenetetramine (HMT and fourteen related cage systems. The agreement between the calculated and experimental molecular dimensions, which are available for five of the 15 cage species, ranges from satisfactory to excellent. In addition, the G3(MP2 heat of formation at 298 K for HMT is in excellent accord with experimental results. Hence, the calculated heats of formation for the other 14 cage systems should be reliable estimates.

  9. Clinical trial of an F(ab')(2) polyvalent equine antivenom for African snake bites in Benin

    OpenAIRE

    Chippaux, Jean-Philippe; Massougbodji, A.; Stock, R. P.; Alagon, A.

    2007-01-01

    We report the results of a trial designed to measure the safety and efficacy of African Antivipmyn((R)), a new freeze-dried polyvalent equine F(ab')(2)-based antivenom. We tested 289 envenomations. After treatment, 19% of treated patients had undesirable events, all benign. A possible adverse effect was attributed to this antivenom in 11% of the patients. Bleeding was observed in 48% of the patients; it stopped within 2 hours after treatment with antivenom in 60% of the patients. Blood incoag...

  10. Ab initio study of vibronic transitions between x2π and 12Σ+ electronic states of HCP+ ion

    Directory of Open Access Journals (Sweden)

    Stojanović Ljiljana

    2013-01-01

    Full Text Available The ground and low-lying excited doublet electronic states of the HCP+ ion were studied by means of multireference configuration interaction method. Vibronic energy levels of the X2Π state of Σ, Π, Δ, and Φ symmetry, up to the 2500 cm-1, have been calculated variationally, employing previously developed ab initio methods which take into account vibronic and spin-orbit interactions. Obtained vibronic wave functions were used to estimate transition moments between vibronic energy levels of the X2Π and 12Σ+ electronic states. Results were compared to available experimental and theoretical data. [Projekat Ministarstva nauke Republike Srbije, br. 172040

  11. AB variant of infantile GM2 gangliosidosis: deficiency of a factor necessary for stimulation of hexosaminidase A-catalyzed degradation of ganglioside GM2 and glycolipid GA2.

    Science.gov (United States)

    Conzelmann, E; Sandhoff, K

    1978-08-01

    Human kidney extracts heated to 60 degrees and devoid of hexosaminidase activity (2-acetamido-2-deoxy-beta-D-glucoside acetamidodeoxyglucohydrolase EC 3.2.1.30) stimulate more than 20-fold the hexosaminidase A-catalyzed degradation of ganglioside GM2 and of glycolipid GA2, the neuronal storage compounds of GM2 gangliosidosis. The stimulating factor of this extract, which is labile at temperatures above 60 degrees, is also present in kidney extracts from patients with infantile GM2 gangliosidosis having a deficiency of hexosaminidase A (Tay-Sachs disease, variant B) and a deficiency of hexosaminidases A and B (variant 0). Evidence is presented that this factor is defective in the AB-variant of infantile GM2 gangliosidosis which is characterized by an accumulation of glycolipids GM2 and GA2 despite the fact that the degrading enzymes, hexosaminidases A and B, retain normal activity levels. Thus, variant AB is an example of a fatal lipid storage disease that is caused not by a defect of a degrading enzyme but rather by a defective factor necessary for the interaction of lipid substrates and the water-soluble hydrolase.

  12. Scintigraphy with /sup 111/In-labeled antimyosin F(ab)/sub 2/ monoclonal antibody and /sup 99m/Tc-pyrophosphate in rhabdomyolysis

    Energy Technology Data Exchange (ETDEWEB)

    Krause, T.; Schuemichen, C.; Hohenloser, S.; Kasper, W.; Meinertz, T.

    1988-02-01

    A report is presented of the scintigraphic diagnosis of a generalized rhabdomyolysis with myocardial involvement using /sup 111/In labelled antimyosin F(ab)/sub 2/ monoclonal antibodies as compared to /sup 99m/Tc pyrophosphate.

  13. Cellulose kraft pulp reinforced polylactic acid (PLA composites: effect of fibre moisture content

    Directory of Open Access Journals (Sweden)

    Elias Retulainen

    2016-06-01

    Full Text Available PLA offers a competitive and CO2 neutral matrix to commonly used polyolefin polymer based composites. Moreover, the use of PLA reduces dependency on oil when producing composite materials. However, PLA has a tendency of hydrolytic degradation under melt processing conditions in the presence of moisture, which remains a challenge when processing PLA reinforced natural fibre composites. Natural fibres such as cellulose fibres are hygroscopic with 6–10 wt% moisture content at 50–70% relative humidity conditions. These fibres are sensitive to melt processing conditions and fibre breakage (cutting also occur during processing. The degradation of PLA, moisture absorption of natural fibres together with fibre cutting and uneven dispersion of fibres in polymer matrix, deteriorates the overall properties of the composite. In the given research paper, bleached softwood kraft pulp (BSKP reinforced PLA compounds were successfully melt processed using BSKP with relatively high moisture contents. The effect of moist BSKP on the molecular weight of PLA, fibre length and the mechanical properties of the composites were investigated. By using moist never-dried kraft pulp fibres for feeding, the fibre cutting was decreased during the melt compounding. Even though PLA degradation occurred during the melt processing, the final damage to the PLA was moderate and thus did not deteriorate the mechanical properties of the composites. However, comprehensive moisture removal is required during the compounding in order to achieve optimal overall performance of the PLA/BSKP composites. The economic benefit gained from using moist BSKP is that the expensive and time consuming drying process steps of the kraft pulp fibres prior to processing can be minimized.

  14. Optical absorption spectra and g factor of MgO: Mn2+explored by ab initio and semi empirical methods

    Science.gov (United States)

    Andreici Eftimie, E.-L.; Avram, C. N.; Brik, M. G.; Avram, N. M.

    2018-02-01

    In this paper we present a methodology for calculations of the optical absorption spectra, ligand field parameters and g factor for the Mn2+ (3d5) ions doped in MgO host crystal. The proposed technique combines two methods: the ab initio multireference (MR) and the semi empirical ligand field (LF) in the framework of the exchange charge model (ECM) respectively. Both methods of calculations are applied to the [MnO6]10-cluster embedded in an extended point charge field of host matrix ligands based on Gellé-Lepetit procedure. The first step of such investigations was the full optimization of the cubic structure of perfect MgO crystal, followed by the structural optimization of the doped of MgO:Mn2+ system, using periodic density functional theory (DFT). The ab initio MR wave functions approaches, such as complete active space self-consistent field (CASSCF), N-electron valence second order perturbation theory (NEVPT2) and spectroscopy oriented configuration interaction (SORCI), are used for the calculations. The scalar relativistic effects have also been taken into account through the second order Douglas-Kroll-Hess (DKH2) procedure. Ab initio ligand field theory (AILFT) allows to extract all LF parameters and spin-orbit coupling constant from such calculations. In addition, the ECM of ligand field theory (LFT) has been used for modelling theoptical absorption spectra. The perturbation theory (PT) was employed for the g factor calculation in the semi empirical LFT. The results of each of the aforementioned types of calculations are discussed and the comparisons between the results obtained and the experimental results show a reasonable agreement, which justifies this new methodology based on the simultaneous use of both methods. This study establishes fundamental principles for the further modelling of larger embedded cluster models of doped metal oxides.

  15. Passive immunotherapy for influenza A H5N1 virus infection with equine hyperimmune globulin F(ab'2 in mice

    Directory of Open Access Journals (Sweden)

    Li Yanbin

    2006-03-01

    Full Text Available Abstract Background Avian influenza virus H5N1 has demonstrated considerable pandemic potential. Currently, no effective vaccines for H5N1 infection are available, so passive immunotherapy may be an alternative strategy. To investigate the possible therapeutic effect of antibody against highly pathogenic H5N1 virus on a mammal host, we prepared specific equine anti-H5N1 IgGs from horses vaccinated with inactivated H5N1 virus, and then obtained the F(ab'2 fragments by pepsin digestion of IgGs. Methods The horses were vaccinated with inactivated H5N1 vaccine to prepare anti-H5N1 IgGs. The F(ab'2 fragments were purified from anti-H5N1 hyperimmune sera by a protocol for 'enhanced pepsin digestion'. The protective effect of the F(ab'2 fragments against H5N1 virus infection was determined in cultured MDCK cells by cytopathic effect (CPE assay and in a BALB/c mouse model by survival rate assay. Results By the protocol for 'enhanced pepsin digestion', total 16 g F(ab'2 fragments were finally obtained from one liter equine antisera with the purity of over 90%. The H5N1-specific F(ab'2 fragments had a HI titer of 1:1024, and the neutralization titre of F(ab'2 reached 1: 2048. The in vivo assay showed that 100 μg of the F(ab'2 fragments could protect BALB/c mice infected with a lethal dose of influenza H5N1 virus. Conclusion The availability of highly purified H5N1-specific F(ab'2 fragments may be promising for treatment of influenza H5N1 infection. Our work has provided experimental support for the application of the therapeutic equine immunoglobulin in future large primate or human trials.

  16. Comparative study on the ability of IgG and F(ab')2 antivenoms to neutralize lethal and myotoxic effects induced by Micrurus nigrocinctus (coral snake) venom

    OpenAIRE

    León Montero, Guillermo; Stiles, Bradley G.; Alape Girón, Alberto; Rojas Céspedes, Gustavo; Gutiérrez, José María

    1999-01-01

    A comparative study was performed on the ability of IgG and F(ab')2 antivenoms to neutralize lethal and myotoxic activities of Micrurus nigrocinctus venom. Both antivenoms were adjusted to a similar neutralizing potency in experiments where venom and antivenoms were preincubated prior to injection. No significant differences were observed between IgG and F(ab')2 antivenoms concerning neutralization of lethal effect in rescue experiments, i.e., when antivenom was administered intravenously aft...

  17. The chemical, mechanical, and physical properties of 3D printed materials composed of TiO2-ABS nanocomposites.

    Science.gov (United States)

    Skorski, Matthew; Esenther, Jake; Ahmed, Zeeshan; Miller, Abigail E; Hartings, Matthew R

    To expand the chemical capabilities of 3D printed structures generated from commercial thermoplastic printers, we have produced and printed polymer filaments that contain inorganic nanoparticles. TiO 2 was dispersed into acrylonitrile butadiene styrene (ABS) and extruded into filaments with 1.75 mm diameters. We produced filaments with TiO 2 compositions of 1%, 5%, and 10% (kg/kg) and printed structures using a commercial 3D printer. Our experiments suggest that ABS undergoes minor degradation in the presence of TiO 2 during the different processing steps. The measured mechanical properties (strain and Young's modulus) for all of the composites are similar to those of structures printed from the pure polymer. TiO 2 incorporation at 1% negatively affects the stress at breaking point and the flexural stress. Structures produced from the 5 and 10% nanocomposites display a higher breaking point stress than those printed from the pure polymer. TiO 2 within the printed matrix was able to quench the intrinsic fluorescence of the polymer. TiO 2 was also able to photocatalyze the degradation of a rhodamine 6G in solution. These experiments display chemical reactivity in nanocomposites that are printed using commercial 3D printers, and we expect that our methodology will help to inform others who seek to incorporate catalytic nanoparticles in 3D printed structures.

  18. Active species in a large volume N2-O2 post-discharge reactor

    International Nuclear Information System (INIS)

    Kutasi, K; Pintassilgo, C D; Loureiro, J; Coelho, P J

    2007-01-01

    A large volume post-discharge reactor placed downstream from a flowing N 2 -O 2 microwave discharge is modelled using a three-dimensional hydrodynamic model. The density distributions of the most populated active species present in the reactor-O( 3 P), O 2 (a 1 Δ g ), O 2 (b 1 Σ g + ), NO(X 2 Π), NO(A 2 Σ + ), NO(B 2 Π), NO 2 (X), O 3 , O 2 (X 3 Σ g - ) and N( 4 S)-are calculated and the main source and loss processes for each species are identified for two discharge conditions: (i) p = 2 Torr, f = 2450 MHz, and (ii) p = 8 Torr, f = 915 MHz; in the case of a N 2 -2%O 2 mixture composition and gas flow rate of 2 x 10 3 sccm. The modification of the species relative densities by changing the oxygen percentage in the initial gas mixture composition, in the 0.2%-5% range, are presented. The possible tuning of the species concentrations in the reactor by changing the size of the connecting afterglow tube between the active discharge and the large post-discharge reactor is investigated as well

  19. Alteration in reactor installation (reactor facility) in the Tokai No.2 Power Station of the Japan Atomic Power Company (report)

    International Nuclear Information System (INIS)

    1984-01-01

    A report to the Ministry of International Trade and Industry by the Nuclear Safety Commission, concerning the alteration of reactor facility in Tokai No.2 Power Station, JAPC, was presented; the technical capability and the safety after the alteration were confirmed by NSC. The alteration was the employment of new type 8x8 fuel as the replacement fuel and of average enrichment of about 2.9 wt.% from the previous 2.7 wt.% for the replacement fuel assemblies. The safety examination made by the Committee on Examination of Reactor Safety of NSC is described: meteorology, the safety design of reactor facility, exposure dose evaluation in normal operation, abnormal transient analysis in operation, accident analysis, and the credible accident analysis for site evaluation. (Mori, K.)

  20. Sterilization of E. coli bacterium in a flowing N2-O2 post-discharge reactor

    International Nuclear Information System (INIS)

    Villeger, S; Cousty, S; Ricard, A; Sixou, M

    2003-01-01

    Effective destruction of Escherichia coli (E. coli) bacteria has been obtained in a flowing N 2 -O 2 microwave post-discharge reactor. The sterilizing agents are the O atoms and the UV emissions of NOβ which are produced by N and O atoms recombination in the reactor. In the following plasma conditions: pressure 5 Torr, flow rate 1 L n min -1 , microwave power of 100 W in a quartz tube of 5 mm, an O atom density of 2.5x10 15 cm -3 is measured by NO titration in the post-discharge reactor with UV emission in a N 2 -(5%)O 2 gas mixture. Full destruction of 10 13 cfu ml -1 E. coli is observed after a treatment time of 25 min. (rapid communication)

  1. Yield-increasing additives in kraft pulping: Effect on carbohydrate retention, composition and handsheet properties

    Energy Technology Data Exchange (ETDEWEB)

    Vaaler, David Andre Grimsoeen

    2008-07-01

    In this thesis, increased hemicellulose retention during kraft pulping has been studied. The work has been divided into three parts: i) Development of an accessible and reliable method for determination of carbohydrate composition of kraft pulps ii) Investigation of the composition and molecular mass distributions of the carbohydrates in kraft pulps with increased hemicellulose content iii) Investigation of the effect of increased hemicellulose content on the sheet properties of kraft pulps with increased hemicellulose content. A method for carbohydrate determination was developed. In this method, enzymes are used to hydrolyse the pulp into monosaccharides. A relatively mild acid hydrolysis is performed prior to detection on an HPLC with an RI-detector. The pulp is not derivatized and no pre-treatment (mechanical or chemical) is needed to determine the carbohydrate composition using the method developed here. Peak deconvolution software is used to improve the accuracy. Polysulphide and H2S primarily increase the glucomannan yield, which can be boosted by up to 7 % on o.d. wood. However, the cellulose yield is more affected by the cooking time and the maximum yield increase of cellulose is approximately 2 % on o.d. wood compared to an ordinary kraft pulp. The cooking time is influenced by sulphide ion concentration, AQ addition and the final Kappa number. The xylan yield is remarkably stable, however the alkali profile during the cook may influence the xylan yield. Surface xylan content of the fibres depends on residual alkali concentration in the black liquor. The molecular mass distributions of cellulose and hemicellulose were determined for pulps with increased hemicellulose content using size exclusion chromatography. Deconvolution by peak separation software is used to gain information about the degree of polymerization for cellulose and hemicellulose. The average DP of glucomannan in the kraft fibre was found to be 350 +- 30 and the average DP of xylan in the

  2. SLOWKIN: a simplified model for the simulation of reactor transients in SLOWPOKE-2

    International Nuclear Information System (INIS)

    Rozon, D.; Kavih, S.

    1997-01-01

    This paper will describe the model used to analyse reactor transients in the SLOWPOKE-2 reactor at Polytechnique. The model is intended to simulate reactor transients which will be induced by control rod displacements during commissioning of the new LEU core to be installed in the SLOWPOKE-2 reactor in 1997, in replacement of the original HEU core. A simplified treatment is justified since our objective is mainly to provide a physical interpretation for any difference observed in the transient behaviour of the new core, as opposed to the current HEU core. The SLOWKIN model used point kinetics to predict neutron power with time. The reactor physics codes DRAGON/DONJON were used to provide some reactor physics insight on the strong neutronic/thermalhydraulic coupling in the reactor and to generate the necessary reactivity coefficients to be used in SLOWKIN. (DM)

  3. AB INITIO INVESTIGATION OF 12-CROWN-4 AND BENZO-12-CROWN-4 COMPLEXES WITH Li+, Na+, K+, Zn2+, Cd2+, AND Hg2+

    Directory of Open Access Journals (Sweden)

    Yahmin Yahmin

    2010-06-01

    Full Text Available The structure and binding energies of 12-crown-4 and benzo-12-crown-4 complexes with Li+, Na+, K+, Zn2+, Cd2+, and Hg2+were investigated with ab initio calculations using Hartree-Fock approximation and second-order perturbation theory. The basis set used in this study is lanl2mb. The structure optimization of cation-crown ether complexes was evaluated at HF/lanl2mb level of theory and interaction energy of the corresponding complexes was calculated at MP2/lanl2mb level of theory (MP2/lanl2mb//HF/lanl2mb. Interactions of the crown ethers and the cations were discussed in term of the structure parameter of crown ether. The binding energies of the complexes show that all complex formed from transition metal cations is more stable than the complexes formed from alkali metal cations.   Keywords: 12-crown-4, benzo-12-crown-4, alkali metals, transition metals

  4. D2 dissociative adsorption on and associative desorption from Si(100): Dynamic consequences of an ab initio potential energy surface

    DEFF Research Database (Denmark)

    Luntz, A. C.; Kratzer, Peter

    1996-01-01

    favors the symmetric one. Under the conditions of many experiments, either could dominate. The calculations show quite weak dynamic coupling to the Si lattice for both paths, i.e., weak surface temperature dependences to dissociation and small energy loss to the lattice upon desorption......Dynamical calculations are reported for D-2 dissociative chemisorption on and associative desorption from a Si(100) surface. These calculations use the dynamically relevant effective potential which is based on an ab initio potential energy surface for the ''pre-paired'' species. Three coordinates...

  5. Nuclear Reactor RA Safety Report, Vol. 2, Site characterization

    International Nuclear Information System (INIS)

    1986-11-01

    RA research reactor is located in the village Vinca, in the vicinity of the Danube right bank, downstream from Belgrade, about 12 km from the city center. The reactor building is in the shallow valley on a plateau about 100 m above the sea level and 20 m above the Danube level. Apart from geographic and demographic data of the reactor site this document covers geologic, seismology and hydrology data. Climatic, ecology and radioactivity data of the surroundings are included as well [sr

  6. Coupling TOR to the Cell Cycle by the Greatwall–Endosulfine–PP2A-B55 Pathway

    Directory of Open Access Journals (Sweden)

    Livia Pérez-Hidalgo

    2017-08-01

    Full Text Available Cell growth and division are two processes tightly coupled in proliferating cells. While Target of Rapamycin (TOR is the master regulator of growth, the cell cycle is dictated by the activity of the cyclin-dependent kinases (CDKs. A long-standing question in cell biology is how these processes may be connected. Recent work has highlighted that regulating the phosphatases that revert CDK phosphorylations is as important as regulating the CDKs for cell cycle progression. At mitosis, maintaining a low level of protein phosphatase 2A (PP2A-B55 activity is essential for CDK substrates to achieve the correct level of phosphorylation. The conserved Greatwall–Endosulfine pathway has been shown to be required for PP2A-B55 inhibition at mitosis in yeasts and multicellular organisms. Interestingly, in yeasts, the Greatwall–Endosulfine pathway is negatively regulated by TOR Complex 1 (TORC1. Moreover, Greatwall–Endosulfine activation upon TORC1 inhibition has been shown to regulate the progression of the cell cycle at different points: the G1 phase in budding yeast, the G2/M transition and the differentiation response in fission yeast, and the entry into quiescence in both budding and fission yeasts. In this review, we discuss the recent findings on how the Greatwall–Endosulfine pathway may provide a connection between cell growth and the cell cycle machinery.

  7. Accurate high level ab initio-based global potential energy surface and dynamics calculations for ground state of CH2(+).

    Science.gov (United States)

    Li, Y Q; Zhang, P Y; Han, K L

    2015-03-28

    A global many-body expansion potential energy surface is reported for the electronic ground state of CH2 (+) by fitting high level ab initio energies calculated at the multireference configuration interaction level with the aug-cc-pV6Z basis set. The topographical features of the new global potential energy surface are examined in detail and found to be in good agreement with those calculated directly from the raw ab initio energies, as well as previous calculations available in the literature. In turn, in order to validate the potential energy surface, a test theoretical study of the reaction CH(+)(X(1)Σ(+))+H((2)S)→C(+)((2)P)+H2(X(1)Σg (+)) has been carried out with the method of time dependent wavepacket on the title potential energy surface. The total integral cross sections and the rate coefficients have been calculated; the results determined that the new potential energy surface can both be recommended for dynamics studies of any type and as building blocks for constructing the potential energy surfaces of larger C(+)/H containing systems.

  8. RHTF 2, a 1200 MWe high temperature reactor

    International Nuclear Information System (INIS)

    Brisbois, Jacques

    1978-01-01

    After having adapted to French conditions the 1160 MWe G.A.C. reactor, Commissariat a l'Energie Atomique and French Industry have decided to design an High Temperature Reactor 1200 MWe based on the G.A.C. technology and taking into account the point of view of Electricite de France and the experience of C.E.A. and industry on the gas cooled reactor technology. The main objective of this work is to produce a reactor design having a low technical risk, good operability, with an emphasis on the safety aspects easing the licensing problems

  9. VISA-2, Reactor Vessel Failure Probability Under Thermal Shock

    International Nuclear Information System (INIS)

    Simonen, F.; Johnson, K.

    1992-01-01

    1 - Description of program or function: VISA2 (Vessel Integrity Simulation Analysis) was developed to estimate the failure probability of nuclear reactor pressure vessels under pressurized thermal shock conditions. The deterministic portion of the code performs heat transfer, stress, and fracture mechanics calculations for a vessel subjected to a user-specified temperature and pressure transient. The probabilistic analysis performs a Monte Carlo simulation to estimate the probability of vessel failure. Parameters such as initial crack size and position, copper and nickel content, fluence, and the fracture toughness values for crack initiation and arrest are treated as random variables. Linear elastic fracture mechanics methods are used to model crack initiation and growth. This includes cladding effects in the heat transfer, stress, and fracture mechanics calculations. The simulation procedure treats an entire vessel and recognizes that more than one flaw can exist in a given vessel. The flaw model allows random positioning of the flaw within the vessel wall thickness, and the user can specify either flaw length or length-to-depth aspect ratio for crack initiation and arrest predictions. The flaw size distribution can be adjust on the basis of different inservice inspection techniques and inspection conditions. The toughness simulation model includes a menu of alternative equations for predicting the shift in the reference temperature of the nil-ductility transition. 2 - Method of solution: The solution method uses closed form equations for temperatures, stresses, and stress intensity factors. A polynomial fitting procedure approximates the specified pressure and temperature transient. Failure probabilities are calculated by a Monte Carlo simulation. 3 - Restrictions on the complexity of the problem: Maxima of 30 welds. VISA2 models only the belt-line (cylindrical) region of a reactor vessel. The stresses are a function of the radial (through-wall) coordinate only

  10. An ab initio Study of the Potential Energy Surface of the Reaction CHCl2+ + H2 and Comparison with Experimental Data

    Czech Academy of Sciences Publication Activity Database

    Roithová, Jana; Hrušák, Jan; Herman, Zdeněk

    2003-01-01

    Roč. 107, - (2003), s. 7355-7363 ISSN 1089-5639 R&D Projects: GA ČR GA203/00/0632; GA AV ČR KJB4040302 Institutional research plan: CEZ:AV0Z4040901 Keywords : ab initio study * reaction CHCl2+ + H2 * experimental data Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.792, year: 2003

  11. Association of CDKAL1, CDKN2A/B & HHEX gene polymorphisms with type 2 diabetes mellitus in the population of Hyderabad, India

    Directory of Open Access Journals (Sweden)

    Uma Jyothi Kommoju

    2016-01-01

    Interpretation & conclusions: A significant association was seen of all the three SNPs of CDKAL1 and CDKN2A/B genes with T2DM but none of the two SNPs of HHEX. Further studies are required to cross-validate our findings in a relatively larger sample. It is also necessary to explore other SNPs of HHEX gene to unequivocally establish the pattern of association of this gene with T2DM in this population.

  12. Imaging of dialysis-related amyloid (AB-amyloid) deposits with 131I-beta 2-microglobulin

    International Nuclear Information System (INIS)

    Floege, J.; Burchert, W.; Brandis, A.; Gielow, P.; Nonnast-Daniel, B.; Spindler, E.; Hundeshagen, H.; Shaldon, S.; Koch, K.M.

    1990-01-01

    The diagnosis of dialysis-related amyloid (AB-amyloid) has been based usually on clinical and radiological criteria. Following the discovery that beta 2-microglobulin was the major protein of this amyloid, we isolated and radiolabelled uremic plasma beta 2-microglobulin. After intravenous injection, gamma-camera images of selected joint areas were obtained from 42 patients who were on regular hemodialysis therapy. Positive scans involving the shoulder, hip, knee and carpal regions were found in 13 of 14 patients treated for more than 10 years and 10 of 16 patients treated for 5 to 10 years. Patients treated for less time had negative scans. Specificity was indicated by negative scans in non-amyloid inflammatory lesions in control hemodialysis patients. Up to 48-fold tracer enrichment was detected in excised AB-amyloid containing tissue as compared to amyloid-free tissue. These findings suggest that circulating radiolabelled beta 2-microglobulin is taken up by the amyloid deposits. This method may non-invasively detect tissue infiltrates of amyloid. It may also permit prospective evaluation of the efficacy of prophylactic dialysis strategies which are designed to prevent or delay the onset of this complication of long-term dialysis

  13. ASAMPSA2 best-practices guidelines for L2 PSA development and applications. Volume 3 - Extension to Gen IV reactors

    International Nuclear Information System (INIS)

    Bassi, C.; Bonneville, H.; Brinkman, H.; Burgazzi, L.; Polidoro, F.; Vincon, L.; Jouve, S.

    2010-01-01

    The main objective assigned to the Work Package 4 (WP4) of the 'ASAMPSA2' project (EC 7. FPRD) consist in the verification of the potential compliance of L2PSA guidelines based on PWR/BWR reactors (which are specific tasks of WP2 and WP3) with Generation IV representative concepts. Therefore, in order to exhibit potential discrepancies between LWRs and new reactor types, the following work was based on the up-to-date designs of: - The European Fast Reactor (EFR) which will be considered as prototypical of a pool-type Sodium-cooled Fast Reactor (SFR); - The ELSY design for the Lead-cooled Fast Reactor (LFR) technology; - The ANTARES project which could be representative of a Very-High Temperature Reactor (VHTR); - The CEA 2400 MWth Gas-cooled Fast Reactor (GFR). (authors)

  14. SNR-2 reactor: Design, state, trends and methods

    International Nuclear Information System (INIS)

    Wehmann, U.

    1983-01-01

    Starting at the situation in 1975, the basic ideas that have lead from the reference care HOM 1 to today's basic core are shown. The use of the various methods is discussed by means of typical aspects of design: BRUST for parameter studies (e.g.: rod cross sections and the influence of burnup on cycle costs), RZ-diffusion for comparative studies with a high degree of accuracy required (e.g.: the influence of rod cross sections on reactivity coefficients), 3-dimensional diffusion (e.g.: studies aiming at reducing the number of absorbers, 3-d burnup of the basic care), 3-d transport (e.g.: ensuring of absorber efficiencies calculated by DEGEN). Further possible design modifications for the SNR-2 reactor and related design work are discussed. In addition to Dr. Heussen's lecture, the present state-of-the-art in design methods and improvements that may be required are dealt with. (orig.) [de

  15. BR2 reactor core steady state transient modeling

    International Nuclear Information System (INIS)

    Makarenko, A.; Petrova, T.

    2000-01-01

    A coupled neutronics/hydraulics/heat-conduction model of the BR2 reactor core is under development at SCK-CEN. The neutron transport phenomenon has been implemented as steady state and time dependent nodal diffusion. The non-linear heat conduction equation in-side fuel elements is solved with a time dependent finite element method. To allow coupling between functional modules and to simulate subcooled regimes, a simple single-phase hydraulics has been introduced, while the two-phase hydraulics is under development. Multiple tests, general benchmark cases as well as calculation/experiment comparisons demonstrated a good accuracy of both neutronic and thermal hydraulic models, numerical reliability and full code portability. A refinement methodology has been developed and tested for better neutronic representation in hexagonal geometry. Much effort is still needed to complete the development of an extended cross section library with kinetic data and two-phase flow representation. (author)

  16. Bio-based polyurethane prepared from Kraft lignin and modified castor oil

    Directory of Open Access Journals (Sweden)

    L. B. Tavares

    2016-11-01

    Full Text Available Current challenges highlight the need for polymer research using renewable natural sources as a substitute for petroleum-based polymers. The use of polyols obtained from renewable sources combined with the reuse of industrial residues such as lignin is an important agent in this process. Different compositions of polyurethane-type materials were prepared by combining technical Kraft lignin (TKL with castor oil (CO or modified castor oil (MCO1 and MCO2 to increase their reactivity towards diphenylmethane diisocyanate (MDI. The results indicate that lignin increases the glass transition temperature, the crosslinking density and improves the ultimate stress especially for those prepared from MCO2 and 30% lignin content from 8.2 MPa (lignin free to 23.5 MPa. Scanning electron microscopy (SEM micrographs of rupture surface after uniaxial tensile tests show ductile-to-brittle transition. The results show the possibility to develop polyurethane-type materials, varying technical grade Kraft lignin content, which cover a wide range of mechanical properties (from large elastic/low Young modulus to brittle/high Young modulus polyurethanes.

  17. ASAMPSA2 project: Appliance of LWR PSA2 methodology to GEN IV reactors

    International Nuclear Information System (INIS)

    Bonneville, H.; Raimond, E.; Bassi, C.; Bertrand, F.; Serre, F.; Brinkman, J.L.; Burgazzi, L.; Jouve, S.; Vincon, L.; Polidoro, F.

    2012-01-01

    The European project ASAMPSA2 (Advanced Safety Assessment Methodology: level 2 PSA) of the 7. Framework Program aims at writing practical guidelines for conducting PSA level 2 studies on Light Water Reactors (PWR and BWR). The project includes also a supplemental task dealing with GEN IV reactors. Two main objectives are assigned to this task: 1) the verification of the potential compliance of L2PSA guidelines based on PWR/BWR reactors with Generation IV concepts; 2) a brief survey of the modelling needs to describe the new features of GEN IV reactor concepts in terms of performing a level 2 PSA. Taking into account the ASAMPSA2 partners knowledge, the project has focused on four concepts: SFR, LFR, GFR and VHTR. For each of those concepts, a conceptual design was selected as reference: the European Fast Reactor (EFR) for sodium cooled fast reactors, the ELSY project for lead cooled fast reactor, the CEA GFR2400 project and the ANTARES project for VHTR. As a first stage, relevant data for each concept have been collected when available. These included: 1) basic general parameters and design characteristics relevant for safety studies with a specific attention given to passive devices; 2) information about former PSA2 studies on such concepts; 3) expert reviews about accident phenomenology knowledge (like PIRT); 4) list of computational tools developed or used for accident progression studies with, if possible, some basic information about the tools (availability, level of development, validation, documentation). In a second stage, the collected data were used to evaluate the compliance of the LWR guideline chapters with GEN IV concepts. The LWR guidelines may be divided into two main sections: chapters dealing with a specific phenomenon induced by core degradation and chapters dealing with general PSA methodology (like interface between PSA1 and PSA2, human risk assessment, system modelling and the role of expert opinion). The overall conclusion is that methodology

  18. The CodY-dependent clhAB2 operon is involved in cell shape, chaining and autolysis in Bacillus cereus ATCC 14579.

    Science.gov (United States)

    Huillet, Eugénie; Bridoux, Ludovic; Wanapaisan, Pagakrong; Rejasse, Agnès; Peng, Qi; Panbangred, Watanalai; Lereclus, Didier

    2017-01-01

    The Gram-positive pathogen Bacillus cereus is able to grow in chains of rod-shaped cells, but the regulation of chaining remains largely unknown. Here, we observe that glucose-grown cells of B. cereus ATCC 14579 form longer chains than those grown in the absence of glucose during the late exponential and transition growth phases, and identify that the clhAB2 operon is required for this chain lengthening phenotype. The clhAB2 operon is specific to the B. cereus group (i.e., B. thuringiensis, B. anthracis and B. cereus) and encodes two membrane proteins of unknown function, which are homologous to the Staphylococcus aureus CidA and CidB proteins involved in cell death control within glucose-grown cells. A deletion mutant (ΔclhAB2) was constructed and our quantitative image analyses show that ΔclhAB2 cells formed abnormal short chains regardless of the presence of glucose. We also found that glucose-grown cells of ΔclhAB2 were significantly wider than wild-type cells (1.47 μm ±CI95% 0.04 vs 1.19 μm ±CI95% 0.03, respectively), suggesting an alteration of the bacterial cell wall. Remarkably, ΔclhAB2 cells showed accelerated autolysis under autolysis-inducing conditions, compared to wild-type cells. Overall, our data suggest that the B. cereus clhAB2 operon modulates peptidoglycan hydrolase activity, which is required for proper cell shape and chain length during cell growth, and down-regulates autolysin activity. Lastly, we studied the transcription of clhAB2 using a lacZ transcriptional reporter in wild-type, ccpA and codY deletion-mutant strains. We found that the global transcriptional regulatory protein CodY is required for the basal level of clhAB2 expression under all conditions tested, including the transition growth phase while CcpA, the major global carbon regulator, is needed for the high-level expression of clhAB2 in glucose-grown cells.

  19. Cyclin dependent kinase inhibitor 2A/B gene deletions are markers of poor prognosis in Indian children with acute lymphoblastic leukemia.

    Science.gov (United States)

    Agarwal, Manisha; Bakhshi, Sameer; Dwivedi, Sadanand N; Kabra, Madhulika; Shukla, Rashmi; Seth, Rachna

    2018-06-01

    Cyclin dependent kinase inhibitor 2A/B (CDKN2A/B) genes are implicated in many malignancies including acute lymphoblastic leukemia (ALL). These tumor suppressor genes, with a key regulatory role in cell cycle are located on chromosome 9p21.3. Previous studies involving CDKN2A/B gene deletions have shown mixed associations with survival outcome in childhood ALL. Hundred and four newly diagnosed children with ALL (1-14 years) were enrolled in this study. Genomic DNA from pretreatment bone marrow/peripheral blood samples of these children was investigated for copy number alterations in CDKN2A/B genes using multiplex ligation dependent probe amplification assay. Immunophenotype subtyping and cytogenetic and molecular analysis of ALL was performed at start of induction chemotherapy in all children. Children were monitored for response to prednisolone (Day 8), complete morphological remission, and minimal residual disease at the end of induction. The minimum postinduction follow-up period was 6 months. CDKN2A/B deletions were seen in 19.8% (18/91) of B lineage acute lymphoblastic leukemia (B-ALL) and 38.5% (5/13) of T lineage acute lymphoblastic leukemia (T-ALL). Monoallelic CDKN2A/B deletions were found in 61.1% of total deletions in B-ALL while all the children with T-ALL harbored biallelic deletions. The prevalence of CDKN2A/B gene deletions was found to be significantly higher in older children (P = 0.002), in those with higher leukocyte count (P = 0.037), and in National Cancer Institute high risk group patients (P = 0.001) in the B-ALL subgroup. Hazard ratio was significantly high for children with CDKN2A/B deletions in total cohort (P = 0.004). Children with CDKN2A/B deletion had significantly lesser event free survival (P = 0.03). CDKN2A/B deletions were significantly more prevalent in T-ALL subgroup and were found to have higher hazard ratio and lesser event free survival in total cohort in our study. © 2018 Wiley Periodicals, Inc.

  20. Preparation, biodistribution and dosimetry of copper-64-labeled anti-colorectal carcinoma monoclonal antibody fragments 1A3-F(ab')2

    International Nuclear Information System (INIS)

    Anderson, C.J.; Schwarz, S.W.; Connett, J.M.

    1995-01-01

    Antibody fragments labeled with a radiometal using bifunctional chelates generally undergo renal clearance followed by trapping of the metabolites, leading to high radiation doses to the kidneys. Copper-64-labeled BAT-2IT-1A3-F(ab') 2 was recently reported to accumulate in colorectal tumors in an animal model, however, kidney uptake was also high. In this study, the preparation of 64 Cu-BAT-2IT-1A3-F(ab') 2 was optimized to reduce the renal uptake. The bifunctional chelate 6-bromoacetamidobenzyl-1,4,8,11-tetraazacyclotetradecane-N,N',N double-prime,N'double-prime-tetraacetic acid (BAT) was conjugated to 1A3-F(ab') 2 using the linking agent 2-iminothiolane (2IT). The conjugation reaction produced 20% of a lower molecular weight impurity found to be TETA-1A3-Fab'. The conjugation procedure was optimized to include FPLC purification of the BAT-2IT-1A3-F(ab') 2 from TETA-1A3-Fab' after conjugation prior to labeling with 64 Cu. The biodistribution of 64 Cu-labeled FPLC-purified and unpurified conjugates was determined in normal Sprague-Dawley rats and tumor-bearing Golden Syrian hamsters. Human absorbed doses were calculated from rat biodistribution data and PET imaging of a baboon. Upon FPLC purification of the BAT-2IT-1A3-F(ab') 2 , the immunoreactivity of 64 Cu-labeled 1A3-F(ab') 2 was significantly improved over that of non-FPLC-purified 64 Cu-BAT-2IT-1A3-F(ab') 2 , and the kidney uptake was decreased in normal rats. The biodistribution in hamsters showed some improvement in both tumor uptake and kidney clearance with FPLC-purified 64 Cu-BAT-2IT-1A3-F(ab') 2 .The improved dosimetry of 64 Cu-labeled FPLC purified BAT-2IT-1A3-F(ab') 2 should more readily allow this agent to be investigated clinically to image colorectal cancer using PET. 33 refs., 7 figs., 3 tabs

  1. Aluminum alters NMDA receptor 1A and 2A/B expression on neonatal hippocampal neurons in rats

    Directory of Open Access Journals (Sweden)

    Yuan Chia-Yi

    2011-11-01

    Full Text Available Abstract Background High aluminum (Al content in certain infant formula raises the concern of possible Al toxicity on brain development of neonates during their vulnerable period of growing. Results of in vivo study showed that Al content of brain tissues reached to 74 μM when oral intake up to 1110 μM, 10 times of that in the hi-Al infant formula. Methods Utilizing a cultured neuron cells in vitro model, we have assessed Al influence on neuronal specific gene expression alteration by immunoblot and immunohistochemistry and neural proliferation rate changes by MTT assay. Results Microscopic images showed that the neurite outgrowth of hippocampal neurons increased along with the Al dosages (37, 74 μM Al (AlCl3. MTT results also indicated that Al increased neural cell viability. On the other hand, the immunocytochemistry staining suggested that the protein expressions of NMDAR 1A and NMDAR 2A/B decreased with the Al dosages (p Conclusion Treated hippocampal neurons with 37 and 74 μM of Al for 14 days increased neural cell viability, but hampered NMDAR 1A and NMDAR 2A/B expressions. It was suggested that Al exposure might alter the development of hippocampal neurons in neonatal rats.

  2. F(ab'2 antibody fragments against Trypanosoma cruzi calreticulin inhibit its interaction with the first component of human complement

    Directory of Open Access Journals (Sweden)

    LORENA AGUILAR

    2005-01-01

    Full Text Available Trypanosoma cruzi calreticulin (TcCRT, described in our laboratory, retains several important functional features from its vertebrate homologues. We have shown that recombinant TcCRT inhibits the human complement system when it binds to the collagenous portion of C1q. The generation of classical pathway convertases and membrane attack complexes is thus strongly inhibited. In most T. cruzi-infected individuals, TcCRT is immunogenic and mediates the generation of specific antibodies. By reverting the C1q / TcCRT interaction, a parasite immune evasion strategy, these antibodies contribute to the host / parasite equilibrium. In an in vitro correlate of this situation, we show that the C1q / TcCRT interaction is inhibited by F(ab'2 polyclonal anti-TcCRT IgG fragments. It is therefore feasible that in infected humans anti-TcCRT antibodies participate in reverting an important parasite strategy aimed at inhibiting the classical complement pathway. Thus, membrane-bound TcCRT interacts with the collagenous portion C1q, and this C1q is recognized by the CD91-bound host cell CRT, thus facilitating parasite internalization. Based on our in vitro results, it could be proposed that the in vivo interaction between TcCRT and vertebrate C1q could be inhibited by F(ab'2 fragments anti-rTcCRT or against its S functional domain, thus interfering with the internalization process

  3. Bt cotton producing Cry1Ac and Cry2Ab does not harm two parasitoids, Cotesia marginiventris and Copidosoma floridanum.

    Science.gov (United States)

    Tian, Jun-Ce; Wang, Xiang-Ping; Chen, Yang; Romeis, Jörg; Naranjo, Steven E; Hellmich, Richard L; Wang, Ping; Shelton, Anthony M

    2018-01-10

    Cabbage looper, Trichoplusia ni (Hübner) is an important lepidopteran pest on many vegetable and greenhouse crops, and some field crops. Although there are no commercial transgenic Bt vegetable or greenhouse crops, T. ni is a target of Bollgard II cotton, which produces Cry1Ac and Cry2Ab. We expand on previous work that examined the effect of Bt crops on parasitoids using Bt-resistant lepidopteran populations as hosts. Cry1Ac/Cry2Ab-resistant T. ni larvae were used to eliminate host quality effects and to evaluate the direct effects of Bt cotton on the parasitoids Copidosoma floridanum (Ashmead) and Cotesia marginiventris (Cresson). These tri-trophic studies confirm that Bt cotton had no significant impact on development, success of parasitism, survival and adult longevity of C. marginiventris when using Bt-resistant T. ni fed on Bt cotton. Similarly, this Bt cotton had no significant impact on the development, mummy weight and the number of progeny produced by C. floridanum. Our studies verified that lyophilized Bt crop tissue maintained its insecticidal bioactivity when incorporated into an artificial diet, demonstrating that hosts and parasitoids were exposed to active Cry proteins. The egg-larval parasitoid C. floridanum, or similar species that consume their entire host, should be considered useful surrogates in risk assessment of Bt crops to non-target arthropods.

  4. Set of rules SOR 2 licensing of nuclear reactors

    International Nuclear Information System (INIS)

    1976-05-01

    This is the set of rules promulgated by the Israel Atomic Energy Commission pursuant to the Supervision of Supplies and Services Law 5718-1957, Order regarding Supervision of Nuclear Reactors (1974) Chapter 3: Permits, to provide for the Licensing of Nuclear Reactors. (B.G.)

  5. Operating reactors licensing actions summary. Vol. 4, No. 2

    International Nuclear Information System (INIS)

    1984-04-01

    This summary is designed to provide the management of the Nuclear Regulatory Commission (NRC) with an overview of licensing actions dealing with operating power and nonpower reactors. These reports utilize data collected from the Division of Licensing in the Office of Nuclear Reactor Regulation and are prepared by the Office of Resource Management

  6. The CO2 cooling gas for the reactors G2/G3 (leaking, analysis, activity)

    International Nuclear Information System (INIS)

    Meiffren, J.; Dupay, F.

    1965-01-01

    The main objective of this study is to publicise the data obtained during five years operation of the reactor G2 and G3 at Marcoule as far as the cooling gas is concerned, from storage of reserves up to its slow escape into the atmosphere, and including all the stages of its practical use, its chemical examination, its nuclear behaviour and its possible physicochemical transformation. This work can not only yield information about the operations carried out at Marcoule but can also provide useful suggestions for improving the sealing and for decreasing the activity of the pressurized gas circuits in reactors similar to G2/G3. (authors) [fr

  7. Electronic structure of Ge-2 and Ge-2 and thermodynamic properties of Ge-2 from all electron ab initio investigations and Knudsen effusion mass spectroscopic measurements

    DEFF Research Database (Denmark)

    Shim, Irene; Baba, M. Sai; Gingerich, K.A.

    2002-01-01

    The low-lying states of the molecule Ge-2 and of the ion Ge-2(-) have been investigated by all electron ab initio multiconfiguration self-consistent field (CASSCF) and multi-reference configuration interaction (MRCI) calculations. The relativistic corrections for the Darwin contact term...... and for the mass-velocity term have been determined in perturbation calculations. Treatment of the spin-orbit coupling has been included. The ground state of Ge-2 is derived as 0(g)(+)((3)Sigma(g)(-)) with equilibrium distance 2.422 Angstrom, and vibrational frequency 270 cm(-1). The spectroscopic constants of 15...... excited states are presented. Thermal functions based on the theoretically determined molecular parameters were used to derive the thermodynamic properties of the Ge-2 molecule from new mass spectrometric equilibrium data. The literature value for the dissociation energy of Ge-2 has been re...

  8. Extraction of hemicellulose from South African eucalyptus grandis using weak white liquor activation technology and its impact on kraft pulping efficiency

    CSIR Research Space (South Africa)

    Johakimu, Jonas K

    2017-09-01

    Full Text Available , near neutral pH during woodchips activation, a short wood activation time (15 min), and weak white liquor to water ratio of 20:80 is required. The concentration of hemicelluloses in the extract was approximately 2.0 g/L. During kraft pulping, weak white...

  9. An experimental investigation of fission product release in SLOWPOKE-2 reactors - Data report

    International Nuclear Information System (INIS)

    Harnden, A.M.C.

    1995-09-01

    The results of an investigation into the release of fission products from SLOWPOKE-2 reactors fuelled with a highly-enriched uranium alloy core are detailed in Volume 1. This data report (Volume 2) contains plots of the activity concentrations of the fission products observed in the reactor container at the University of Toronto, Ecole Polytechnique and the Kanata Isotope Production Facility. Release rates from the reactor container water to the gas headspace are also included. (author)

  10. Reducing sugar production of sweet sorghum bagasse kraft pulp

    Science.gov (United States)

    Solihat, Nissa Nurfajrin; Fajriutami, Triyani; Adi, Deddy Triyono Nugroho; Fatriasari, Widya; Hermiati, Euis

    2017-01-01

    Kraft pulping of sweet sorghum bagasse (SSB) has been used for effective delignification method for cellulose production. This study was conducted to evaluate the performance pulp kraft of SSB for reducing sugar production. The study intended to investigate the effect of active alkali and sulfidity loading variation of SSB pulp kraft on reducing sugar yield per biomass. The SSB pulp was prepared after pulping using three variations of active alkali (17, 19, and 22%) and sulfidity loading (20, 22, and 24%) at 170°C for 4 h with liquor to wood ratio of 10. A total of 9 pulps were obtained from these pretreatments. Delignification pretreatment has been succesfully removed lignin and hemicellulose more than 90% and 50%, respectively. Increasing active alkali and sulfidity loading has significantly increased lignin removal caused by disruption of the cell wall structure for releasing lignin into black liquor in the cellulose extraction. The enzymatic hydrolysis of pulp was carried out with cellulase loading of 40 FPU per g substrate in the shaking incubator at 50°C and 150 rpm for 78 h. For each 24 h, the reducing sugar yield (DNS assay) has been observed. Even though the lignin and hemicellulose loss occurred along with higher active alkali loading, this condition tends to decrease its yield. The reducing sugar concentration varied between 7-8 g/L. Increasing active alkali and sulfidity was significantly decreased the reducing sugar per biomass. Pulp delignified by 17% active alkali and 20% sulfidity has demonstrated the maximum reducing sugar yield per biomass of 45.57% resulted after 72 h enzymatic hydrolysis. These results indicated that kraft pulping was success to degrade more lignin and hemicellulose content to facilitate the enzyme for breaking down the cellulose into its sugar monomer. A high loss of lignin and hemicellulose are not single factor to improve digestibility of SSB. This sugar has potential for yeast fermented into bioethanol.

  11. Mergers and acquisitions : the case of Kraft Foods and Cadbury

    OpenAIRE

    Ribeiro, Sara Isabel de Paula

    2013-01-01

    The aim of this dissertation is to focus on a determinant aspect of Corporate Finance that is Mergers and Acquisitions (M&A). This dissertation not only provides a practical analysis of main issued regarding a process of M&A, but also provides a theoretical framework about M&A. Specifically, this dissertation explores the real case of Kraft Foods - world’s second largest manufacturer and packager food products – and Cadbury - the world’s second largest confectionery firm. ...

  12. Turkey's regulatory plans for high enriched to low enriched conversion of TR-2 reactor core

    International Nuclear Information System (INIS)

    Guelol Oezdere, Oya

    2003-01-01

    Turkey is a developing country and has three nuclear facilities two of which are research reactors and one pilot fuel production plant. One of the two research reactors is TR-2 which is located in Cekmece site in Istanbul. TR-2 Reactor's core is composed of both high enriched and low enriched fuel and from high enriched to low enriched core conversion project will take place in year 2005. This paper presents the plans for drafting regulations on the safety analysis report updates for high enriched to low enriched core conversion of TR-2 reactor, the present regulatory structure of Turkey and licensing activities of nuclear facilities. (author)

  13. Internationalisation; KonKraft-rapport 4; Internasjonalisering

    Energy Technology Data Exchange (ETDEWEB)

    2008-07-01

    disintegrate. The obvious strategy to pursuit is to strengthen Norway's position as a dynamic and leading competence center for oil- and gas activities. Recruitment and development of sufficient competencies is generally a major challenge for the oil- and gas trade. Shortage of human capital leads to increased wage pressure which in the long run may weaken profits and competitiveness. In some of the petroleum clusters the companies try to find solutions to counteract the negative effects of the battle for the best brains. Through the project KonKraft INTSOK has unveiled high ambitions concerning increased internationalisation throughout the Norwegian petroleum cluster, except for Northern Norway. Here there is still an opposition against activities in the region, as well as in the Barents sea. INTSOK's intention with the project has been to describe its multitude. Therefore eight very different environments where selected to make a closer study on the development in different regions. The environments represent a variety of sizes, geography and trades. Some of the clusters are new or under establishment, others are already in full operation. Together the eight environments cover a major part of the value chain in the Norwegian offshore sector. The project has clearly demonstrated that cluster development contributes both to internationalisation as well as keeping the companies in Norway. Some main findings: The positive development in the drilling cluster of Southern Norway - the Node cluster - has created strong impact: The cluster ranks among the world's leading on drilling equipment and barely any oil or gas environment has had a similar expansion. The Kongsberg environment is not an offshore cluster, but an overall technology cluster where offshore applications is one of several technology areas. The companies develop and produce a broad range of advanced products and systems. The turnover among the offshore companies amounts to 65% of the total turnover for

  14. The Effect of Bacillus thuringiensis toxin Cry1A.105 and Cry2Ab2 on The Survival of The Non-Target Pest, Spodoptera litura

    Directory of Open Access Journals (Sweden)

    Kurnia Pratiwi

    2016-07-01

    Full Text Available Spodoptera litura is one of the important insect pest of maize besides the notoriously damaging corn borer, Ostrinia furnacalis. S. litura has been the target of various controls including the use of Bacillus thuringiensis (Bt toxin Cry1A.105 and Cry2Ab2. This study was conducted to evaluate the acute effect of Bt toxin Cry1A.105 and Cry2Ab2 on the growth and development of S. litura from larval to adult stages. Two sublethal concentrations were used; 0.1875 and 0.0469 ppm for Cry1A.105, and 0.0008 and 0.0003 ppm for Cry2Ab2. The bioassay using diet dipping was carried out on a CRD with three experiments and five repetitions. The observation was carried out on the mortality and survival rates of S. litura. The mortality reached 28% when the larvae were treated with 0.1875 ppm and 20% with 0.0469 ppm of Cry 1A.105. The exposed larvae and pupae were smaller than control. Larval and pupal weight were 117.0 and 165.6 g with 0.1875 ppm, while control were 212.9 and 211.2 g. Cry1A.105 also longer the larval stage, larval stage with higher and lower concentration were 24.5 and 22.3 day, while control was 20.5 day. The resulted pupae from larve which exposed by Cry1A.105 were less than control; there were 40% at concentration 0.1875 ppm and control 61%. The two concentration of Cry2Ab2 produced similar mortality of 20%. Similarly, Cry2Ab2 affected pupal to adult stages development. The longevity of pupal stage with concentration 0.0003 ppm was 9.5 days, followed by 0.0008 ppm (9.1 days and control (10.1 days. The adult emerge on the highest concentration was 47.4% while control only 34.6%. There results showed that both Cry1A.105 and Cry2Ab2 were detrimental to the survival of S. litura which is the non-target insect of transgenic Bt maize.   INTISARI   Spodoptera litura merupakan salah satu hama penting yang menyerang tanaman jagung, selain Ostrinia furnacalis. Belakangan ini O. furnacalis diketahui telah menjadi target dari berbagai macam cara

  15. Producing a True Lignin Depolymerase for Biobleaching Softwood Kraft Pulp

    Energy Technology Data Exchange (ETDEWEB)

    Simo Sarkanen

    2002-02-04

    This project constituted an intensive effort devoted to producing, from the white-rot fungus Tramets Cingulata, a lignin degrading enzyme (lignin depolymerase) that is directly able to biobleach or delignify softwood kraft pulp brownstock. To this end, the solutions in which T. cingulata was grown contained dissolved kraft lignin which fulfilled two functions; it behaved as a lignin deploymerase substrate and it also appeared to act as an inducer of enzyme expression. However, the lignin depolymerase isoenzymes (and other extracellular T. cingulata enzymes) interacted very strongly with both the kraft lignin components and the fungal hypae, so the isolating these proteins from the culture solutions proved to be unexpectedly difficult. Even after extensive experimentation with a variety of protein purification techniques, only one approach appeared to be capable of purifying lignin depolymerases to homogeneity. Unfortunately the procedure was extremely laborious; it involved the iso electric focusing of concentrated buffer-exchanged culture solutions followed by electro-elution of the desired protein bands from the appropriate polyacrylamide gel segments

  16. Room temperature linelists for CO2 asymmetric isotopologues with ab initio computed intensities

    Science.gov (United States)

    Zak, Emil J.; Tennyson, Jonathan; Polyansky, Oleg L.; Lodi, Lorenzo; Zobov, Nikolay F.; Tashkun, Sergei A.; Perevalov, Valery I.

    2017-12-01

    The present paper reports room temperature line lists for six asymmetric isotopologues of carbon dioxide: 16O12C18O (628), 16O12C17O (627), 16O13C18O (638),16O13C17O (637), 17O12C18O (728) and 17O13C18O (738), covering the range 0-8000 cm-1. Variational rotation-vibration wavefunctions and energy levels are computed using the DVR3D software suite and a high quality semi-empirical potential energy surface (PES), followed by computation of intensities using an ab initio dipole moment surface (DMS). A theoretical procedure for quantifying sensitivity of line intensities to minor distortions of the PES/DMS renders our theoretical model as critically evaluated. Several recent high quality measurements and theoretical approaches are discussed to provide a benchmark of our results against the most accurate available data. Indeed, the thesis of transferability of accuracy among different isotopologues with the use of mass-independent PES is supported by several examples. Thereby, we conclude that the majority of line intensities for strong bands are predicted with sub-percent accuracy. Accurate line positions are generated using an effective Hamiltonian, constructed from the latest experiments. This study completes the list of relevant isotopologues of carbon dioxide; these line lists are available to remote sensing studies and inclusion in databases.

  17. Anaerobic digestion of alkaline bleaching wastewater from a kraft pulp and paper mill using UASB technique.

    Science.gov (United States)

    Larsson, Madeleine; Truong, Xu-Bin; Björn, Annika; Ejlertsson, Jörgen; Bastviken, David; Svensson, Bo H; Karlsson, Anna

    2015-01-01

    Anaerobic digestion of alkaline kraft elemental chlorine-free bleaching wastewater in two mesophilic, lab-scale upflow anaerobic sludge bed reactors resulted in significantly higher biogas production (250±50 vs. 120±30 NmL g [Formula: see text]) and reduction of filtered total organic carbon (fTOC) (60±5 vs. 43±6%) for wastewater from processing of hardwood (HW) compared with softwood (SW). In all cases, the gas production was likely underestimated due to poor gas separation in the reactors. Despite changes in wastewater characteristics, a stable anaerobic process was maintained with hydraulic retention times (HRTs) between 7 and 14 h. Lowering the HRT (from 13.5 to 8.5 h) did not significantly affect the process, and the stable performance at 8.5 h leaves room for further decreases in HRT. The results show that this type of wastewater is suitable for a full-scale implementation, but the difference in methane potential between SW and HW is important to consider both regarding process dimensioning and biogas yield optimization.

  18. Near-infrared spectra and rovibrational dynamics on a four-dimensional ab initio potential energy surface of (HBr)2.

    Science.gov (United States)

    Castillo-Chará, J; McIntosh, A L; Wang, Z; Lucchese, R R; Bevan, J W

    2004-06-08

    Supersonic jet investigations of the (HBr)(2) dimer have been carried out using a tunable diode laser spectrometer to provide accurate data for comparison with results from a four-dimensional (4-D) ab initio potential energy surface (PES). The near-infrared nu(1) (+/-), nu(2) (+/-), and (nu(1)+nu(4))(-) bands of (H (79)Br)(2), (H (79)Br-H (81)Br), and (H (81)Br)(2) isotopomers have been recorded in the range 2500-2600 cm(-1) using a CW slit jet expansion with an upgraded near-infrared diode laser spectrometer. The 4-D PES has been calculated for (HBr)(2) using second-order Møller-Plesset perturbation theory with an augmented and polarized 6-311G basis set. The potential is characterized by a global minimum occurring at the H bond structure with the distance between the center of masses (CM) of the monomer being R(CM)=4.10 A with angles theta(A)=10 degrees, theta(B)=100 degrees and a well depth of 692.2 cm(-1), theta(A) is the angle the HBr bond of monomer A makes with the vector from the CM of A to the CM of B, and theta(B) is the corresponding angle monomer B makes with the same CM-CM vector. The barrier for the H interchange occurs at the closed C(2h) structure for which R(CM)=4.07 A, theta(A)=45 degrees, theta(B)=135 degrees, and the barrier height is 73.9 cm(-1). The PES was fitted using a linear-least squares method and the rovibrational energy levels of the complex were calculated by a split pseudospectral method. The spectroscopic data provide accurate molecular parameters for the dimer that are then compared with the results predicted on the basis of the 4-D ab initio PES. (c) 2004 American Institute of Physics.

  19. Studies of association of variants near the HHEX, CDKN2A/B, and IGF2BP2 genes with type 2 diabetes and impaired insulin release in 10,705 Danish subjects

    DEFF Research Database (Denmark)

    Grarup, Niels; Rose, Chrisian S; Andersson, Ehm A

    2007-01-01

    In the present study, we aimed to validate the type 2 diabetes susceptibility alleles identified in six recent genome-wide association studies in the HHEX/KIF11/IDE (rs1111875), CDKN2A/B (rs10811661), and IGF2BP2 (rs4402960) loci, as well as the intergenic rs9300039 variant. Furthermore, we aimed...

  20. Estimation of Acacia melanoxylon unbleached Kraft pulp brightness by NIR spectroscopy

    Directory of Open Access Journals (Sweden)

    António J. A. Santos

    2015-08-01

    Full Text Available Aim of the study: The ability of NIR spectroscopy for predicting the ISO brightness was studied on unbleached Kraft pulps of Acacia melanoxylon R. Br. Area of study: Sites covering littoral north, mid interior north and centre interior of Portugal. Materials and methods: The samples were Kraft pulped in standard identical conditions targeted to a kappa number of 15. A Near Infrared (NIR partial least squares regression (PLSR model was developed for the ISO brightness prediction using 75 pulp samples with a variation range of 18.9 to 47.9 %. Main results: Very good correlations between NIR spectra and ISO brightness were obtained. Ten methods were used for PLS analysis (cross validation with 48 samples, and a test set validation was made with 27 samples. The 1stDer pre-processed spectra coupling two wavenumber ranges from 9404 to 7498 cm-1 and 4605 to 4243 cm-1 allowed the best model with a root mean square error of ISO brightness prediction of 0.5 % (RMSEP, a r2 of 99.5 % with a RPD of 14.7. Research highlights: According to AACC Method 39-00, the present model is sufficiently accurate to be used for process control (RPD ≥ 8

  1. Fate of Residual Lignin during Delignification of Kraft Pulp by Trametes versicolor

    Science.gov (United States)

    Reid, Ian D.

    1998-01-01

    The fungus Trametes versicolor can delignify and brighten kraft pulps. To better understand the mechanism of this biological bleaching and the by-products formed, I traced the transformation of pulp lignin during treatment with the fungus. Hardwood and softwood kraft pulps containing 14C-labelled residual lignin were prepared by laboratory pulping of lignin-labelled aspen and spruce wood and then incubated with T. versicolor. After initially polymerizing the lignin, the fungus depolymerized it to alkali-extractable forms and then to soluble forms. Most of the labelled carbon accumulated in the water-soluble pool. The extractable and soluble products were oligomeric; single-ring aromatic products were not detected. The mineralization of the lignin carbon to CO2 varied between experiments, up to 22% in the most vigorous cultures. The activities of the known enzymes laccase and manganese peroxidase did not account for all of the lignin degradation that took place in the T. versicolor cultures. This fungus may produce additional enzymes that could be useful in enzyme bleaching systems. PMID:9603823

  2. Membrane treatment of alkaline bleaching effluents from elementary chlorine free kraft softwood cellulose production.

    Science.gov (United States)

    Oñate, Elizabeth; Rodríguez, Edgard; Bórquez, Rodrigo; Zaror, Claudio

    2015-01-01

    This paper reports experimental results on the sequential use of ultrafiltration (UF), nanofiltration (NF) and reverse osmosis (RO) to fractionate alkaline extraction bleaching effluents from kraft cellulose production. The aim was to unveil the way key pollutants are distributed when subjected to sequential UF/NF/RO membrane separation processes. Alkaline bleaching effluents were obtained from a local pinewood-based mill, featuring elementary chlorine free bleaching to produce high-brightness cellulose. The experimental system was based on a laboratory-scale membrane system, DSS LabStak® M20 Alfa Laval, using Alfa Laval UF and NF/RO membranes, operated at a constant transmembrane pressure (6 bar for UF membranes and 32 bar for NF/RO membranes), at 25°C. Results show that 78% chemical oxygen demand (COD) and total phenols, 82% adsorbable organic halogens (AOX) and 98% colour were retained by UF membranes which have molecular weight cut-off (MWCO) above 10 kDa. In all, 16% of original COD, total phenols and AOX, and the remaining 2% colour were retained by UF membranes within the 1 to 10 kDa MWCO range. Chloride ions were significantly present in all UF permeates, and RO was required to obtain a high-quality permeate with a view to water reuse. It is concluded that UF/NF/RO membranes offer a feasible option for water and chemicals recovery from alkaline bleaching effluents in kraft pulp production.

  3. ab-Plane Anisotropy of Transport Properties in Unidirectionally Twinned YBa2Cu3O7-δ Films

    International Nuclear Information System (INIS)

    Villard, C.; Chateignier, D.; Thrane, B.; Koren, G.; Cohen, D.; Polturak, E.

    1996-01-01

    A unidirectionally twinned, c oriented YBa 2 Cu 3 O 7-δ film was prepared on a (001) NdGaO 3 substrate. In the normal state between 100 and 300K, the unidirectional twin plane lattice induces a strong anisotropy of ρ ab , leading to a temperature independent ratio of 6 between the resisitivities across and along the twin boundaries. At 77K, the self-field critical current parallel to twin planes is 1.2x10 6 A/cm 2 , a value which is 25 times higher than along the perpendicular direction. This shows that, at this temperature, twin boundaries control the critical current values in YBCO films by either channeling or pinning effects. copyright 1996 The American Physical Society

  4. A sp2+sp3 hybridized carbon allotrope transformed from AB stacking graphyne and THD-graphene

    Science.gov (United States)

    Zhang, Yu; Shang, Jiacheng; Fu, Weida; Zeng, Li; Tang, Tao; Cai, Yingxiang

    2018-01-01

    New carbon allotropes can be designed by combining sp, sp2 and sp3 three hybridization states. And the hybridization states or coordination numbers of carbon atoms can be changed by applying high pressure on carbon materials. In this study, a common high pressure phase (named as TBBC) transformed from AB-stacking graphyne or THD-graphene is predicted. Its kinetic stability is examined using finite displacement method. We find that the sp2 and sp3 hybridized carbon atoms behave different vibration features at high frequency region. Both graphene-like and diamond-like vibration peaks occurs. Phase transition energy barriers from both graphyne and THD-graphene to TBBC are estimated. Electronic structure calculations show that the TBBC is an indirect semiconductor with a bandgap of 0.66 eV. The ideal tensile strength of TBBC is high in [0001] and [1 1 ¯ 00 ] directions, but is weak along [1 2 ¯ 10 ] direction.

  5. Population Pharmacokinetics of an Indian F(ab'2 Snake Antivenom in Patients with Russell's Viper (Daboia russelii Bites.

    Directory of Open Access Journals (Sweden)

    Geoffrey K Isbister

    Full Text Available There is limited information on antivenom pharmacokinetics. This study aimed to investigate the pharmacokinetics of an Indian snake antivenom in humans with Russell's viper bites.Patient data and serial blood samples were collected from patients with Russell's viper (Daboia russelii envenoming in Sri Lanka. All patients received Indian F(ab'2 snake antivenom manufactured by VINS Bioproducts Ltd. Antivenom concentrations were measured with sandwich enzyme immunoassays. Timed antivenom concentrations were analysed using MONOLIXvs4.2. One, two and three compartment models with zero order input and first order elimination kinetics were assessed. Models were parameterized with clearance (CL, intercompartmental clearance (Q, central compartment volume (V and peripheral compartment volume (VP. Between-subject-variability (BSV on relative bioavailability (F was included to account for dose variations. Covariates effects (age, sex, weight, antivenom batch, pre-antivenom concentrations were explored by visual inspection and in model building. There were 75 patients, median age 57 years (40-70 y and 64 (85% were male. 411 antivenom concentration data points were analysed. A two compartment model with zero order input, linear elimination kinetics and a combined error model best described the data. Inclusion of BSV on F and weight as a covariate on V improved the model. Inclusion of pre-antivenom concentrations or different batches on BSV of F did not. Final model parameter estimates were CL,0.078 L h(-1, V,2.2L, Q,0.178 L h(-1 and VP,8.33L. The median half-life of distribution was 4.6 h (10-90%iles:2.6-7.1 h and half-life of elimination, 140 h (10th-90th percentilesx:95-223h.Indian F(ab'2 snake antivenom displayed biexponential disposition pharmacokinetics, with a rapid distribution half-life and more prolonged elimination half-life.

  6. Structural and thermodynamic study of dicesium molybdate Cs2Mo2O7: Implications for fast neutron reactors

    Science.gov (United States)

    Smith, A. L.; Kauric, G.; van Eijck, L.; Goubitz, K.; Wallez, G.; Griveau, J.-C.; Colineau, E.; Clavier, N.; Konings, R. J. M.

    2017-09-01

    The structure of α-Cs2Mo2O7 (monoclinic in space group P21 / c), which can form during irradiation in fast breeder reactors in the space between nuclear fuel and cladding, has been refined in this work at room temperature from neutron diffraction data. Furthermore, the compounds' thermal expansion and polymorphism have been investigated using high temperature X-ray diffraction combined with high temperature Raman spectroscopy. A phase transition has been observed at Ttr(α → β)=(621.9±0.8) K using Differential Scanning Calorimetry, and the structure of the β-Cs2Mo2O7 phase, orthorhombic in space group Pbcm, has been solved ab initio from the high temperature X-ray diffraction data. Furthermore, the low temperature heat capacity of α-Cs2Mo2O7 has been measured in the temperature range T=(1.9-313.2) K using a Quantum Design PPMS (Physical Property Measurement System) calorimeter. The heat capacity and entropy values at T=298.15 K have been derived as Cp,mo (Cs2Mo2O7 , cr , 298.15 K) = (211.9 ± 2.1) J K-1mol-1 and Smo (Cs2Mo2O7 , cr , 298.15 K) = (317.4 ± 4.3) J K-1mol-1 . When combined with the enthalpy of formation reported in the literature, these data yield standard entropy and Gibbs energy of formation as Δf Smo (Cs2Mo2O7 , cr , 298.15 K) = - (628.2 ± 4.4) J K-1mol-1 and Δf Gmo (Cs2Mo2O7 , cr , 298.15 K) = - (2115.1 ± 2.5) kJmol-1 . Finally, the cesium partial pressure expected in the gap between fuel and cladding following the disproportionation reaction 2Cs2MoO4=Cs2Mo2O7+2Cs(g)+ 1/2 O2(g) has been calculated from the newly determined thermodynamic functions.

  7. Ab initio Computations of the Electronic, Mechanical, and Thermal Properties of Ultra High Temperature Ceramics (UHTC) ZrB2 and HfB2

    Science.gov (United States)

    Lawson, John W.; Bauschlicher, Charles W.; Daw, Murray

    2011-01-01

    Refractory materials such as metallic borides, often considered as ultra high temperature ceramics (UHTC), are characterized by high melting point, high hardness, and good chemical inertness. These materials have many applications which require high temperature materials that can operate with no or limited oxidation. Ab initio, first principles methods are the most accurate modeling approaches available and represent a parameter free description of the material based on the quantum mechanical equations. Using these methods, many of the intrinsic properties of these material can be obtained. We performed ab initio calculations based on density functional theory for the UHTC materials ZrB2 and HfB2. Computational results are presented for structural information (lattice constants, bond lengths, etc), electronic structure (bonding motifs, densities of states, band structure, etc), thermal quantities (phonon spectra, phonon densities of states, specific heat), as well as information about point defects such as vacancy and antisite formation energies.

  8. Neutronic modeling of pebble bed reactors in APOLLO2

    International Nuclear Information System (INIS)

    Grimod, M.

    2010-01-01

    In this thesis we develop a new iterative homogenization technique for pebble bed reactors, based on a 'macro-stochastic' transport approximation in the collision probability method. A model has been developed to deal with the stochastic distribution of pebbles with different burnup in the core, considering spectral differences in homogenization and depletion calculations. This is generally not done in the codes presently used for pebble bed analyses, where a pebble with average isotopic composition is considered to perform the cell calculation. Also an iterative core calculation scheme has been set up, where the low-order RZ S N full-core calculation computes the entering currents in the spectrum zones subdividing the core. These currents, together with the core k eff , are then used as surface source in the fine-group heterogeneous calculation of the multi-pebble geometries. The developed method has been verified using reference Monte Carlo simulations of a simplified PBMR- 400 model. The pebbles in this model are individually positioned and have different randomly assigned burnup values. The APOLLO2 developed method matches the reference core k eff within ± 100 pcm, with relative differences on the production shape factors within ± 4%, and maximum discrepancy of 3% at the hotspot. Moreover, the first criticality experiment of the HTR-10 reactor was used to perform a first validation of the developed model. The computed critical number of pebbles to be loaded in the core is very close to the experimental value of 16890, only 77 pebbles less. A method to calculate the equilibrium reactor state was also developed and applied to analyze the simplified PBMR-400 model loaded with different fuel types (UO 2 , Pu, Pu + MA). The potential of the APOLLO2 method to compute different fluxes for the different pebble types of a multi-pebble geometry was used to evaluate the bias committed by the average composition pebble approximation. Thanks to a 'compensation of error

  9. Spent fuel strategy for the BR2 reactor

    International Nuclear Information System (INIS)

    Gubel, P.; Collard, G.

    1998-01-01

    The Belgian MTR reactor is fuelled with HEU UAl x elements and the fuel cycle was normally closed by reprocessing consecutively in Belgium (Eurochemic), France (Marcoule) and finally in the U.S.A. (Idaho Falls and Savannah River). When the acceptance of spent fuel by the U.S. was terminated, the facility was left with a huge backlog of used elements stored under water. After a few years, urgent and mandatory actions were required to maintain the BR2 facility operating. Later the accent was put on the evaluation of an optimum long term solution for the BR2 spent fuel during the projected 15 years life extension after the refurbishment executed between 1995 and 1997. The paper gives an overview of these successive actions taken during the last years as well as the handled various criteria for comparing and evaluating the available long-term alternatives. After commitment to reprocessing in existing facilities operated for aluminum fuels the focus of the BR2 fuel cycle strategy is now moving to the procurement of the necessary HEU fuel for securing the long-term operation of the facility. (author)

  10. Neutron flux determinations in the reactors G2 and G3 during operation

    International Nuclear Information System (INIS)

    Boulinier, C.; Faurot, P.; Sagot, M.; Teste du Bailler, A.

    1961-01-01

    After demonstrating the sensitivity of the distribution of power in a production reactor to a deformation caused by dissymmetries of reactivity in the reactor, the authors describe the method of neutron flux determination devised for the reactors G2 and G3 under working conditions; the detector used is a tungsten or nickel wire, the γ activity of which is measured with an ionisation chamber. Several flux determinations are given as examples to illustrate the sensitivity of the method. (author) [fr

  11. Development and testing of the EDF-2 reactor fuel element

    International Nuclear Information System (INIS)

    Delpeyroux, P.

    1964-01-01

    This technical report reviews the work which has been necessary for defining the EDF-2 fuel element. After giving briefly the EDF-2 reactor characteristics and the preliminary choice of parameters which made it possible to draw up a draft plan for the fuel element, the authors consider the research proper: - Uranium studies: tests on the passage into the β phase of an internal crown of a tube, bending of the tube under the effect of a localized force, welding of the end-pellets and testing for leaks. The resistance of the tube to crushing and of the pellets to yielding under the external pressure have been studied in detail in another CEA report. - Can studies: conditions of production and leak proof testing of the can, resistance of the fins to creep due to the effect of the gas flow. - Studies of the extremities of the element: creep under compression and welding of the plugs to the can. - Cartridge studies: determination of the characteristics of the can fuel fixing grooves and of the canning conditions, verification of the resistance of the fuel element to thermal cycling, determination of the temperature drop at the can-fuel interface dealt with in more detail in another CEA report. - Studies of the whole assembly: this work which concerns the graphite jacket, the support and the cartridge vibrations has been carried out by the Mechanical and Thermal Study Service (Mechanics Section). In this field the Fuel Element Study Section has investigated the behaviour of the centering devices in a gas current. The outcome of this research is the defining of the plan of the element the production process and the production specifications. The validity of ail these out-of-pile tests will be confirmed by the in-pile tests already under way and by irradiation of the elements in the EDF-2 reactor itself. In conclusion the programme is given for improving the fuel element and for defining the fuel element for the second charge. (authors) [fr

  12. Microsolvation of the acetate anion [CH3CO2-(H2O)n, n=1-3]: A photoelectron spectroscopy and ab initio computational study

    Czech Academy of Sciences Publication Activity Database

    Wang, X. B.; Jagoda-Cwiklik, B.; Chia, Ch.; Xing, X. P.; Zhou, M.; Jungwirth, Pavel; Wang, L. S.

    2009-01-01

    Roč. 477, 1/3 (2009), s. 41-44 ISSN 0009-2614 R&D Projects: GA MŠk LC512; GA ČR GA203/08/0114 Grant - others:NNSF(CN) 20528303 Institutional research plan: CEZ:AV0Z40550506 Keywords : acetate anion * photoelectron spectroscopy * ab initio calculations Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.291, year: 2009

  13. The effects of a single intravenous injection of novel activin A/BMP-2 (AB204) on toxicity and the respiratory and central nervous systems.

    Science.gov (United States)

    Yoon, Byung-Hak; Lee, Jae Hyup; Na, Kyuheum; Ahn, Chihoon; Cho, Jongho; Ahn, Hyun Chan; Choi, Jungyoun; Oh, Hyosun; Kim, Byong Moon; Choe, Senyon

    2016-01-01

    The purpose of this study was to determine the effects of a single intravenous injection of a novel osteoinductive material, activin A/BMP-2 (AB204), to rodents on toxicity and their respiratory functions and central nervous system (CNS). A single intravenous injection of AB204 was given to Sprague-Dawley (SD) rats in doses of 0, 0.625, 2.5 and 10 mg/kg to observe the mortality rate, the general symptoms for 14 days. The experimental groups were also given 0.2, 0.4 and 0.8 mg/kg of AB204, respectively, and the respiration rate, the tidal volume and the minute volume were measured for 240 min. The experimental groups of imprinting control region (ICR) mice were given a single intravenous injection of 0.2, 0.4 and 0.8 mg/kg of AB204, respectively. Their body temperature was taken and general behaviors were observed to evaluate the effect of AB204 on the CNS for 240 min. The study on toxicity of a single intravenous injection found no death or abnormal symptoms, abnormal findings from autopsy, or abnormal body weight gain or loss in all the experimental groups. No abnormal variation associated with the test substance was observed in the respiration rate, the tidal volume, the minute volume, body temperature or the general behaviors. On the basis of these results, the approximate lethal dose of AB204 for a single intravenous injection exceeds 10 mg/kg for SD rats and a single intravenous injection of ≤0.8 mg/kg AB204 has no effect on their respiratory system for SD rat and no effect on their CNS for ICR mice.

  14. A sp2+sp3 hybridized carbon allotrope transformed from AB stacking graphyne and THD-graphene

    Directory of Open Access Journals (Sweden)

    Yu Zhang

    2018-01-01

    Full Text Available New carbon allotropes can be designed by combining sp, sp2 and sp3 three hybridization states. And the hybridization states or coordination numbers of carbon atoms can be changed by applying high pressure on carbon materials. In this study, a common high pressure phase (named as TBBC transformed from AB-stacking graphyne or THD-graphene is predicted. Its kinetic stability is examined using finite displacement method. We find that the sp2 and sp3 hybridized carbon atoms behave different vibration features at high frequency region. Both graphene-like and diamond-like vibration peaks occurs. Phase transition energy barriers from both graphyne and THD-graphene to TBBC are estimated. Electronic structure calculations show that the TBBC is an indirect semiconductor with a bandgap of 0.66 eV. The ideal tensile strength of TBBC is high in [0001] and [11¯00] directions, but is weak along [12¯10] direction.

  15. Phonon spectra of elpasolites Cs2NaRF6 (R=Y,Yb): Ab initio calculations

    Science.gov (United States)

    Chernyshev, Vladimir; Petrov, Vladislav; Nikiforov, Anatoliy; Zakiryanov, Dmitriy

    2015-12-01

    The influence of hydrostatic pressure on structure and dynamics of a crystal lattice of elpasolites Cs2NaYbF6 and Cs2NaYF6 (S.G. 225) within ab initio approach is investigated. Frequencies and irreducible representations (irreps) of phonon modes are determined. Elastic constants are calculated. The calculations are carried out within MO LCAO approach using DFT method with hybrid functionalities of B3LYP and PBE0 in CRYSTAL09 periodic code. For the description of rare earth ion the pseudopotential replacing internal orbitals including 4f orbitals was used. External 5s and 5p orbitals defining chemical bond were described by valence basis sets.

  16. Phonon spectra of elpasolites Cs{sub 2}NaRF{sub 6} (R=Y,Yb): Ab initio calculations

    Energy Technology Data Exchange (ETDEWEB)

    Chernyshev, Vladimir, E-mail: Vladimir.Chernyshev@urfu.ru; Petrov, Vladislav; Nikiforov, Anatoliy; Zakiryanov, Dmitriy [Ural Federal University, Ekaterinburg (Russian Federation)

    2015-12-07

    The influence of hydrostatic pressure on structure and dynamics of a crystal lattice of elpasolites Cs{sub 2}NaYbF{sub 6} and Cs{sub 2}NaYF{sub 6} (S.G. 225) within ab initio approach is investigated. Frequencies and irreducible representations (irreps) of phonon modes are determined. Elastic constants are calculated. The calculations are carried out within MO LCAO approach using DFT method with hybrid functionalities of B3LYP and PBE0 in CRYSTAL09 periodic code. For the description of rare earth ion the pseudopotential replacing internal orbitals including 4f orbitals was used. External 5s and 5p orbitals defining chemical bond were described by valence basis sets.

  17. Homogeneous fast reactor benchmark testing of CENDL-2 and ENDF/B-6

    International Nuclear Information System (INIS)

    Liu Guisheng

    1995-11-01

    How to choose correct weighting spectrum has been studied to produce multigroup constants for fast reactor benchmark calculations. A correct weighting option makes us obtain satisfying results of K eff and central reaction rate ratios for nine fast reactor benchmark testing of CENDL-2 and ENDF/B-6. (author). 8 refs, 2 figs, 4 tabs

  18. Homogeneous fast reactor benchmark testing of CENDL-2 and ENDF/B-6

    International Nuclear Information System (INIS)

    Liu Guisheng

    1995-01-01

    How to choose correct weighting spectrum has been studied to produce multigroup constants for fast reactor benchmark calculations. A correct weighting option makes us obtain satisfying results of K eff and central reaction rate ratios for nine fast reactor benchmark testings of CENDL-2 and ENDF/B-6. (4 tabs., 2 figs.)

  19. Human/murine chimeric 81C6 F(ab')2 fragment: preclinical evaluation of a potential construct for the targeted radiotherapy of malignant glioma

    International Nuclear Information System (INIS)

    Boskovitz, Abraham; Akabani, Gamal H.; Pegram, Charles N.; Bigner, Darrell D.; Zalutsky, Michael R.

    2004-01-01

    We have obtained encouraging responses in recent Phase I studies evaluating 131 I-labeled human/murine chimeric 81C6 anti-tenascin monoclonal antibody (ch81C6) administered into surgically-created tumor resection cavities in brain tumor patients. However, because the blood clearance is slow, hematologic toxicity has been higher than seen with murine 81C6 (mu81C6). In the current study, a series of paired-label experiments were performed in athymic mice bearing subcutaneous D-245 MG human glioma xenografts to compare the biodistribution of the fragment ch81C6 F(ab') 2 labeled using Iodogen to a) intact ch81C6, b) mu81C6, and c) ch81C6 F(ab') 2 labeled using N-succinimidyl 3-[ 131 I]iodobenzoate. Tumor retention of radioiodine activity for the F(ab') 2 fragment was comparable to that for intact ch81C6 for the first 24 h and to that for mu81C6 for the first 48 h; as expected, blood and other normal tissue levels declined faster for ch81C6 F(ab') 2. Radiation dosimetry calculations suggest that 131 I-labeled ch81C6 F(ab') 2 may warrant further evaluation as a targeted radiotherapeutic for the treatment of brain tumors

  20. Human/murine chimeric 81C6 F(ab'){sub 2} fragment: preclinical evaluation of a potential construct for the targeted radiotherapy of malignant glioma

    Energy Technology Data Exchange (ETDEWEB)

    Boskovitz, Abraham; Akabani, Gamal H.; Pegram, Charles N.; Bigner, Darrell D.; Zalutsky, Michael R. E-mail: zalut001@mc.duke.edu

    2004-04-01

    We have obtained encouraging responses in recent Phase I studies evaluating {sup 131}I-labeled human/murine chimeric 81C6 anti-tenascin monoclonal antibody (ch81C6) administered into surgically-created tumor resection cavities in brain tumor patients. However, because the blood clearance is slow, hematologic toxicity has been higher than seen with murine 81C6 (mu81C6). In the current study, a series of paired-label experiments were performed in athymic mice bearing subcutaneous D-245 MG human glioma xenografts to compare the biodistribution of the fragment ch81C6 F(ab'){sub 2} labeled using Iodogen to a) intact ch81C6, b) mu81C6, and c) ch81C6 F(ab'){sub 2} labeled using N-succinimidyl 3-[{sup 131}I]iodobenzoate. Tumor retention of radioiodine activity for the F(ab'){sub 2} fragment was comparable to that for intact ch81C6 for the first 24 h and to that for mu81C6 for the first 48 h; as expected, blood and other normal tissue levels declined faster for ch81C6 F(ab'){sub 2.} Radiation dosimetry calculations suggest that {sup 131}I-labeled ch81C6 F(ab'){sub 2} may warrant further evaluation as a targeted radiotherapeutic for the treatment of brain tumors.

  1. The reactor accident in the Three Mile Island-2 reactor plant. (Harrisburg, USA)

    International Nuclear Information System (INIS)

    Anon.

    1979-01-01

    The presentation of the accident development is based on the bulletin of the Atomic Industrial Forum (AIF) from the 6th of April, 1979. In addition, there are some short pieces of information, No. 14 and 15 of the association for reactor security as well as written and verbal information of the firms Brown, Boveri and Co/Babcock-Brown Boveri Reaktor GmbH (BBC/BBR). (orig.) [de

  2. Ab initio study of the interplay between superconductivity and magnetic fields in MgB{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Aperis, Alexandros; Maldonado, Pablo; Oppeneer, Peter M. [Uppsala University, Uppsala (Sweden)

    2015-07-01

    Among the bulk superconductors broadly accepted to be mediated by phonons, MgB{sub 2} exhibits a record high critical temperature of T{sub c}=39 K. The relatively simple crystal structure of this material makes it an ideal platform to investigate fundamental phenomena, such as the interplay between superconductivity and the Zeeman effect, at the ab initio level. Here we combine DFT calculations providing electronic band and phonon dispersions with numerical solutions of the fully anisotropic Eliashberg equations, to provide a complete picture of the modification of the two-band superconductivity in this compound at finite external magnetic fields and temperature. We predict interesting signatures in the H - T phase diagram which could be experimentally probed.

  3. Ab initio thermal rate calculations of HO + HO = O(3P) + H2O reaction and isotopologues.

    Science.gov (United States)

    Nguyen, Thanh Lam; Stanton, John F

    2013-04-04

    The forward and reverse reactions, HO + HO ⇌ O((3)P) + H2O, which play roles in both combustion and laboratory studies, were theoretically characterized with a master equation approach to compute thermal reaction rate constants at both the low and high pressure limits. Our ab initio k(T) results for the title reaction and two isotopic variants agree very well with experiments (within 15%) over a wide temperature range. The calculated reaction rate shows a distinctly non-Arrhenius behavior and a strong curvature consistent with the experiment. This characteristic behavior is due to effects of positive barrier height and quantum mechanical tunneling. Tunneling is very important and contributes more than 70% of total reaction rate at room temperature. A prereactive complex is also important in the overall reaction scheme.

  4. Computational tridimensional protein modeling of Cry1Ab19 toxin from Bacillus thuringiensis BtX-2.

    Science.gov (United States)

    Kashyap, Sudhanshu; Singh, B D; Amla, D V

    2012-06-01

    We report the computational structural simulation of the Cry1Ab19 toxin molecule from B. thuringiensis BtX-2 based on the structure of Cry1Aa1 deduced by x-ray diffraction. Validation results showed that 93.5% of modeled residues are folded in a favorable orientation with a total energy Z-score of -8.32, and the constructed model has an RMSD of only 1.13. The major differences in the presented model are longer loop lengths and shortened sheet components. The overall result supports the hierarchical three-domain structural hypothesis of Cry toxins and will help in better understanding the structural variation within the Cry toxin family along with facilitating the design of domain-swapping experiments aimed at improving the toxicity of native toxins.

  5. Radioimmunodetection (RID) with OC-125 antibody F(ab)2 fragments in the follow-up of ovarian carcinoma

    International Nuclear Information System (INIS)

    Bockisch, A.; Broeckelmann, J.; Briele, B.; Vogel, J.; Oehr, P.; Osterthun, B.; Rheinsberg, J.; Hotze, A.; Biersack, H.J.; Krebs, D.

    1990-01-01

    Radioimmunodetection (RID) using 131 I-labelled OC-125 antibody F(ab') 2 fragments proved to be sensitive and specific for detecting ovarian carcinoma metastases and recurrences. 40 investigations in patients suffering from advanced ovarian carcinoma or carcinoma of unknown origin but with elevated CA-125 serum levels were investigated. The sensitivity, specificity, and accuracy were found to be 84%, 73%, and 80%, respectively. Analysing the 37 investigations in patients with ovarian carcinomas separately, the numbers were 91%, 71%, and 84%. This imaging modality may therefore be used as an alternative to exploratory surgery. No side-effects were observed clinically. After RID the serum levels of CA-125 were unexpected high in some patients when the measurement was performed in a routine procedure using the same anti-CA-125 antibody in the in vitro test as was used for imaging. (author)

  6. Precipitation and valorisation of lignin obtained from South African Kraft mill black liquor

    CSIR Research Space (South Africa)

    Namane, Mpho

    2016-04-01

    Full Text Available . In this thesis, the isolation and recovery of lignin from kraft mill black liquor was examined, an in-depth characterisation of the polymer was undertaken, and finally, a method for the potential valorisation of the lignin from a South African kraft mill...

  7. Ageing/obsolescence management at the ZED-2 Research Reactor

    International Nuclear Information System (INIS)

    Mon, D.; Trudeau, C.

    2014-01-01

    The Zero Energy Deuterium (ZED-2) Research Reactor first achieved criticality in 1960 September. Ageing of Systems, Structures and Components (SSCs) as well as the obsolescence of many original components had led to the Facility being in a reactive mode with respect to maintenance rather than a preventative maintenance mode. Through the implementation of an Ageing Management Plan to access the effects of Ageing Related Degradation Mechanisms (ARDMs) on SSCs and a Critical Spare Parts Obsolescence Plan (establishing new specifications for components, procurement of new components and building a replacement inventory) the Facility is returning to a preventative maintenance state rather than a reactive maintenance state. Upgrades and refurbishment of the original equipment and components is underway within the Facility. This paper describes the programs being carried out in the Facility and focuses on the upgraded nuclear electronics, renewed moderator level control system and spare parts inventory system. Implementation of the above mentioned programs will enable the Facility to continue to fulfill its mandate as an integral part of AECL's Vision and Strategic Outcome: 'To be a global partner in nuclear innovation' and that 'Canadians and the world receive energy, health, environmental and economic benefits from nuclear science and technology with confidence that nuclear safety and security are assured', respectively. (author)

  8. Human kinetic distribution of I-123 F(Ab')/sub 2/ and FAb compared to the parent I-123 intact antibody

    International Nuclear Information System (INIS)

    De Nardo, S.J.; De Nardo, G.L.; O'Grady, L.F.; Peng, J.S.; Macey, D.J.; Mills, S.L.; Caridiff, R.D.; Epstein, A.L.

    1985-01-01

    Studies of radiolabeled monoclonal antibodies are being performed by many investigators using a variety of molecular forms of the antibody. This study evaluates two I-123-labeled antibodies (Lym-1 IgG2a and B6.01 IgG1) and their I-123-labeled FAb and F(Ab')/sub 2/ for relative whole body distribution and kinetics, selected organ kinetics, and site of degradation. Evidence of immunocomplex formation, circulating antigen, and HAMA, were monitored by HPLC-TSK analysis and appropriate radioassays of the plasma. Each antibody and each I-123-labeled fragment has been evaluated in 5 patients. One patient had serial comparisons of the radiolabeled parent molecule, F(Ab')/sub 2/ (100μg and 5 mg) and FAb (100μg) of Lym-1. Blood clearance, urine excretion rate, and plasma and urine HPLC fractionation of the radioactive species were determined. Whole body clearance by total body scans and organ clearance were obtained by geometric mean of anterior and posterior areas of interest. The FAb and F(Ab')/sub 2/ fragments had similar blood pool recovery 5 minutes after the 5-minute injection. These were the same as blood levels when 5mg of intact I-123-labeled antibody was given. The second phase of the blood curves for F(Ab')/sub 2/ had a T1/2 of 35-40 hours and for FAb was 15-20 hours. Urine excretion varied, but agreed with total body loss from body scan information. The patient with serial studies had a 24-hour residual dose of 82% for FAb, 62% for 10μg for F(Ab')/sub 2/ and 61% for 5mg of F(Ab')/sub 2/. Renal uptake for all patients was higher and more persistent with both fragments than intact antibody, but hepatic uptake was less

  9. Biodistribution of anti-CEA F(ab')2 fragments conjugated with chelating polymers: influence of conjugate electron charge on tumor uptake and blood clearance

    International Nuclear Information System (INIS)

    Slinkin, M.A.; Curtet, C.; Faivre-Chauvet, A.; Sai-Maurel, C.; Gestin, J.F.; Chatal, J.F.; Torchilin, V.P.

    1993-01-01

    F(ab') 2 fragments of anti-carcinoembryonic antigen (CEA) monoclonal antibody (mAb) were modified with three chain-terminal polysine-based chelating polymers so as to carry different electron charges. Immunoreactive conjugates labeled with 111 In up to a specific radioactivity of 120-140 μCi/μg were injected into nude mice bearing humans colorectal carcinoma, and the biodistribution patterns were compared with each other and with that of an anti-CEA F(ab') 2 -DTPA control. Immunoconjugate modified with positively-charged polymer produced the highest tumor uptake [up to 20% injected dose per gram (ID/g)], with very significant non-specific radioactivity in normal organs (particularly kidneys). When modified with a polymer carrying only a slight negative charge, the immunoconjugate also produced fairly high tumor uptake (up to 18% ID/g), with much lower non-specific radioactivity in normal organs. Highly negatively-charged conjugate produced the lowest tumor uptake (up to 8% ID/g), whereas blood and whole-body clearances were the fastest but slower than those of conventionally labeled F(ab') 2 mAb. The possible mechanisms for the effects described are discussed. (author)

  10. Biodistribution of anti-CEA F(ab')2 fragments conjugated with chelating polymers: influence of conjugate electron charge on tumor uptake and blood clearance.

    Science.gov (United States)

    Slinkin, M A; Curtet, C; Faivre-Chauvet, A; Sai-Maurel, C; Gestin, J F; Torchilin, V P; Chatal, J F

    1993-05-01

    F(ab')2 fragments of anti-carcinoembryonic antigen (CEA) monoclonal antibody (mAb) were modified with three chain-terminal polylysine-based chelating polymers so as to carry different electron charges. Immunoreactive conjugates labeled with 111In up to a specific radioactivity of 120-140 microCi/micrograms were injected into nude mice bearing human colorectal carcinoma, and the biodistribution patterns were compared with each other and with that of an anti-CEA F(ab')2-DTPA control. Immunoconjugate modified with positively-charged polymer produced the highest tumor uptake [up to 20% injected dose per gram (ID/g)], with very significant non-specific radioactivity in normal organs (particularly kidneys). When modified with a polymer carrying only a slight negative charge, the immunoconjugate also produced fairly high tumor uptake (up to 18% ID/g), with much lower non-specific radioactivity in normal organs. Highly negatively-charged conjugate produced the lowest tumor uptake (up to 8% ID/g), whereas blood and whole-body clearances were the fastest but slower than those of conventionally labeled F(ab')2 mAb. The possible mechanisms for the effects described are discussed.

  11. Immunity status of adults and children against poliomyelitis virus type 1 strains CHAT and Sabin (LSc-2ab) in Germany.

    Science.gov (United States)

    Eggers, Maren; Terletskaia-Ladwig, Elena; Rabenau, Holger F; Doerr, Hans W; Diedrich, Sabine; Enders, Gisela; Enders, Martin

    2010-12-09

    In October 2007, the working group CEN/TC 216 of the European Committee for standardisation suggested that the Sabin oral poliovirus vaccine type 1 strain (LSc-2ab) presently used for virucidal tests should be replaced by another attenuated vaccine poliovirus type 1 strain, CHAT. Both strains were historically used as oral vaccines, but the Sabin type 1 strain was acknowledged to be more attenuated. In Germany, vaccination against poliomyelitis was introduced in 1962 using the oral polio vaccine (OPV) containing Sabin strain LSc-2ab. The vaccination schedule was changed from OPV to an inactivated polio vaccine (IPV) containing wild polio virus type 1 strain Mahoney in 1998. In the present study, we assessed potential differences in neutralising antibody titres to Sabin and CHAT in persons with a history of either OPV, IPV, or OPV with IPV booster. Neutralisation poliovirus antibodies against CHAT and Sabin 1 were measured in sera of 41 adults vaccinated with OPV. Additionally, sera from 28 children less than 10 years of age and immunised with IPV only were analysed. The neutralisation assay against poliovirus was performed according to WHO guidelines. The neutralisation activity against CHAT in adults with OPV vaccination history was significantly lower than against Sabin poliovirus type 1 strains (Wilcoxon signed-rank test P strains equally. The lack of neutralising antibodies against the CHAT strain in persons vaccinated with OPV might be associated with an increased risk of reinfection with the CHAT polio virus type 1, and this implies a putative risk of transmission of the virus to polio-free communities. We strongly suggest that laboratory workers who were immunised with OPV receive a booster vaccination with IPV before handling CHAT in the laboratory.

  12. Ab initio calculations of the electron spectrum and density of states of TlFeS{sub 2} and TlFeSe{sub 2} crystals

    Energy Technology Data Exchange (ETDEWEB)

    Ismayilova, N. A., E-mail: ismayilova-narmin-84@mail.ru; Orudjev, H. S.; Jabarov, S. H. [Azerbaijan National Academy of Sciences, Institute of Physics (Azerbaijan)

    2017-04-15

    The results of ab initio calculations of the electron spectrum of TlFeS{sub 2} and TlFeSe{sub 2} crystals in the antiferromagnetic phase are reported. Calculations are carried out in the context of the density functional theory. The origin of the bands of s, p, and d electron states of Tl, Fe, S, and Se atoms is studied. It is established that, in the antiferromagnetic phase, the crystals possess semiconductor properties. The band gaps are found to be 0.05 and 0.34 eV for TlFeS{sub 2} and TlFeSe{sub 2} crystals, respectively.

  13. Research reactors - an overview

    International Nuclear Information System (INIS)

    West, C.D.

    1997-01-01

    A broad overview of different types of research and type reactors is provided in this paper. Reactor designs and operating conditions are briefly described for four reactors. The reactor types described include swimming pool reactors, the High Flux Isotope Reactor, the Mark I TRIGA reactor, and the Advanced Neutron Source reactor. Emphasis in the descriptions is placed on safety-related features of the reactors. 7 refs., 7 figs., 2 tabs

  14. Ab initio calculation of the transition-state properties and addition rate constants for H + C2H2 and selected isotopic analogues

    International Nuclear Information System (INIS)

    Harding, L.B.; Wagner, A.F.; Bowman, J.M.; Schatz, G.C.; Christoffel, K.

    1982-01-01

    GVB-POL-CI ab initio calculations of the geometries, energetics, and normal mode frequencies of C 2 H 2 , C 2 H 3 , and the transition state for the addition reaction of H + C 2 H 2 are presented. In addition, normal mode frequencies for the isotopic variants D + C 2 D 2 , D + C 2 H 2 , and H + C 2 D 2 are preented. These results are compared to experimental values for C 2 H 2 and to ab initio values of Hagase and Kern, and semiempirical values of Keil, Lynch, Cowfer, and Michael. The results are also used to calculate the apparent bimolecular addition rate constant using conventional RRKM theory for chemical activation. The calculated rate constants and their isotopic variants are compared as a function of temperature and pressure to available experimental information. The agreement is little different from that obtained by Keil et al. with a similar calculation using semiempirical values for acetylene, transition-state, and vinyl radical properties. In particular, the calculated high-pressure limit of the rate constant appears to be at least 1 order of magnitude higher than the experimental limit. Several possible reasons for this discrepancy are discussed

  15. Glomerular filtration rate after alpha-radioimmunotherapy with 211At-MX35-F(ab')2: a long-term study of renal function in nude mice

    DEFF Research Database (Denmark)

    Back, T.; Haraldsson, B.; Hultborn, R

    2009-01-01

    of the glomerular filtration rate (GFR). The renal toxicity was evaluated at levels close to the dose limit for the bone marrow and well within the range for therapeutic efficacy on tumors. Astatinated MX35-F(ab')(2) monoclonal antibodies were administered intravenously to nude mice. Both non-tumor-bearing animals...... manifested late. Examination of the kidney sections showed histologic changes that were overall subdued. Following alpha-RIT with (211)At-MX35-F(ab')(2) at levels close to the dose limit of severe myelotoxicity, the effects found on renal function were relatively small, with only minor to moderate reductions...... in GFR. These results suggest that a mean absorbed dose to the kidneys of approximately 10 Gy is acceptable, and that the kidneys would not be the primary dose-limiting organ in systemic alpha-RIT when using (211)At-MX35-F(ab')(2) Udgivelsesdato: 2009/12...

  16. Localization of tumors in vivo by scintigraphic identification of Clostridium butyricum using 131I-labelled antibodies and F(ab')2-antibody fragments

    International Nuclear Information System (INIS)

    Vogt, R.; Mehnert, W.H.; Schmidt, H.E.; Altenbrunn, H.J.; Akademie der Wissenschaften der DDR, Berlin-Buch. Zentralinstitut fuer Isotopen- und Strahlenforschung)

    1979-01-01

    Tumor-bearing mice injected with clostridial spores show enrichment and germination of the spores within the tumor. 131 I-labelled anti-Clostridium-antibodies and anti-Clostridium-F(ab') 2 -fragments were used for a possible localization of tumors in vivo by scintiscanning. The application of the antibody revealed increased radioactivity in the tumors of mice pretreated with spores as well as in animals without pretreatment. In using F(ab') 2 -fragments instead of total antibody neither the apparently unspecific increase of radioactivity in not pretreated mice nor the specific fixation of labelled F(ab') 2 -fragments to clostridial rods in the tumors of pretreated animals could be demonstrated. The results are discussed with respect to further investigation

  17. Recent advances in the utilization and the irradiation technology of the refurbished BR2 reactor

    International Nuclear Information System (INIS)

    Dekeyser, J.; Benoit, P.; Decloedt, C.; Pouleur, Y.; Verwimp, A.; Weber, M.; Vankeerberghen, M.; Ponsard, B.

    1999-01-01

    Operation and utilization of the materials testing reactor BR2 at the Belgian Nuclear Research Centre (SCK·CEN) has since its start in 1963 always followed closely the needs and developments of nuclear technology. In particular, a multitude of irradiation experiments have been carried out for most types of nuclear power reactors, existing or under design. Since the early 1990s and increased focus was directed towards more specific irradiation testing needs for light water reactor fuels and materials, although other areas of utilization continued as well (e.g. fusion reactor materials, safety research, ...), including also the growing activities of radioisotope production and silicon doping. An important milestone was the decision in 1994 to implement a comprehensive refurbishment programme for the BR2 reactor and plant installations. The scope of this programme comprised very substantial studies and hardware interventions, which have been completed in early 1997 within planning and budget. Directly connected to this strategic decision for reactor refurbishment was the reinforcement of our efforts to requalify and upgrade the existing irradiation facilities and to develop advanced devices in BR2 to support emerging programs in the following fields: - LWR pressure vessel steel, - LWR irradiation assisted stress corrosion cracking (IASCC), - reliability and safety of high-burnup LWR fuel, - fusion reactor materials and blanket components, - fast neutron reactor fuels and actinide burning, - extension and diversification of radioisotope production. The paper highlights these advances in the areas of BR2 utilisation and the ongoing development activities for the required new generation of irradiations devices. (author)

  18. System Design of a Supercritical CO2 cooled Micro Modular Reactor

    International Nuclear Information System (INIS)

    Kim, Seong Gu; Cho, Seongkuk; Yu, Hwanyeal; Kim, Yonghee; Jeong, Yong Hoon; Lee, Jeong Ik

    2014-01-01

    Small modular reactor (SMR) systems that have advantages of little initial capital cost and small restriction on construction site are being developed by many research organizations around the world. Existing SMR concepts have the same objective: to achieve compact size and a long life core. Most of small modular reactors have much smaller size than the large nuclear power plant. However, existing SMR concepts are not fully modularized. This paper suggests a complete modular reactor with an innovative concept for reactor cooling by using a supercritical carbon dioxide. The authors propose the supercritical CO 2 Brayton cycle (S-CO 2 cycle) as a power conversion system to achieve small volume of power conversion unit (PCU) and to contain the reactor core and PCU in one vessel. A conceptual design of the proposed small modular reactor was developed, which is named as KAIST Micro Modular Reactor (MMR). The supercritical CO 2 Brayton cycle for the S-CO 2 cooled reactor core was optimized and the size of turbomachinery and heat exchanger were estimated preliminary. The nuclear fuel composed with UN was proposed and the core lifetime was obtained from a burnup versus reactivity calculation. Furthermore, a system layout with fully passive safety systems for both normal operation and emergency operation was proposed. (author)

  19. Sublethal Effects of Chlorine-Free Kraft Mill Effluents on Daphnia magna.

    Science.gov (United States)

    Chamorro, Soledad; López, Daniela; Brito, Pablina; Jarpa, Mayra; Piña, Benjamin; Vidal, Gladys

    2016-12-01

    The implementation of elemental chlorine-free (ECF) bleaching methods has drastically reduced the aquatic toxicity of Kraft mill effluents during the last decade. However, the residual toxicity of Kraft mill effluents is still a potential concern for the environment, even when subjected to secondary wastewater treatment. The aim of this study is characterize potential sublethal effects of ECF Kraft mill effluents using Daphnia magna as model species. D. magna exposed towards increasing concentration of ECF Kraft mill effluent showed a significant, dose-dependent reduction in feeding. Conversely, post-feeding assay, life history, and allometric growth analyses showed stimulatory, rather than inhibitory effects in exposed animals at low concentrations, while high concentrations of ECF Kraft mill effluents reduced their reproductive output. These results suggest a hormetic effect in which moderate concentrations of the effluent had a stimulatory effect with higher concentrations causing inhibition in some variables.

  20. Ab initio potential energy surface and vibration-rotation energy levels of germanium dicarbide, GeC2.

    Science.gov (United States)

    Koput, Jacek

    2018-03-05

    The accurate ground-state potential energy surface of germanium dicarbide, GeC 2 , has been determined from ab initio calculations using the coupled-cluster approach. The core-electron correlation, higher-order valence-electron correlation, and scalar relativistic effects were taken into account. The potential energy surface of GeC 2 was shown to be extraordinarily flat near the T-shaped equilibrium configuration. The potential energy barrier to the linear CCGe configuration was predicted to be 1218 cm -1 . The vibration-rotation energy levels of some GeC 2 isotopologues were calculated using a variational method. The vibrational bending mode ν 3 was found to be highly anharmonic, with the fundamental wavenumber being only 58 cm -1 . Vibrational progressions due to this mode were predicted for the v1=1, v2=1, and v2=2 states of GeC 2 . © 2018 Wiley Periodicals, Inc. © 2018 Wiley Periodicals, Inc.

  1. The modular approach enables a fully ab initio simulation of the contacts between 3D and 2D materials.

    Science.gov (United States)

    Fediai, Artem; Ryndyk, Dmitry A; Cuniberti, Gianaurelio

    2016-10-05

    Up to now, the electrical properties of the contacts between 3D metals and 2D materials have never been computed at a fully ab initio level due to the huge number of atomic orbitals involved in a current path from an electrode to a pristine 2D material. As a result, there are still numerous open questions and controversial theories on the electrical properties of systems with 3D/2D interfaces-for example, the current path and the contact length scalability. Our work provides a first-principles solution to this long-standing problem with the use of the modular approach, a method which rigorously combines a Green function formalism with the density functional theory (DFT) for this particular contact type. The modular approach is a general approach valid for any 3D/2D contact. As an example, we apply it to the most investigated among 3D/2D contacts-metal/graphene contacts-and show its abilities and consistency by comparison with existing experimental data. As it is applicable to any 3D/2D interface, the modular approach allows the engineering of 3D/2D contacts with the pre-defined electrical properties.

  2. Hydrogen interstitials inside bulk reduced-CeO2: charge state, defect chemistry and dynamics by ab-initio calculations

    Science.gov (United States)

    Zhang, Lei; Liu, Meilin; Meilin Liu Team

    CeO2 is a well-known and widely-used solid oxide fuel cells (SOFC) electrolyte and catalyst anode support, due to its facile oxygen vacancy formation and diffusion within its symmetric and capacious fluorite lattice. In real SOFC working conditions, hydrogen fuels will dissociate on anode surface and possibly permeate inside CeO2-based anode support and electrolyte. Studying hydrogen defect inside CeO2 lattice thus has two significant impacts: To see how hydrogen alters the ``oxygen buffering'' inside CeO2 as an anode support, and to see how it affects oxygen vacancy's diffusion and clustering inside electrolyte CeO2. Hereby ab-initio calculations in Kohn-Sham Density Functional Theory with Hubbard model of self-interaction correction is carried out to investigate the electron polaron and vacancy formation in CeO2 affected by hydrogen, the hydrogen defect state within the band gap of CeO2, the chemistry of defect interactions and its effect on oxygen vacancy mobility. The authors acknowledge financial support from ARPA-E REBELS Program DE-AR0000502, and computation resources from National Energy Research Scientific Computing Center DE-AC02-05CH11231 and Extreme Science and Engineering Discovery Environment ACI-1053575.

  3. Molecular determinants for drug-receptor interactions. Part 2. An ab initio molecular orbital and dipole moment study of the novel nootropic agent piracetam (2-oxopyrrolidin-1-ylacetamide)

    Science.gov (United States)

    Lumbroso, H.; Liégeois, C.; Pappalardo, G. C.; Grassi, A.

    From the ab initio molecular energies of the possible conformers and from a classical dipole moment analysis of 2-oxopyrrolidin-l-ylacetamide (μ = 4.02 D in dioxan at 30.0°C), the preferred conformation in solution of this novel nootropic agent has been determined. The exocyclic N-CH 2 bond is rotated in one sense by 90° and the exocyclic CH 2-C bond rotated in the same sense by 120° from the "planar" ( OO)- cis conformation. The structures of the two enantiomers in solution differ from that of the crystalline molecule.

  4. Fuel Summary Report: Shippingport Light Water Breeder Reactor - Rev. 2

    Energy Technology Data Exchange (ETDEWEB)

    Olson, Gail Lynn; Mc Cardell, Richard Keith; Illum, Douglas Brent

    2002-09-01

    The Shippingport Light Water Breeder Reactor (LWBR) was developed by Bettis Atomic Power Laboratory to demonstrate the potential of a water-cooled, thorium oxide fuel cycle breeder reactor. The LWBR core operated from 1977-82 without major incident. The fuel and fuel components suffered minimal damage during operation, and the reactor testing was deemed successful. Extensive destructive and nondestructive postirradiation examinations confirmed that the fuel was in good condition with minimal amounts of cladding deformities and fuel pellet cracks. Fuel was placed in wet storage upon arrival at the Expended Core Facility, then dried and sent to the Idaho Nuclear Technology and Engineering Center for underground dry storage. It is likely that the fuel remains in good condition at its current underground dry storage location at the Idaho Nuclear Technology and Engineering Center. Reports show no indication of damage to the core associated with shipping, loading, or storage.

  5. Water chemistry of nuclear reactor systems 4: v. 2

    International Nuclear Information System (INIS)

    All the papers are about the chemical factors which determine the operational behaviour of nuclear power stations. The first five papers concern the coolant chemistry of pressurized water reactors from the operational experience at different power plants. The next five papers deal with boiling water reactor coolant chemistry from experience at different reactors. The control of corrosion products under normal conditions is the subject of two papers. Fission product chemistry under normal conditions is the subject of two papers. Fission product chemistry under normal and accident conditions, particularly iodine, is dealt with in four papers. Chemical decontamination of PWR primary and secondary circuits, corrosion resistance using additives and water quality in secondary circuits are covered in the remaining six papers. As well as the twenty two papers, each section is followed by the discussions which followed on the paper included here and others not in this volume. The discussions include additional data and references. (UK)

  6. Life cycle greenhouse gases and non-renewable energy benefits of kraft black liquor recovery

    International Nuclear Information System (INIS)

    Gaudreault, Caroline; Malmberg, Barry; Upton, Brad; Miner, Reid

    2012-01-01

    The life cycle greenhouse gas (GHG) and fossil fuel benefits of black liquor recovery are analyzed. These benefits are due to the production of energy that can be used in the pulping process or sold, and the recovery of the pulping chemicals that would otherwise need to be produced from other resources. The fossil GHG emissions and non-renewable energy consumption of using black liquor in the kraft recovery system are approximately 90% lower than those for a comparable fossil fuel-based system. Across all scenarios, the systems relying on black liquor solids achieve a median reduction of approximately 140 kg CO 2 eq./GJ of energy produced, compared to the systems relying on fossil fuels to provide the same energy and pulping chemical production functions. The benefits attributable to the recovery of pulping chemicals vary from 44% to 75% of the total benefit. Applied to the total production of kraft pulp in the U.S., the avoided emissions are equivalent to the total Scopes 1 and 2 emissions from the entire U.S. forest products industry. These results do not depend on the accounting method for biogenic carbon (because biogenic CO 2 emissions are the same for the systems compared) and the results are valid across a range of assumptions about the displaced fossil fuel, the GHG-intensity of the electricity grid, the fossil fuels used in the lime kiln, and the level of cogeneration at pulp and paper mills. The benefits occur without affecting the amount of wood harvested or the amount of chemical pulp produced. -- Highlights: ► Black liquor, a by-product of kraft pulping, represents about half of the energy used in the paper industry. ► The greenhouse gases (GHG) benefits of black liquor recovery compared to an equivalent fossil fuel system were analyzed. ► The GHG emissions of the black liquor system are approximately 90% lower than those for the fossil fuel system. ► The benefits from the recovery of the chemicals vary from 44% to 75% of the total benefit.

  7. The Ebola Virus Nucleoprotein Recruits the Host PP2A-B56 Phosphatase to Activate Transcriptional Support Activity of VP30

    DEFF Research Database (Denmark)

    Kruse, Thomas; Biedenkopf, Nadine; Hertz, Emil Peter Thrane

    2018-01-01

    Transcription of the Ebola virus genome depends on the viral transcription factor VP30 in its unphosphorylated form, but the underlying molecular mechanism of VP30 dephosphorylation is unknown. Here we show that the Ebola virus nucleoprotein (NP) recruits the host PP2A-B56 protein phosphatase......A-B56 and show that it suppresses Ebola virus transcription and infection. This work dissects the molecular mechanism of VP30 dephosphorylation by PP2A-B56, and it pinpoints this phosphatase as a potential target for therapeutic intervention....

  8. A Design Study on Experimental Power Reactor Core Fueled with UO2 CFP

    International Nuclear Information System (INIS)

    Aziz, Ferhat; Rivai, Abu Khalid

    2003-01-01

    A neutronic study on core design of a 300 MWt EPR was performed. In this study the use of 4.8% enriched UO 2 coated fuel particle was analyzed. The design was then compared to 5% enriched UO 2 pin fueled EPR based on existing PWRs. Both reactors are operated with single batch refueling system with a cycle length of 3 years. The core physics parameters analyzed were : effective multiplication factor in a cycle, flux distributions and cycle burnup. The results of calculation showed that the core effective multiplication factor for reactor with fuel compact can be maintained at 1.2841 at beginning of cycle (BOC) and 1.0060 at end of cycle (EOC). As for the UO 2 pin fueled reactor, the effective multiplication factor was 1.1927 at BOC and 1.0514 at EOC. The size of active core for the CFP fueled reactor were 320 cm in height and 320 cm in diameter. As for pin fueled reactor, the height was 200 cm and diameter was 180 cm. The results of calculations showed that neutron flux distribution was quite flat for both types of reactor designs, although the volume of CFP fueled reactor was 5 times as big as the pin fueled reactor

  9. Current status of restoration work for obstacle and upper core structure in reactor vessel of experimental fast reactor 'Joyo'. 2-2

    International Nuclear Information System (INIS)

    Okuda, Eiji; Ito, Hiromichi; Yoshihara, Shizuya

    2014-01-01

    An accident occurred in experimental fast reactor 'Joyo' in 2007 which is obstruction of fuel change equipment caused by contacting rotating plug and MARICO-2. In addition, we confirmed two happenings in the reactor vessel that (1) Deformation of MARICO-2 subassembly on the in vessel storage rack together with a transfer pot, (2) Deformation of the Upper core structure of 'Joyo' caused by contacting MARICO-2 subassembly and the UCS. We do the restoration work for restoring it. This time, we describe current status of Replacement work of the UCS. (author)

  10. TMI-2 [Three Mile Island Unit 2] reactor vessel head and plenum removal

    International Nuclear Information System (INIS)

    Hultman, C.W.; Jackson, R.W.

    1988-01-01

    As a result of the damage to the Three Mile Island Unit 2 (TMI-2) core during the accident in March 1979, removal of the reactor vessel head and plenum in the normal manner was judged to be impossible. In June 1982, a task force was formed to develop a plan for removing the TMI-2 reactor vessel head. The plan proposed removing the head using the standard head removal procedure in conjunction with the necessary precautions, changes, and preparations required for potential problems. This included the potential for both higher than normal radiation levels and airborne radioactive contamination. In addition, the plan specified that the plant be left either in a condition to proceed with plenum and fuel removal immediately after head removal or in a safe long-term lay-up condition. The basic plan consisting of the described major steps is discussed

  11. Reproduction of the PSBR reactor with Exterminator-2

    International Nuclear Information System (INIS)

    Aguilar H, F.

    1983-08-01

    To reproduce the reactor PSBR reported in (1), with the available version of the Exterminator-II in the ININ, they took the dimensions, composition specifications, effective sections of the different compositions (excepting those of the central thimble and of the moderator), the K eff and the factors of power (FP) for the different burners. Based on the comparison of the K eff and of the FP obtained with those reported the precision it is determined before in the reproduction of the reactor mentioned. (Author)

  12. Embedding Fragment ab Initio Model Potentials in CASSCF/CASPT2 Calculations of Doped Solids: Implementation and Applications.

    Science.gov (United States)

    Swerts, Ben; Chibotaru, Liviu F; Lindh, Roland; Seijo, Luis; Barandiaran, Zoila; Clima, Sergiu; Pierloot, Kristin; Hendrickx, Marc F A

    2008-04-01

    In this article, we present a fragment model potential approach for the description of the crystalline environment as an extension of the use of embedding ab initio model potentials (AIMPs). The biggest limitation of the embedding AIMP method is the spherical nature of its model potentials. This poses problems as soon as the method is applied to crystals containing strongly covalently bonded structures with highly nonspherical electron densities. The newly proposed method addresses this problem by keeping the full electron density as its model potential, thus allowing one to group sets of covalently bonded atoms into fragments. The implementation in the MOLCAS 7.0 quantum chemistry package of the new method, which we call the embedding fragment ab inito model potential method (embedding FAIMP), is reported here, together with results of CASSCF/CASPT2 calculations. The developed methodology is applied for two test problems: (i) the investigation of the lowest ligand field states (2)A1 and (2)B1 of the Cr(V) defect in the YVO4 crystal and (ii) the investigation of the lowest ligand field and ligand-metal charge transfer (LMCT) states at the Mn(II) substitutional impurity doped into CaCO3. Comparison with similar calculations involving AIMPs for all environmental atoms, including those from covalently bounded units, shows that the FAIMP treatment of the YVO4 units surrounding the CrO4(3-) cluster increases the excitation energy (2)B1 → (2)A1 by ca. 1000 cm(-1) at the CASSCF level of calculation. In the case of the Mn(CO3)6(10-) cluster, the FAIMP treatment of the CO3(2-) units of the environment give smaller corrections, of ca. 100 cm(-1), for the ligand-field excitation energies, which is explained by the larger ligands of this cluster. However, the correction for the energy of the lowest LMCT transition is found to be ca. 600 cm(-1) for the CASSCF and ca. 1300 cm(-1) for the CASPT2 calculation.

  13. Development of a Novel Catalytic Membrane Reactor for Heterogeneous Catalysis in Supercritical CO2

    Science.gov (United States)

    Islam, Nazrul M.; Chatterjee, Maya; Ikushima, Yutaka; Yokoyama, Toshiro; Kawanami, Hajime

    2010-01-01

    A novel type of high-pressure membrane reactor has been developed for hydrogenation in supercritical carbon dioxide (scCO2). The main objectives of the design of the reactor are the separate feeding of hydrogen and substrate in scCO2 for safe reactions in a continuous flow process, and to reduce the reaction time. By using this new reactor, hydrogenation of cinnamaldehyde into hydrocinnamaldehyde has been successfully carried out with 100% selectivity at 50 °C in 10 MPa (H2: 1 MPa, CO2: 9 MPa) with a flow rate of substrate ranging from 0.05 to 1.0 mL/min. PMID:20162008

  14. Free energies for degradation reactions of 1,2,3-trichloropropane from ab initio electronic structure theory.

    Science.gov (United States)

    Bylaska, Eric J; Glaesemann, Kurt R; Felmy, Andrew R; Vasiliu, Monica; Dixon, David A; Tratnyek, Paul G

    2010-11-25

    Electronic structure methods were used to calculate the gas and aqueous phase reaction energies for reductive dechlorination (i.e., hydrogenolysis), reductive β-elimination, dehydrochlorination, and nucleophilic substitution by OH− of 1,2,3-trichloropropane. The thermochemical properties ΔH(f)°(298.15 K), S°(298.15 K, 1 bar), and ΔG(S)(298.15 K, 1 bar) were calculated by using ab initio electronic structure calculations, isodesmic reactions schemes, gas-phase entropy estimates, and continuum solvation models for 1,2,3-trichloropropane and several likely degradation products: CH3−CHCl−CH2Cl, CH2Cl−CH2−CH2Cl, C•H2−CHCl−CH2Cl, CH2Cl−C•H−CH2Cl, CH2═CCl−CH2Cl, cis-CHCl═CH−CH2Cl, trans-CHCl═CH−CH2Cl, CH2═CH−CH2Cl, CH2Cl−CHCl−CH2OH, CH2Cl−CHOH−CH2Cl, CH2═CCl−CH2OH, CH2═COH−CH2Cl, cis-CHOH═CH−CH2Cl, trans-CHOH═CH−CH2Cl, CH(═O)−CH2−CH2Cl, and CH3−C(═O)−CH2Cl. On the basis of these thermochemical estimates, together with a Fe(II)/Fe(III) chemical equilibrium model for natural reducing environments, all of the reactions studied were predicted to be very favorable in the standard state and under a wide range of pH conditions. The most favorable reaction was reductive β-elimination (ΔG(rxn)° ≈ −32 kcal/mol), followed closely by reductive dechlorination (ΔG(rxn)° ≈ −27 kcal/mol), dehydrochlorination (ΔG(rxn)° ≈ −27 kcal/mol), and nucleophilic substitution by OH− (ΔG(rxn)° ≈ −25 kcal/mol). For both reduction reactions studied, it was found that the first electron-transfer step, yielding the intermediate C•H2−CHCl−CH2Cl and the CH2Cl−C•H−CH2Cl species, was not favorable in the standard state (ΔG(rxn)° ≈ +15 kcal/mol) and was predicted to occur only at relatively high pH values. This result suggests that reduction by natural attenuation is unlikely.

  15. Kinetics and tissue distribution of the radiolabeled chimeric monoclonal antibody MOv18 IgG and F(ab')2 fragments in ovarian carcinoma patients

    NARCIS (Netherlands)

    Buist, M. R.; Kenemans, P.; den Hollander, W.; Vermorken, J. B.; Molthoff, C. J.; Burger, C. W.; Helmerhorst, T. J.; Baak, J. P.; Roos, J. C.

    1993-01-01

    Twenty-four patients suspected of having ovarian carcinoma received i.v. injection with a combination of radiolabeled intact IgG (1 mg) and F(ab')2 fragments (1 mg) of the chimeric monoclonal antibody MOv18, each form labeled with 1.85 MBq 131I or 125I. Laparotomy was performed either 2 or 6 days

  16. A novel Pseudomonas aeruginosa bacteriophage, Ab31, a chimera formed from temperate phage PAJU2 and P. putida lytic phage AF: characteristics and mechanism of bacterial resistance.

    Directory of Open Access Journals (Sweden)

    Libera Latino

    Full Text Available A novel temperate bacteriophage of Pseudomonas aeruginosa, phage vB_PaeP_Tr60_Ab31 (alias Ab31 is described. Its genome is composed of structural genes related to those of lytic P. putida phage AF, and regulatory genes similar to those of temperate phage PAJU2. The virion structure resembles that of phage AF and other lytic Podoviridae (S. enterica Epsilon 15 and E. coli phiv10 with similar tail spikes. Ab31 was able to infect P. aeruginosa strain PA14 and two genetically related strains called Tr60 and Tr162, out of 35 diverse strains from cystic fibrosis patients. Analysis of resistant host variants revealed different phenotypes, including induction of pigment and alginate overproduction. Whole genome sequencing of resistant variants highlighted the existence of a large deletion of 234 kbp in two strains, encompassing a cluster of genes required for the production of CupA fimbriae. Stable lysogens formed by Ab31 in strain Tr60, permitted the identification of the insertion site. During colonization of the lung in cystic fibrosis patients, P. aeruginosa adapts by modifying its genome. We suggest that bacteriophages such as Ab31 may play an important role in this adaptation by selecting for bacterial characteristics that favor persistence of bacteria in the lung.

  17. Kraft Foods, Inc. in India — The Cadbury Acquisition

    OpenAIRE

    V. S. Pai; Ram Subramanian

    2014-01-01

    When the United States-based Kraft Foods, Inc. (KFI) acquired the United Kingdom-based Cadbury plc, KFI got entry into the Indian market. KFI CEO, Irene Rosenfeld had targeted the developing markets as key for the company to achieve a 5% organic growth rate and the strong position of Cadbury India augured well for expanding KFI's presence in that market. However, after nearly a year since the acquisition, KFI was moving slowly in India and appeared content to consolidate Cadbury's market pres...

  18. Characterization, sequencing and comparative genomic analysis of vB_AbaM-IME-AB2, a novel lytic bacteriophage that infects multidrug-resistant Acinetobacter baumannii clinical isolates.

    Science.gov (United States)

    Peng, Fan; Mi, Zhiqiang; Huang, Yong; Yuan, Xin; Niu, Wenkai; Wang, Yahui; Hua, Yuhui; Fan, Huahao; Bai, Changqing; Tong, Yigang

    2014-07-05

    With the use of broad-spectrum antibiotics, immunosuppressive drugs, and glucocorticoids, multidrug-resistant Acinetobacter baumannii (MDR-AB) has become a major nosocomial pathogen species. The recent renaissance of bacteriophage therapy may provide new treatment strategies for combatting drug-resistant bacterial infections. In this study, we isolated a lytic bacteriophage vB_AbaM-IME-AB2 has a short latent period and a small burst size, which clear its host's suspension quickly, was selected for characterization and a complete genomic comparative study. The isolated bacteriophage vB_AbaM-IME-AB2 has an icosahedral head and displays morphology resembling Myoviridae family. Gel separation assays showed that the phage particle contains at least nine protein bands with molecular weights ranging 15-100 kDa. vB_AbaM-IME-AB2 could adsorb its host cells in 9 min with an adsorption rate more than 99% and showed a short latent period (20 min) and a small burst size (62 pfu/cell). It could form clear plaques in the double-layer assay and clear its host's suspension in just 4 hours. Whole genome of vB_AbaM-IME-AB2 was sequenced and annotated and the results showed that its genome is a double-stranded DNA molecule consisting of 43,665 nucleotides. The genome has a G + C content of 37.5% and 82 putative coding sequences (CDSs). We compared the characteristics and complete genome sequence of all known Acinetobacter baumannii bacteriophages. There are only three that have been sequenced Acinetobacter baumannii phages AB1, AP22, and phiAC-1, which have a relatively high similarity and own a coverage of 65%, 50%, 8% respectively when compared with our phage vB_AbaM-IME-AB2. A nucleotide alignment of the four Acinetobacter baumannii phages showed that some CDSs are similar, with no significant rearrangements observed. Yet some sections of these strains of phage are nonhomologous. vB_AbaM-IME-AB2 was a novel and unique A. baumannii bacteriophage. These findings suggest a common

  19. Growth suppression of colorectal cancer by plant-derived multiple mAb CO17-1A × BR55 via inhibition of ERK1/2 phosphorylation.

    Science.gov (United States)

    Kwak, Dong Hoon; Moussavou, Ghislain; Lee, Ju Hyoung; Heo, Sung Youn; Ko, Kisung; Hwang, Kyung-A; Jekal, Seung-Joo; Choo, Young-Kug

    2014-11-14

    We have generated the transgenic Tabaco plants expressing multiple monoclonal antibody (mAb) CO7-1A × BR55 by cross-pollinating with mAb CO17-1A and mAb BR55. We have demonstrated the anti-cancer effect of plant-derived multiple mAb CO17-1A × BR55. We find that co-treatment of colorectal mAbs (anti-epithelial cellular adhesion molecule (EpCAM), plant-derived monoclonal antibody (mAb(P)) CO17-1A and mAb(P) CO17-1A × BR55) with RAW264.7 cells significantly inhibited the cell growth in SW620 cancer cells. In particular, multi mAb(P) CO17-1A × BR55 significantly and efficiently suppressed the growth of SW620 cancer cells compared to another mAbs. Apoptotic death-positive cells were significantly increased in the mAb(P) CO17-1A × BR55-treated. The mAb(P) CO17-1A × BR55 treatment significantly decreased the expression of B-Cell lymphoma-2 (BCl-2), but the expression of Bcl-2-associated X protein (Bax), and cleaved caspase-3 were markedly increased. In vivo, the mAb(P) CO17-1A × BR55 significantly and efficiently inhibited the growth of colon tumors compared to another mAbs. The apoptotic cell death and inhibition of pro-apoptotic proteins expression were highest by treatment with mAb(P) CO17-1A × BR55. In addition, the mAb(P) CO17-1A × BR55 significantly inhibited the extracellular signal-regulated kinase 1 and 2 (ERK1/2) phosphorylation in cancer cells and tumors. Therefore, this study results suggest that multiple mAb(P) CO17-1A × BR55 has a significant effect on apoptosis-mediated anticancer by suppression of ERK1/2 phosphorylation in colon cancer compared to another mAbs. In light of these results, further clinical investigation should be conducted on mAb(P) CO17-1A × BR55 to determine its possible chemopreventive and/or therapeutic efficacy against human colon cancer.

  20. Insight of DFT and ab initio atomistic thermodynamics on the surface stability and morphology of In2O3

    Science.gov (United States)

    Zhang, Minhua; Wang, Wenyi; Chen, Yifei

    2018-03-01

    In2O3 catalysts show remarkable activity and selectivity in methanol synthesis from CO2 hydrogenation. In order to get insight into the surface stability of this catalyst, density functional theory and ab initio atomistic thermodynamics method were used to investigate the surface free energies of various facets as a function of oxygen chemical potential, as well as the influences of temperature, pressure and gas compositions. The results show that the (111) facet presents lowest surface free energy under oxygen-rich condition, while the indium-terminated (100) facet is the most stable one under oxygen-lean condition. Moreover, we applied Wulff construction to determine the equilibrium shape of In2O3 with different oxygen chemical potentials. The equilibrium shape under oxygen-lean condition is cubic, which only expose (100) facet, while, the equilibrium shape under oxygen-rich condition is octahedron, which only expose (111) facet. Meanwhile, the results agree well with what is observed experimentally. It is further predicted that Wulff shape of In2O3 exists in a truncated octahedron morphology in which the (100) surface becomes predominant plane under CO2 hydrogenation reaction conditions.

  1. Ab initio potential energy surface and vibration-rotation energy levels of silicon dicarbide, SiC2.

    Science.gov (United States)

    Koput, Jacek

    2016-10-05

    The accurate ground-state potential energy surface of silicon dicarbide, SiC2 , has been determined from ab initio calculations using the coupled-cluster approach. Results obtained with the conventional and explicitly correlated coupled-cluster methods were compared. The core-electron correlation, higher-order valence-electron correlation, and scalar relativistic effects were taken into account. The potential energy barrier to the linear SiCC configuration was predicted to be 1782 cm(-1) . The vibration-rotation energy levels of the SiC2 , (29) SiC2 , (30) SiC2 , and SiC(13) C isotopologues were calculated using a variational method. The experimental vibration-rotation energy levels of the main isotopologue were reproduced to high accuracy. In particular, the experimental energy levels of the highly anharmonic vibrational ν3 mode of SiC2 were reproduced to within 6.7 cm(-1) , up to as high as the v3  = 16 state. © 2016 Wiley Periodicals, Inc.

  2. Rotational Energy Transfer of N2 Gas Determined Using a New Ab Initio Potential Energy Surface

    Science.gov (United States)

    Huo, Winifred M.; Stallcop, James R.; Partridge, Harry; Langhoff, Stephen R. (Technical Monitor)

    1997-01-01

    Rotational energy transfer between two N2 molecules is a fundamental process of some importance. Exchange is expected to play a role, but its importance is somewhat uncertain. Rotational energy transfer cross sections of N2 also have applications in many other fields including modeling of aerodynamic flows, laser operations, and linewidth analysis in nonintrusive laser diagnostics. A number of N2-N2 rigid rotor potential energy surface (PES) has been reported in the literature.

  3. Ab initio study of dissociative attachment of low-energy electrons to F2

    International Nuclear Information System (INIS)

    Hazi, A.U.; Orel, A.E.; Rescigno, T.N.

    1981-01-01

    Adiabatic-nuclei resonance theory has been applied to the study of dissociative attachment of low-energy electrons to F 2 . Stieltjes moment theory was used to derive fixed-nuclei electronic resonance parameters from large scale configuration-interaction calculations on F 2 and F 2 - . Dissociative attachment cross sections are reported for the four lowest vibrational levels of F 2 and compared to available experimental data

  4. Reactor Physics

    Energy Technology Data Exchange (ETDEWEB)

    Ait Abderrahim, A

    2001-04-01

    The Reactor Physics and MYRRHA Department of SCK-CEN offers expertise in various areas of reactor physics, in particular in neutronics calculations, reactor dosimetry, reactor operation, reactor safety and control and non-destructive analysis of reactor fuel. This expertise is applied in the Department's own research projects in the VENUS critical facility, in the BR1 reactor and in the MYRRHA project (this project aims at designing a prototype Accelerator Driven System). Available expertise is also used in programmes external to the Department such as the reactor pressure steel vessel programme, the BR2 reactor dosimetry, and the preparation and interpretation of irradiation experiments by means of neutron and gamma calculations. The activities of the Fuzzy Logic and Intelligent Technologies in Nuclear Science programme cover several domains outside the department. Progress and achievements in these topical areas in 2000 are summarised.

  5. Reactor Physics

    International Nuclear Information System (INIS)

    Ait Abderrahim, A.

    2001-01-01

    The Reactor Physics and MYRRHA Department of SCK-CEN offers expertise in various areas of reactor physics, in particular in neutronics calculations, reactor dosimetry, reactor operation, reactor safety and control and non-destructive analysis of reactor fuel. This expertise is applied in the Department's own research projects in the VENUS critical facility, in the BR1 reactor and in the MYRRHA project (this project aims at designing a prototype Accelerator Driven System). Available expertise is also used in programmes external to the Department such as the reactor pressure steel vessel programme, the BR2 reactor dosimetry, and the preparation and interpretation of irradiation experiments by means of neutron and gamma calculations. The activities of the Fuzzy Logic and Intelligent Technologies in Nuclear Science programme cover several domains outside the department. Progress and achievements in these topical areas in 2000 are summarised

  6. Reactor Physics

    Energy Technology Data Exchange (ETDEWEB)

    Ait Abderrahim, A

    2002-04-01

    SCK-CEN's Reactor Physics and MYRRHA Department offers expertise in various areas of reactor physics, in particular in neutron and gamma calculations, reactor dosimetry, reactor operation and control, reactor code benchmarking and reactor safety calculations. This expertise is applied in the Department's own research projects in the VENUS critical facility, in the BR1 reactor and in the MYRRHA project (this project aims at designing a prototype Accelerator Driven System). Available expertise is also used in programmes external to the Department such as the reactor pressure steel vessel programme, the BR2 materials testing reactor dosimetry, and the preparation and interpretation of irradiation experiments by means of neutron and gamma calculations. The activities of the Fuzzy Logic and Intelligent Technologies in Nuclear Science programme cover several domains outside the department. Progress and achievements in these topical areas in 2001 are summarised.

  7. An ab initio investigation of the properties of H2:HX hydrogen-bonded complexes

    Science.gov (United States)

    Fernández, M. I.; Canle, M.; García, M. V.; Santaballa, J. A.

    2010-04-01

    Ammonia oxide ( +NH 3O -), a zwitterionic tautomer of hydroxylamine (NH 2OH), has been proposed to explain the high reactivity of NH 2OH with phosphate esters. The key parameter for kinetically significant reactions through +NH 3O - is the value of the tautomeric constant KT = [ +NH 3O -]/[NH 2OH], which it has so far proved elusive to measure experimentally. Thermodynamic cycles using CBS-QB3 and CPCM computed data have been used to estimate microscopic and macroscopic acid-base equilibria involving NH 2OH, the latter in close agreement to the experimental ones, but those involving anions. Calculated KT is 2.6 × 10 -2, which indicates that although molecular NH 2OH is favoured, there should be enough +NH 3O - in aqueous solution to be a kinetically active species.

  8. Solid methane cold moderator for the IBR-2 reactor

    International Nuclear Information System (INIS)

    Beliakov, A. A.; Tretiakov, I. T.; Shabalin, E. P.; Golikov, V. V.; Luschivkov, V I.

    1997-09-01

    The paper describes the research and design work carried out since 1986 at the Frank Laboratory of Neutron Physics of the Joint Institute for Nuclear Research in Dubna to create a cryogenic moderator for the IBR-22 reactor using solid methane as a moderating substance.

  9. Methodology for reactor core physics analysis - part 2

    International Nuclear Information System (INIS)

    Ponzoni Filho, P.; Fernandes, V.B.; Lima Bezerra, J. de; Santos, T.I.C.

    1992-12-01

    The computer codes used for reactor core physics analysis are described. The modifications introduced in the public codes and the technical basis for the codes developed by the FURNAS utility are justified. An evaluation of the impact of these modifications on the parameter involved in qualifying the methodology is included. (F.E.). 5 ref, 7 figs, 5 tabs

  10. Reactor vessel

    NARCIS (Netherlands)

    Makkee, M.; Kapteijn, F.; Moulijn, J.A.

    1999-01-01

    A reactor vessel (1) comprises a reactor body (2) through which channels (3) are provided whose surface comprises longitudinal inwardly directed parts (4) and is provided with a catalyst (6), as well as buffer bodies (8, 12) connected to the channels (3) on both sides of the reactor body (2) and

  11. Development of prototype reactor maintenance. (2) Application to piping support of sodium-cooled reactor prototype

    International Nuclear Information System (INIS)

    Arai, Masanobu; Kunogi, Kosuke; Aizawa, Kosuke; Chikazawa, Yoshitaka; Takaya, Shigeru; Kubo, Shigenobu; Kotake, Shoji; Ito, Takaya; Yamaguchi, Akira

    2017-01-01

    A maintenance program on piping support of prototype fast breeder reactor Monju are studied. Based on degradation mechanism, snubbers in Monju primary cooling system showed lifetime more than the plant lifetime of 30 years by experiments conservatively. For the first step during construction, visual inspection on accessible all supports could be available. In that visual inspection, mounting conditions and damages of all accessible supports could be monitored. One of major features of the Monju primary piping system is large thermal expansion due to large temperature difference between maintenance and operation conditions. Thanks to that large thermal expansion, integrity of piping supports could be monitored by measuring piping displacement. When technologies of piping displacement monitoring are matured in Monju, visual inspection on piping support could be shifted to piping displacement monitoring. At that stage, the visual inspection could be limited only on representative supports. (author)

  12. Estimation of power feedback parameters of pulse reactor IBR-2M on transients

    International Nuclear Information System (INIS)

    Pepyolyshev, Yu.N.; Popov, A.K.

    2013-01-01

    Parameters of the IBR-2M reactor power feedback (PFB) on a model of the reactor dynamics by mathematical treatment of two registered transients are estimated. Frequency characteristics and the pulse transient characteristics corresponding to these PFB parameters are calculated. PFB parameters received thus can be considered as their express tentative estimation as real measurements in this case occupy no more than 30 minutes. Total PFB is negative at 1 and 2 MW. At the received estimations of PFB parameters in a self-regulation mode it is possible to consider the stability margins of the IBR-2M reactor satisfactory

  13. Interaction of C2H with molecular hydrogen: Ab initio potential energy surface and scattering calculations

    Science.gov (United States)

    Dagdigian, Paul J.

    2018-01-01

    The potential energy surface (PES) describing the interaction of the ethynyl (C2H) radical in its ground X˜ 2Σ+ electronic state with molecular hydrogen has been computed through restricted coupled cluster calculations including single, double, and (perturbative) triple excitations [RCCSD(T)], with the assumption of fixed molecular geometries. The computed points were fit to an analytical form suitable for time-independent quantum scattering calculations of rotationally inelastic cross sections and rate constants. A representative set of energy dependent state-to-state cross sections is presented and discussed. The PES and cross sections for collisions of H2(j = 0) are compared with a previous study [F. Najar et al., Chem. Phys. Lett. 614, 251 (2014)] of collisions of C2H with H2 treated as a spherical collision partner. Good agreement is found between the two sets of calculations when the H2 molecule in the present calculation is spherically averaged.

  14. Ab initio calculation on the low-lying excited states of Si2+ cation including spin–orbit coupling

    International Nuclear Information System (INIS)

    Liu, Yanlei; Zhai, Hongsheng; Zhang, Xiaomei; Liu, Yufang

    2013-01-01

    Highlights: • 24 Λ–S states are correlated to the dissociation limit of Si( 3 P g ) + Si + ( 2 P u ) are first reported. • The dissociation energies of the calculated electronic states are predicted in our work. • It is first time that the entire 54 Ω states generated from the 24 Λ–S states have been studied. • PECs of Λ–S and Ω states are depicted with the aid of avoided crossing rule between the same symmetry. - Abstract: Ab initio all-electron relativistic calculations of the low-lying excited states of Si 2 + have been performed at MRCI+Q/AVQZ level. The calculated electronic states, including 12 doublet and 12 quartet Λ–S states, are correlated to the dissociation limit of Si( 3 P g ) + Si + ( 2 P u ). Spin–orbit interaction is taken into account via the state interaction approach with the full Breit-Pauli Hamiltonian, which causes the entire 24 Λ–S states to split into 54 Ω states. This is the first time that spin–orbit coupling (SOC) calculation has been performed on Si 2 + . The obtained potential energy curves (PECs) of Λ–S and Ω states are respectively depicted with the aid of the avoided crossing rule between the same symmetry. The spectroscopic constants of the bound Λ–S and Ω states are determined, and excellent agreements with the latest theoretical results are achieved

  15. The effect of temperature on the catalytic conversion of Kraft lignin using near-critical water

    DEFF Research Database (Denmark)

    Nguyen, Thi Dieu Huyen; Maschietti, Marco; Åmand, Lars-Erik

    2014-01-01

    The catalytic conversion of suspended LignoBoost Kraft lignin was performed in near-critical water using ZrO2/K2CO3 as the catalytic system and phenol as the co-solvent and char suppressing agent. The reaction temperature was varied from 290 to 370 C and its effect on the process was investigated...... in a continuous flow (1 kg/h). The yields of water-soluble organics (WSO), bio-oil and char (dry lignin basis) were in the ranges of 5–11%, 69–87% and 16–22%, respectively. The bio-oil, being partially deoxygenated, exhibited higher carbon content and heat value, but lower sulphur content than lignin. The main 1...

  16. Accurate ab initio potential for HO2+ : CBS extrapolated energies and direct-fit diatomic curves

    Science.gov (United States)

    Xavier, F. George D.; Martínez-González, Marco; Varandas, A. J. C.

    2018-01-01

    A potential energy surface is reported at the complete basis set limit for the ground electronic state of HO2+ via a four dimensional interpolation in relaxed hyperspherical coordinates. The dissociated products OH+ and O2+ have also been studied at the complete basis set level and subsequently analytically modelled. In the case of O2+, the vibrational states predicted from the model potential have also been directly included in the fit. The potential form so obtained matches the RKR levels with a root mean square deviation below 1cm-1 . Spin orbit + relativistic effects have also been taken into account for the O2+ ion.

  17. Electronic, magnetic and ferroelectric properties of rhombohedral AgFeO2: an ab initio study

    OpenAIRE

    Chakraborty, Jayita; Dasgupta, Indra

    2017-01-01

    Using first principle calculations under the framework of density functional theory we have investigated the electronic structure, magnetism and ferroelectric polarization in the triangular lattice antiferromagnet AgFeO2, and its comparison to the isostructural system CuFeO2. Our calculations reveal that spin orbit interaction plays an important role in determining the magnetic property of AgFeO2 and is possibly responsible for its different magnetic ground state in comparison to CuFeO2. Calc...

  18. Ablation of human colon carcinoma in nude mice by 131I-labeled monoclonal anti-carcinoembryonic antigen antibody F(ab')2 fragments

    International Nuclear Information System (INIS)

    Buchegger, F.; Pfister, C.; Fournier, K.; Prevel, F.; Schreyer, M.; Carrel, S.; Mach, J.P.

    1989-01-01

    Pooled F(ab')2 fragments of three MAbs against distinct epitopes of carcinoembryonic antigen (CEA) were used for radioimmunotherapy of nude mice bearing a subcutaneous human colon carcinoma xenograft. 9-10 d after transplantation when tumor nodules were in exponential growth, 36 mice were treated by intravenous injection of different amounts of 131 I-labeled MAb F(ab')2. All 14 mice injected with a single dose of 2,200 (n = 10) or 2,800 microCi (n = 4) showed complete tumor remission. 8 of the 10 mice treated with 2,200 microCi survived in good health for 1 yr when they were killed and shown to be tumor free. Four of nine other mice treated with four fractionated doses of 400 microCi showed no tumor relapse for more than 9 mo. In contrast, all 15 mice injected with 1,600-3,000 microCi 131 I-control IgG F(ab')2 showed tumor growth retardation of only 1-4 wk, and 15 of 16 mice injected with unlabeled anti-CEA MAb F(ab')2 showed unmodified tumor progression as compared with untreated mice. From tissue radioactivity distributions it was calculated that by an injection of 2,200 microCi 131 I-MAb F(ab')2 a mean dose of 8,335 rad was selectively delivered to the tumor, while the tissue-absorbed radiation doses for the normal organs were: peripheral blood, 2,093; stomach, 1,668; kidney, 1,289; lung, 1,185; liver, 617; spleen, 501; small intestine, 427; large intestine, 367; bone, 337; and muscle, 198. These treatments were well tolerated since out of 19 mice with complete tumor remission only 4 required bone marrow transplantation and 17 were in good health for 6-12 mo of observation

  19. Manejo de lepidópteros-praga na cultura do milho com o evento Bt piramidado Cry1A.105 e Cry2Ab2

    Directory of Open Access Journals (Sweden)

    José Magid Waquil

    2013-12-01

    Full Text Available O objetivo deste trabalho foi avaliar a eficácia do evento piramidado (MON 89034, que expressa as proteínas Cry1A.105 e Cry2Ab2, no controle dos principais lepidópteros-praga da cultura do milho no Brasil, Spodoptera frugiperda, Helicoverpa spp. e Diatraea saccharalis. Os ensaios foram conduzidos em quatro regiões do país, com o híbrido DKB 390, submetido a seis tratamentos: híbrido com o evento piramidado, híbrido com o evento que expressa apenas a proteína Cry1A(b (MON 810 e híbrido convencional (não Bt, todos com e sem manejo integrado de S. frugiperda. Para o evento piramidado, não foi necessário o controle químico em nenhum dos locais avaliados. Diferenças significativas foram observadas entre os tratamentos quanto aos danos e à presença de lagartas. Em geral, essas variáveis foram mais baixas no híbrido com o evento piramidado e mais altas no híbrido convencional, sem controle químico. Sob alta infestação, o controle químico reduziu os danos causados por S. frugiperda e D. saccharalis, tanto no evento que expressa apenas uma proteína, como no híbrido convencional. Com base nos danos causados pelos insetos, o evento piramidado Cry1A.105 e Cry2Ab2 é eficiente no controle dos principais lepidópteros-pragas do milho no Brasil.

  20. ARD remediation with limestone in a CO2 pressurized reactor

    Science.gov (United States)

    Sibrell, Philip L.; Watten, Barnaby J.; Friedrich, Andrew E.; Vinci, Brian J.

    2000-01-01

    We evaluated a new process for remediation of acid rock drainage (ARD). The process treats ARD with intermittently fluidized beds of granular limestone maintained within a continuous flow reactor pressurized with CO2. Tests were performed over a thirty day period at the Toby Creek mine drainage treatment plant, Elk County, Pennsylvania in cooperation with the Pennsylvania Department of Environmental Protection. Equipment performance was established at operating pressures of 0, 34, 82, and 117 kPa using an ARD flow of 227 L/min. The ARD had the following characteristics: pH, 3.1; temperature, 10 °C; dissolved oxygen, 6.4 mg/L; acidity, 260 mg/L; total iron, 21 mg/L; aluminum, 22 mg/L; manganese, 7.5 mg/L; and conductivity, 1400 μS/cm. In all cases tested, processed ARD was net alkaline with mean pH and alkalinities of 6.7 and 59 mg/L at a CO2 pressure of 0 kPa, 6.6 and 158 mg/L at 34 kPa, 7.4 and 240 mg/L at 82 kPa, and 7.4 and 290 mg/L at 117 kPa. Processed ARD alkalinities were correlated to the settled bed depth (pCO2 pressure (pfiltration following treatment. No indications of metal hydroxide precipitation or armoring of the limestone were observed. The surplus alkalinity established at 82 kPa was successful in treating an equivalent of 1136 L/min (five-fold dilution) of the combined three ARD streams entering the Toby Creek Plant. This side-stream capability provides savings in treatment unit scale as well as flexibility in treatment effect. The capability of the system to handle higher influent acidity was tested by elevating the acidity to 5000 mg/L with sulfuric acid. Net alkaline effluent was produced, indicating applicability of the process to highly acidic ARD.

  1. Pojehali, hüüab "Jääaeg 2" / Tiit Tuumalu

    Index Scriptorium Estoniae

    Tuumalu, Tiit, 1971-

    2006-01-01

    Täispikk animafilm "Jääaeg 2 : Suur sula" ("Ice Age 2 : The Meltdown") : režissöör Carlos Sandanha : eestikeelse dublaazhi režissöör Peeter Simm : Ameerika Ühendriigid 2006. Peeter Simm dublaazhi tegemisest

  2. Modelling Tityus scorpion venom and antivenom pharmacokinetics. Evidence of active immunoglobulin G's F(ab')2 extrusion mechanism from blood to tissues.

    Science.gov (United States)

    Sevcik, C; D'Suze, G; Díaz, P; Salazar, V; Hidalgo, C; Azpúrua, H; Bracho, N

    2004-12-01

    Modelling Tityus scorpion venom and antivenom pharmacokinetics. Evidence of active immunoglobulin G's F(ab')(2) extrusion mechanism from blood to tissues. We measured pharmacokinetic parameters for T. discrepans venom in rams. Forty, 75 or 100 microg/kg venom were injected subcutaneously in the inner side of the thigh. Plasma venom content (venenemia) was determined by enzyme-linked immunosorbent assay (ELISA) from 0 to 300 min after injecting venom. Venenemia was fit to a three-compartment model (inoculation site, plasma and extra vascular extracellular space), it was assumed that the venom may also be irreversibly removed from plasma. Calculated time course of venom content shows that at any time no more that 30% of the venom is present in plasma. Venenemia peaks at 1h and decays afterwards. Fluorescently labelled antivenom [horse anti-TityusF(ab')(2) or fraction antigen binding, immuglobulin without Fc chain covalently bound to fluorescine or fluorescamine] pharmacokinetics was determined. Although F(ab')(2) molecular weight is >/=10 times bigger that toxin's, the rate of outflow of F(ab')(2) from blood to tissues was approximately 4 times faster than the venom's outflow. Venom content in the injection site decays exponentially for >6h, this prediction was confirmed immunohistochemically. Only approximately 5% of the venom is eliminated in 10h; approximately 80% of the venom is in the tissues after 2h and remains there for >10h.

  3. Probing the Interaction of Ionic Liquids with CO2: A Raman Spectroscopy and Ab Initio Study

    National Research Council Canada - National Science Library

    Eucker, IV, William

    2008-01-01

    ...) with selected ionic liquids (ILs). Raman spectroscopy and first principle quantum mechanical calculations were performed on selected IL solvents in contact with CO2 in the effort to discover how the solvents interact with the gas. ILs are salts...

  4. MAGELLAN V RSS 5 OCCULTATION PROFILE ABS H2SO4 VOLMIX V1.0

    Data.gov (United States)

    National Aeronautics and Space Administration — This data set includes vertical profiles of 13-cm and 3.6-cm absorptivity and abundance of sulfuric acid vapor (H2SO4). The data set is composed of the following...

  5. Untersuchungen von Defektchalkopyrithalbleitern [vacancy] AB$_2$C$_4$ mit der Methode der gestoerten $\\gamma-\\gamma$- Winkelkorrelation (PAC)

    CERN Document Server

    Dietrich, M

    1998-01-01

    The compounds [vacancy]AB$_2$C$_4$ with defect chalcopyrite structure are especially interesting among the ternary semiconductors. The reason is the occurrence of vacancies in an ordered and stoichiometric manner. Representatives of defect chalcopyrites have been implanted with radioactive probe isotopes mainly at the mass separator ISOLDE at CERN. The nuclear quadrupole interactions of the probe nuclei with the electric field gradients at lattice sites have been observed with perturped $\\gamma-\\gamma$ -angular correlation spectroscopy (PAC). The annealing of the implantation induced lattice damage takes place at temperatures in between 700 K and 1100 K in the substances investigated. $^{117}$Cd, $^{111}$In and $^{77}$Br substitute the Cd-site, both Ga-sites and the Se-site, resp., in CdGa$_2$Se$_4$. The probe $^{111}$Ag substitutes the vacancy. Both the experimentally and the theoretically determined electric field gradients are in the order of magnitude of 10E21 V/m$^2$. At elevated temperatures, disorder o...

  6. Ab initio study of the EFG tensor at Cd impurities in Sc{sub 2}O{sub 3} semiconductor

    Energy Technology Data Exchange (ETDEWEB)

    Munoz, E.L.; Richard, D. [Departamento de Fisica and IFLP (CONICET-UNLP), Facultad de Ciencias Exactas, Universidad Nacional de La Plata, CC 67, 1900 La Plata (Argentina); Errico, L.A. [Departamento de Fisica and IFLP (CONICET-UNLP), Facultad de Ciencias Exactas, Universidad Nacional de La Plata, CC 67, 1900 La Plata (Argentina); Universidad Nacional del Noroeste Bonaerense (UNNOBA), Monteagudo 2772, Pergamino, CP 2700 Buenos Aires (Argentina); Renteria, M., E-mail: renteria@fisica.unlp.edu.a [Departamento de Fisica and IFLP (CONICET-UNLP), Facultad de Ciencias Exactas, Universidad Nacional de La Plata, CC 67, 1900 La Plata (Argentina)

    2009-10-01

    We present an ab initio study of diluted Cd impurities localized at both cation sites of the semiconductor Sc{sub 2}O{sub 3}. The electric-field-gradient (EFG) tensor at Cd impurities located at both cationic sites of the host structure was determined from the calculation of the electronic structure of the doped system. Calculations were performed with the full-potential augmented-plane wave plus local orbitals (APW+lo) method within the framework of the density functional theory. We studied the atomic structural relaxations and the perturbation of the electronic charge density induced by the impurities in the host system in a fully self-consistent way. We showed that the Cd impurity introduces an increase of 8% in the nearest oxygen neighbors bond-lengths, changing the EFG sign for probes located at the asymmetric cation site. The APW+lo predictions for the charged state of the Cd impurity were compared with EFG results existent in the literature, coming from time-differential gamma-gamma perturbed-angular-correlations experiments performed on {sup 111}Cd-implanted Sc{sub 2}O{sub 3} powder samples. From the excellent agreement between theory and experiment, we can strongly suggest that the Cd acceptor impurities are ionized at room temperature. Finally, we showed that simple calculations like those performed within the point-charge model with antishielding factors do not correctly describe the problem of a Cd impurity in Sc{sub 2}O{sub 3}.

  7. Single-layer 1T‧-MoS2 under electron irradiation from ab initio molecular dynamics

    Science.gov (United States)

    Pizzochero, Michele; Yazyev, Oleg V.

    2018-04-01

    Irradiation with high-energy particles has recently emerged as an effective tool for tailoring the properties of two-dimensional transition metal dichalcogenides. In order to carry out an atomically-precise manipulation of the lattice, a detailed understanding of the beam-induced events occurring at the atomic scale is necessary. Here, we investigate the response of 1T' -MoS2 to the electron irradiation by ab initio molecular dynamics means. Our simulations suggest that an electron beam with energy smaller than 75 keV does not result in any knock-on damage. The displacement threshold energies are different for the two nonequivalent sulfur atoms in 1T' -MoS2 and strongly depend on whether the top or bottom chalcogen layer is considered. As a result, a careful tuning of the beam energy can promote the formation of ordered defects in the sample. We further discuss the effect of the electron irradiation in the neighborhood of a defective site, the mobility of the sulfur vacancies created and their tendency to aggregate. Overall, our work provides useful guidelines for the imaging and the defect engineering of 1T' -MoS2 using electron microscopy.

  8. Ab initio calculation of electron–phonon coupling in monoclinic β-Ga2O3 crystal

    International Nuclear Information System (INIS)

    Ghosh, Krishnendu; Singisetti, Uttam

    2016-01-01

    The interaction between electrons and vibrational modes in monoclinic β-Ga 2 O 3 is theoretically investigated using ab-initio calculations. The large primitive cell of β-Ga 2 O 3 gives rise to 30 phonon modes all of which are taken into account in transport calculation. The electron-phonon interaction is calculated under density functional perturbation theory and then interpolated using Wannier–Fourier interpolation. The long-range interaction elements between electrons and polar optical phonon (POP) modes are calculated separately using the Born effective charge tensor. The direction dependence of the long-range POP coupling in a monoclinic crystal is explored and is included in the transport calculations. Scattering rate calculations are done using the Fermi golden rule followed by solving the Boltzmann transport equation using the Rode's method to estimate low field mobility. A room temperature mobility of 115 cm 2 /V s is observed. Comparison with recent experimentally reported mobility is done for a wide range of temperatures (30 K–650 K). It is also found that the POP interaction dominates the electron mobility under low electric field conditions. The relative contribution of the different POP modes is analyzed and the mode 21 meV POP is found to have the highest impact on low field electron mobility at room temperature.

  9. Immunolymphoscintigraphy and immunoscintigraphy of ovarian and fallopian tube cancer using F(ab')2 fragments of monoclonal antibody OC 125

    International Nuclear Information System (INIS)

    Lehtovirta, P.; Kairemo, K.J.; Liewendahl, K.; Seppaelae, M.

    1990-01-01

    We have used immunolymphoscintigraphy (ILS) alone or in combination with immunoscintigraphy with 131 I-labeled F(ab')2 fragments of monoclonal OC 125 antibodies to improve detection of retroperitoneal lymph node metastases of ovarian and fallopian tube cancer. ILS was carried out with bilateral dorsopedal s.c. injections on nine patients and with bilateral iliopelvic injections into the ischiorectal fossa on two other patients. Radioimaging was performed 2-4 times between 0 and 5 days. An additional dose of labeled antibody fragments was given i.v., and imaging was done 2-3 days later. Conventional immunoscintigraphy without preceding ILS was carried out on another nine patients. Dorsopedal ILS improved detection of pelvic and paraaortic lymph node metastases. Malignant lymph nodes were detectable as early as 3 h after s.c. injection of the tracer. Combined results of ILS and immunoscintigraphy in 16 surgically verified cases indicated a true positive finding in 9 patients, true negative finding in 5, false positive in one, and false negative in 1. Calculated from these figures the sensitivity, specificity, and accuracy of the method were 90, 83, and 88%, respectively. Involved lymph nodes were found more frequently in those patients whose serum CA 125 concentration was elevated demonstrating that an elevated serum CA 125 level does not preclude successful radioimmunodetection

  10. Production of Sn-117m in the BR2 high-flux reactor.

    Science.gov (United States)

    Ponsard, B; Srivastava, S C; Mausner, L F; Russ Knapp, F F; Garland, M A; Mirzadeh, S

    2009-01-01

    The BR2 reactor is a 100MW(th) high-flux 'materials testing reactor', which produces a wide range of radioisotopes for various applications in nuclear medicine and industry. Tin-117m ((117m)Sn), a promising radionuclide for therapeutic applications, and its production have been validated in the BR2 reactor. In contrast to therapeutic beta emitters, (117m)Sn decays via isomeric transition with the emission of monoenergetic conversion electrons which are effective for metastatic bone pain palliation and radiosynovectomy with lesser damage to the bone marrow and the healthy tissues. Furthermore, the emitted gamma photons are ideal for imaging and dosimetry.

  11. Irradiation effects on Zr-2.5Nb in power reactors

    Energy Technology Data Exchange (ETDEWEB)

    Song, C., E-mail: Carol.Song@cnl.ca [Canadian Nuclear Laboratories, Chalk River, Ontario (Canada)

    2016-06-15

    Zirconium alloys are widely used as structural materials in nuclear applications because of their attractive properties such as a low absorption cross-section for thermal neutrons, excellent corrosion resistance in water, and good mechanical properties at reactor operating temperatures. Zr-2.5Nb is one of the most commonly used zirconium alloys and has been used for pressure tube materials in CANDU (Canada Deuterium Uranium) and RBMK (Reaktor Bolshoy Moshchnosti Kanalnyy, 'High Power Channel-type Reactor') reactors for over 40 years. In a recent report from the Electric Power Research Institute, Zr-2.5Nb was identified as one of the candidate materials for use in normal structural applications in light-water reactors owing to its increased resistance to irradiation-induced degradation as compared with currently used materials. Historically, the largest program of in-reactor tests on zirconium alloys was performed by Atomic Energy of Canada Limited. Over many years of in-reactor testing and CANDU operating experience with Zr- 2.5Nb, extensive research has been conducted on the irradiation effects on its microstructures, mechanical properties, deformation behaviours, fracture toughness, delayed hydride cracking, and corrosion. Most of the results on Zr-2.5Nb obtained from CANDU experience could be used to predict the material performance under light water reactors. This paper reviews the irradiation effects on Zr-2.5Nb in power reactors (including heavy-water and light-water reactors) and summarizes the current state of knowledge. (author)

  12. A Conserved Motif Provides Binding Specificity to the PP2A-B56 Phosphatase

    DEFF Research Database (Denmark)

    Hertz, Emil Peter Thrane; Kruse, Thomas; Davey, Norman E

    2016-01-01

    -exposed pocket on PP2A regulatory B56 subunits binds to a consensus sequence on interacting proteins, which we term the LxxIxE motif. The composition of the motif modulates the affinity for B56, which in turn determines the phosphorylation status of associated substrates. Phosphorylation of amino acid residues......Dynamic protein phosphorylation is a fundamental mechanism regulating biological processes in all organisms. Protein phosphatase 2A (PP2A) is the main source of phosphatase activity in the cell, but the molecular details of substrate recognition are unknown. Here, we report that a conserved surface...... within the motif increases B56 binding, allowing integration of kinase and phosphatase activity. We identify conserved LxxIxE motifs in essential proteins throughout the eukaryotic domain of life and in human viruses, suggesting that the motifs are required for basic cellular function. Our study provides...

  13. Ab initio treatment of gas phase GeO{sup 2+} doubly charged ion

    Energy Technology Data Exchange (ETDEWEB)

    Mogren Al Mogren, M. [Chemistry Department, Faculty of Science, King Saud University, PO Box 2455, Riyadh 11451 (Saudi Arabia); Ben Abdallah, D. [Laboratoire de Spectroscopie Atomique, Moléculaire et Applications – LSAMA, Université de Tunis, Tunis (Tunisia); Department of General Studies, Riyadh Corporation of Technology, Technical and Vocational Training Corporation, PO Box 42826, Riyadh 11551 (Saudi Arabia); Hochlaf, M., E-mail: hochlaf@univ-mlv.fr [Université Paris-Est, Laboratoire Modélisation et Simulation Multi Echelle, MSME UMR 8208 CNRS, 5 bd Descartes, 77454 Marne-la-Vallée (France)

    2015-01-13

    Highlights: • Theoretical investigation of the novel gas-phase molecular species GeO{sup 2+}. • Spectroscopic parameters of this dication in its electronic ground and exited states. • Theoretical double ionization spectrum of GeO. - Abstract: Using multi reference configuration interaction methodology in connection with a large basis set, we show that GeO{sup 2+} is a metastable species either in the ground or in the electronically excited states. This confirms the observation of this dication in gas phase by mass spectrometry. In addition, we derived a set of accurate spectroscopic terms for GeO{sup 2+} bound states. At the MRCI/aug-cc-pV5Z level of theory, the adiabatic double ionization energy of GeO is computed to be ∼28.93 eV.

  14. Kinetic modeling of kraft delignification of Eucalyptus globulus

    Energy Technology Data Exchange (ETDEWEB)

    Santos, A.; Rodriguez, F.; Gilarranz, M.A.; Moreno, D.; Garcia-Ochoa, F. [Univ. Complutense, Madrid (Spain). Dept. de Ingenieria Quimica

    1997-10-01

    A kinetic model for the kraft pulping delignification of Eucalyptus globulus is proposed. This model is discriminated among some kinetic expressions often used in the literature, and the kinetic parameters are determined by fitting of experimental results. A total of 25 isothermal experiments at liquor-to-wood ratios of 50 and 5 L/kg have been carried out. Initial, bulk, and residual delignification stages have been observed during the lignin removal, the transitions being, referring to the lignin initial content, about 82 and 3%. Carbohydrate removal and effective alkali-metal and hydrosulfide consumption have been related with the lignin removal by means of effective stoichiometric coefficients for each stage, coefficients also being calculated by fitting of the experimental data. The kinetic model chosen has been used to simulate typical kraft pulping experiments carried out at nonisothermal conditions, using a temperature ramp. The model yields simulated values close to those obtained experimentally for the wood studied and also ably reproduces the trends of the literature data.

  15. Comparison of ab initio molecular properties of EDO-TTF with the properties of the (EDO-TTF)(2)PF6 crystal

    NARCIS (Netherlands)

    Linker, Gerrit-Jan; van Loosdrecht, Paul H. M.; van Duijnen, Piet; Broer, Ria

    2010-01-01

    We performed ab initio quantum chemical calculations for the geometrical and electronic structure of the EDO-TTF (ethylenedioxy-tetrathiafulvalene) molecule using HF, CASSCF and DFT methods. We compare these in vacuo results with the properties of the (EDO-TTF)(2)PF6 crystal at near room

  16. 111In-cetuximab-F(ab')2 SPECT imaging for quantification of accessible epidermal growth factor receptors (EGFR) in HNSCC xenografts

    NARCIS (Netherlands)

    Dijk, L.K. van; Hoeben, B.A.W.; Stegeman, H.; Kaanders, J.H.A.M.; Franssen, G.M.; Boerman, O.C.; Bussink, J.

    2013-01-01

    BACKGROUND AND PURPOSE: Immunohistochemical epidermal growth factor receptor (EGFR) expression does not correlate with treatment response in head and neck squamous cell carcinomas (HNSCC). Aim was to apply the tracer (111)In-cetuximab-F(ab')2 for EGFR microSPECT imaging and to investigate if tracer

  17. Ab-initio study of dynamical properties of two dimensional MoS2 under strain

    Directory of Open Access Journals (Sweden)

    Himadri Soni

    2015-10-01

    Full Text Available In this paper, we report the biaxial strain induced modifications in the phonon dispersion curves of monolayer MoS2 using first principles calculations in the framework of density functional perturbation theory. We have used the ultrasoft psedopotentials and the exchange correlation energies have been approximated by the local density approximation. There are significant changes in the phonon dispersion curves under strain. A systematic decrease in the optical phonon modes is observed with strain percentage. The longitudinal and transverse acoustic phonon modes of monolayer MoS2 show linear dependency for both without and with strain cases. However, the out of plane acoustic mode (ZA which behaves quadratically with wave vector k- turns linear under strain. We have also linked ripple in single layer (SL MoS2 by ZA mode with strain using shell elasticity theory. The strain induced softening of linear behaviour of ZA mode with strain indicates the absence of rippling under strain. At a very high strain there is a possibility of structural phase transition as the ZA mode at zone centre turns imaginary above 15% strain. Our results indicate a close relationship between the morphology and properties enabling the device tailoring and bandgap engineering in SL-MoS2 by manipulating the strain.

  18. Ab initio potential energy and dipole moment surfaces for CS2: determination of molecular vibrational energies.

    Science.gov (United States)

    Pradhan, Ekadashi; Carreón-Macedo, José-Luis; Cuervo, Javier E; Schröder, Markus; Brown, Alex

    2013-08-15

    The ground state potential energy and dipole moment surfaces for CS2 have been determined at the CASPT2/C:cc-pVTZ,S:aug-cc-pV(T+d)Z level of theory. The potential energy surface has been fit to a sum-of-products form using the neural network method with exponential neurons. A generic interface between neural network potential energy surface fitting and the Heidelberg MCTDH software package is demonstrated. The potential energy surface has also been fit using the potfit procedure in MCTDH. For fits to the low-energy regions of the potential, the neural network method requires fewer parameters than potfit to achieve high accuracy; global fits are comparable between the two methods. Using these potential energy surfaces, the vibrational energies have been computed for the four most abundant CS2 isotopomers. These results are compared to experimental and previous theoretical data. The current potential energy surfaces are shown to accurately reproduce the low-lying vibrational energies within a few wavenumbers. Hence, the potential energy and dipole moments surfaces will be useful for future study on the control of quantum dynamics in CS2.

  19. Janus Reactors with Highly Efficient Enzymatic CO2Nanocascade at Air-Liquid Interface.

    Science.gov (United States)

    Gao, Song; Mohammad, Munirah; Yang, Hao-Cheng; Xu, Jia; Liang, Kang; Hou, Jingwei; Chen, Vicki

    2017-12-13

    Though enzymatic cascade reactors have been the subject of intense research over the past few years, their application is still limited by the complicated fabrication protocols, unsatisfactory stability and lack of effective reactor designs. In addition, the spatial positioning of the cascade reactor has so far not been investigated, which is of significant importance for biphase catalytic reaction systems. Inspired by the Janus properties of the lipid cellular membrane, here we show a highly efficient Janus gas-liquid reactor for CO 2 hydration and conversion. Within the Janus reactor, nanocascades containing the nanoscale compartmentalized carbonic anhydrase and formic dehydrogenase were positioned at a well-defined gas-liquid interface, with a high substrate concentration gradient. The Janus reactor exhibited 2.5 times higher CO 2 hydration efficiency compared with the conventional gas-liquid contactor with pristine membranes, and the formic acid conversion rate can reach approximately 90%. Through this work, we provide evidence that the spatial arrangement of the nanocascade is also crucial to efficient reactions, and the Janus reactor can be a promising candidate for the biphase catalytic reactions in environmental, biological and energy aspects.

  20. A simulation Model of the Reactor Hall Ventilation and air Conditioning Systems of ETRR-2

    International Nuclear Information System (INIS)

    Abd El-Rahman, M.F.

    2004-01-01

    Although the conceptual design for any system differs from one designer to another. each of them aims to achieve the function of the system required. the ventilation and air conditioning system of reactors hall is one of those systems that really differs but always dose its function for which it is designed. thus, ventilation and air conditioning in some reactor hall constitute only one system whereas in some other ones, they are separate systems. the Egypt Research Reactor-2 (ETRR-2)represents the second type. most studies conducted on ventilation and air conditioning simulation models either in traditional building or for research rectors show that those models were not designed similarly to the model of the hall of ETRR-2 in which ventilation and air conditioning constitute two separate systems.besides, those studies experimented on ventilation and air conditioning simulation models of reactor building predict the temperature and humidity inside these buildings at certain outside condition and it is difficult to predict when the outside conditions are changed . also those studies do not discuss the influences of reactor power changes. therefore, the present work deals with a computational study backed by infield experimental measurements of the performance of the ventilation and air conditioning systems of reactor hall during normal operation at different outside conditions as well as at different levels of reactor power

  1. Calculation of the paramagnetic susceptibility and specific heat in UGa{sub 2} and UPd{sub 2}Al{sub 3} from ab initio crystal field theory

    Energy Technology Data Exchange (ETDEWEB)

    Richter, M.; Forstreuter, J.; Koepernik, K.; Eschrig, H. [Univ. of Technol., Dresden (Germany). MPG Res. Group Electron Systems; Divis, M. [Univ. of Technol., Dresden (Germany). MPG Res. Group Electron Systems]|[Karlova Univ., Prague (Czechoslovakia). Dept. of Metal Physics; Steinbeck, L. [Univ. of Technol., Dresden (Germany). MPG Res. Group Electron Systems]|[York Univ. (United Kingdom). Dept. of Physics

    1997-02-01

    In the framework of the self-interaction corrected local density approximation, ab initio calculations have been carried out to obtain crystal field parameters for the paramagnetic state of UGa{sub 2} and UPd{sub 2}Al{sub 3}. In two sets of calculations localized 5f states with occupation two and three, respectively, have been assumed. Using these parameters and adjusted anisotropic molecular field constants, the paramagnetic susceptibility for both compounds and the Schottky contribution to the specific heat in UPd{sub 2}Al{sub 3} have been obtained by crystal field model calculations. Very good agreement between theoretical and experimental data is found for 5f{sup 2} occupation in UGa{sub 2}. For UPd{sub 2}Al{sub 3}, the 5f{sup 2} assumption yields qualitatively reasonable results as well, but it does not explain the T = 50 K maximum in the experimental data. (orig.).

  2. Relaxation and electronic structure of the V 2O 3(0001) surface: ab initio cluster model studies

    Science.gov (United States)

    Czekaj, I.; Hermann, K.; Witko, M.

    2003-02-01

    The electronic structure and geometric relaxation of the (0001) surface of rhombohedral vanadium sesquioxide, V 2O 3, is studied theoretically with large surface cluster models where ab initio density functional theory is used to characterize charging and bonding. Geometric relaxation in the topmost surface region, up to 5 layers, with its three different bulk terminations is determined by minimizing total energies of the clusters. This yields major relaxation effects depending on the termination. The oxygen layer termination OVV ' exhibits strong relaxation of sub-surface vanadium layers resulting in increased ionic charging at the surface (measured by corresponding atom charges). The metal layer termination VV 'O leads to inwards relaxation of the two topmost vanadium layers by over 40% resulting also in increased surface charging. Ionic charging at the surface is the smallest for the half metal layer V 'OV termination where only the topmost vanadium layer relaxes inwards by 30% in addition to some rearrangement of sub-surface vanadium. This termination is believed to be the most stable of the three relaxed bulk-type terminations based also on analogies with experiments for Cr 2O 3(0001). However, total density-of-states and atom-projected partial densities-of-states curves depend relatively little on surface termination to allow a clear discrimination which could assist an unambiguous experimental identification.

  3. Ab initio Potential-Energy Surfaces and Electron-Spin-Exchange Cross Sections for H-O2 Interactions

    Science.gov (United States)

    Stallcop, James R.; Partridge, Harry; Levin, Eugene

    1996-01-01

    Accurate quartet- and doublet-state potential-energy surfaces for the interaction of a hydrogen atom and an oxygen molecule in their ground states have been determined from an ab initio calculation using large-basis sets and the internally contracted multireference configuration interaction method. These potential surfaces have been used to calculate the H-O2 electron-spin-exchange cross section; the square root of the cross section (in a(sub 0)), not taking into account inelastic effects, can be obtained approximately from the expressions 2.390E(sup -1/6) and 5.266-0.708 log10(E) at low and high collision energies E (in E(sub h)), respectively. These functional forms, as well as the oscillatory structure of the cross section found at high energies, are expected from the nature of the interaction energy. The mean cross section (the cross section averaged over a Maxwellian velocity distribution) agrees reasonably well with the results of measurements.

  4. Ab initio study of STM-induced vacancy formation on the MoS{sub 2} surface

    Energy Technology Data Exchange (ETDEWEB)

    Caulfield, J.C.; Fisher, A.J. [Department of Physics and Astronomy, University College London, Gower Street, London WC1E 6BT (United Kingdom)

    1998-06-01

    The ab initio projector augmented wave technique has been used to study the STM-induced extraction of single atoms from the surface of MoS{sub 2}. The STM tip is represented by a cluster of molybdenum atoms and bias effects are introduced by adding a linear external potential (constant electric field) to the total self-consistent potential of the system. It is found that the calculated barriers against extraction of Mo and S atoms from the surface with a tip-sample separation of 8 au (4.2 A) are too large to explain the reproducibility of atom-extraction experiments on the surface. In fact, from these calculations, local surface temperatures around 1600 K and 5100 K would be required to extract S and Mo atoms respectively at the rates apparent in the experiments. Since it is highly unlikely that such temperatures are achieved, other mechanisms must be contributing to the extraction process and the various possibilities are discussed. (author)

  5. Fast breeder reactors: Experience and trends. V. 2

    International Nuclear Information System (INIS)

    1986-01-01

    The IAEA Symposium on ''Fast Breeder Reactors: Experience and Future Trends'' was held, at the invitation of the Government of France, in Lyons, France, on 22-26 July 1985. It was hosted by the French Commissariat a l'energie atomique and Electricite de France. The purpose of the Symposium was to review the experience gained so far in the field of LMFBRs, taking into account the constructional, operational, technological, economic and fuel cycle aspects, and to consider the developmental trends as well as the international co-operation in fast breeder reactor design and utilization. The Symposium was attended by almost 400 participants (340 participants, 35 observers and 20 journalists) from 25 countries and five international organizations. More than 80 papers were presented and discussed during six regular sessions and four poster sessions. A separate abstract was prepared for each of these papers

  6. Diffusion calculation's for the SLOWPOKE-2 reactor using DONJON

    International Nuclear Information System (INIS)

    Noceir, S.; El Hajjaji, O.; Varin, E.

    1997-01-01

    The SLOWPOKE reactor at Ecole Polytechnique will be refueled with a Low Enriched Uranium (LEU) fuel in place of a High Enriched Uranium (HEU) fuel used until now. The purpose of this study is to provide various models, using the reactor physics chain of codes DRAGON/DONJON, in order to predict the behavior of the new LEU Slowpoke. In particle, we will present some numerical results concerning the separate temperature effects of the main components of the core, the effect of a partial void appearing near the fuel pins and the axial and radial flux distributions. Finally the difference between the present HEU and the future LEU fuel power will be given. (author)

  7. A KINETIC MODEL FOR H2O2/UV PROCESS IN A COMPLETELY MIXED BATCH REACTOR. (R825370C076)

    Science.gov (United States)

    A dynamic kinetic model for the advanced oxidation process (AOP) using hydrogen peroxide and ultraviolet irradiation (H2O2/UV) in a completely mixed batch reactor (CMBR) is developed. The model includes the known elementary chemical and photochemical reac...

  8. Possible doping strategies for MoS 2 monolayers: An ab initio study

    KAUST Repository

    Dolui, Kapildeb

    2013-08-14

    Density functional theory is used to systematically study the electronic properties of doped MoS2 monolayers, where the dopants are incorporated both via S/Mo substitution or as adsorbates. Among the possible substitutional dopants at the Mo site, Nb is identified as suitable p-type dopant, while Re is the donor with the lowest activation energy. When dopants are simply adsorbed on a monolayer we find that alkali metals shift the Fermi energy into the MoS2 conduction band, making the system n type. Finally, the adsorption of charged molecules is considered, mimicking an ionic liquid environment. We find that molecules adsorption can lead to both n- and p-type conductivity, depending on the charge polarity of the adsorbed species. © 2013 American Physical Society.

  9. Novel Catalytic Reactor for CO2 Reduction via Sabatier Process Project

    Data.gov (United States)

    National Aeronautics and Space Administration — A novel short contact time Microlith Sabatier reactor system for CO2 reduction offers a significant advance in support of manned spaceflight. Compared to current and...

  10. Novel, Regenerable Microlith Catalytic Reactor for CO2 Reduction via Bosch Process, Phase I

    Data.gov (United States)

    National Aeronautics and Space Administration — Precision Combustion, Inc. (PCI) proposes to develop an extremely compact, lightweight and regenerable MicrolithREG catalytic CO2 reduction reactor, capable of...

  11. Advanced technologies for water cooled reactors 1990. Pt. 2

    International Nuclear Information System (INIS)

    1991-05-01

    The main purpose of the meeting was to review and discuss the status of national programmes, the progress achieved since the last meeting held in June 1988 in the field of advanced technologies and design trends for existing and future water cooled reactors. 24 specialists from 14 countries and the IAEA took part in the meeting and 12 papers were presented. A separate abstract was prepared for each of these papers. Refs, figs and tabs

  12. European supercritical water cooled reactor (HPLWR Phase 2 project)

    International Nuclear Information System (INIS)

    Schulenberg, Thomas; Starflinger, Joerg; Marsault, Philippe; Bittermann, Dietmar; Maraczy, Czaba; Laurien, Eckart; Lycklama, Jan Aiso; Anglart, Henryk; Andreani, Michele; Ruzickova, Mariana; Heikinheimo, Liisa

    2010-01-01

    The High Performance Light Water Reactor (HPLWR), how the European Supercritical Water Cooled Reactor is called, is a pressure vessel type reactor operated with supercritical water at 25 MPa feedwater pressure and 500 deg C maximum core outlet temperature. It is designed and analyzed by a European consortium of 13 partners from 8 Euratom member states in the second phase of the HPLWR project. Most emphasis has been laid on a core with a thermal neutron spectrum, consisting of small, housed fuel assemblies with 40 fuel pins each and a central water box to improve the neutron moderation despite the low coolant density. Peak cladding temperatures of the fuel rods have been minimized by heating up the coolant in three steps with intermediate coolant mixing. The innovative core design with upward and downward flow through its assemblies has been studied with neutronic, thermal-hydraulic and stress analyses and has been reviewed carefully in a mid-term assessment. The containment design with its safety and residual heat removal systems is based on the latest boiling water reactor concept, but with different passive high pressure coolant injection systems to cause a forced convection through the core. The design concept of the steam cycle is indicating the envisaged efficiency increase to around 44%. Moreover, it provides the constraints to design the components of the balance of the plant. The project is accompanied by numerical studies of heat transfer of supercritical water in fuel assemblies and by material tests of candidate cladding alloys, performed by the consortium and supported by additional tests of the Joint Research Centre of the European Commission. An overview of results achieved up to now, given in this paper, is illustrating the latest scientific and technological advances. (author)

  13. Gemstone Color and Silicon Doping in the ETRR-2 Reactor

    International Nuclear Information System (INIS)

    Helal, A. I.

    2004-01-01

    The present article presents a general view of the recent utilities of the rectors. The applications depend on the effect of the neutrons on the material. The effect on pure silicon ingots which is known as neutron transmutation doping is used as a way to transfer the silicon ingot as an insulator to a semiconductor one. The effect on geological stones which is known as artificial gem colored stones are presented as new applications of the reactor facilities. (author)

  14. Effects of black liquor shocks on activated sludge treatment of bleached kraft pulp mill wastewater.

    Science.gov (United States)

    Morales, Gabriela; Pesante, Silvana; Vidal, Gladys

    2015-01-01

    Kraft pulp mills use activated sludge systems to remove organic matter from effluents. Process streams may appear as toxic spills in treatment plant effluents, such as black liquor, which is toxic to microorganisms of the activated sludge. The present study evaluates the effects of black liquor shocks in activated sludge systems. Four black liquor shocks from 883 to 3,225 mg chemical oxygen demand-COD L(-1) were applied during 24 hours in a continuously operating lab-scale activated sludge system. Removal efficiencies of COD, color and specific compounds were determined. Moreover, specific oxygen uptake rate (SOUR), sludge volumetric index (SVI) and indicator microorganisms were evaluated. Results show that the addition of black liquor caused an increase in COD removal (76-67%) immediately post shock; followed two days later by a decrease (-19-50%). On the other hand, SOUR ranged between 0.152 and 0.336 mgO2 g(-1) volatile suspended solids-VSS• min(-1) during shocks, but the initial value was reestablished at hour 24. When the COD concentration of the shock was higher than 1,014 mg/L, the abundance of stalked ciliates and rotifers dropped. Finally, no changes in SVI were observed, with values remaining in the range 65.8-40.2 mL g(-1) total suspended solids-TSS during the entire operating process. Based on the results, the principal conclusion is that the activated sludge system with the biomass adapted to the kraft pulp effluent could resist a black liquor shock with 3,225 mgCOD L(-1) of concentration during 24 h, under this study's conditions.

  15. Ab initio calculation of mechanical and thermal properties of U{sub 2}Mo intermetallic

    Energy Technology Data Exchange (ETDEWEB)

    Jaroszewicz, S., E-mail: jaroszew@tandar.cnea.gov.ar [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina); Losada, E.L.; Garcés, J.E. [DAEE, Centro Atómico Bariloche, Comisión Nacional de Energía Atómica (Argentina); Mosca, H.O. [Gerencia de Investigación y Aplicaciones, Comisión Nacional de Energía Atómica (Argentina)

    2013-10-15

    We present a study of structural, elastic and thermodynamic properties of tetragonal (C11{sub b}) U{sub 2}Mo by means of density-functional theory based calculations using full-potential linearized augmented plane wave method. In this approach the generalized gradient approximation were used for the exchange–correlation potential calculation. The optimized lattice parameters are in excellent agreement with the experimental data. Through the Debye–Grüneisen model the temperature and pressure dependence of equation of state, bulk modulus, thermal expansion and specific heat have been obtained and discussed in the range of pressure 0–20 GPa and the temperature 0–800 K.

  16. Structural study of uranyl (6) nitrate complexes: [UO{sub 2}(NO{sub 3}){sub 2}TMP{sub 2}] by ab initio molecular orbital calculation

    Energy Technology Data Exchange (ETDEWEB)

    Oda, Y.; Koyama, T.; Funasaka, H. [Japan Nuclear Cycle Development Institute, Tokai Works (Japan)

    2000-07-01

    Ab initio molecular orbital calculations on the structure and stability of the complex of uranyl nitrate with water or tri-methyl phosphate (TMP) was performed using the Density Functional Theory with the basis set including the relativistic effects. When the aqua uranyl nitrate complex structure was calculated with two water molecules at the first coordination sphere, the optimized complex structure was not in agreement with the experimental data of [UO{sub 2}(NO{sub 3}){sub 2}(H{sub 2}O){sub 6}]. The optimization of the complex structure was improved by taking into account the influence of outer four water molecules at the second coordination sphere, which should bond with inner water molecules through the water hydrogen. It means the solution effect is not negligible for the coordination of the ligands such as water. For the H{sub 3}PO{sub 4} coordination, eight models were preferred, one group had the coordination angle of U-O-P in H{sub 3}PO{sub 4} is bent, and other group had straight and the four combinations of the direction of three O-H groups. [UO{sub 2}(NO{sub 3})2(H{sub 3}PO{sub 4}){sub 2}] had greater stability, when U-O-P angle was bent, and there were on the equatorial plane. Finally, the structure of [UO{sub 2}(NO{sub 3}){sub 2}TMP{sub 2}] is optimized, and the optimized geometry has agreement with experimental values. From the comparison of H{sub 3}PO{sub 4} and TMP coordination, the alkyl group in the organophosphorus ligand strongly influences the bond angle of U-O-P. (authors)

  17. Ab Initio Study of Electronic Transport in Cubic-HfO2 Grain Boundaries

    Directory of Open Access Journals (Sweden)

    Elena Degoli

    2017-01-01

    Full Text Available In polycrystalline materials the grain boundaries (GBs are particularly important as they can act as a sink for atom defects and impurities, which may drive structural transformation of the materials and consequently modify their properties. Characterising the structure and properties of GBs is critical for understanding and controlling material property. Here, we investigated how GBs can modify the structural, electronic, and transport properties of the polycrystalline material HfO2. In general, grain boundaries are considered to be detrimental to the physical stability and electronic transport in HfO2. Anyway, studying by first principles the two most stable and common types of GBs, the tilt and the twist, we found substantial differences on the impact they have on the material properties. In fact, while tilt defects create channels of different sizes and shapes in hafnia along which the electronic transport is stronger in relation to leakage current through GBs, twist defects create a sort of amorphous structure that tends to resemble the bulk and which is independent of the number of rotated planes/atoms.

  18. Preclinical validation of111In-girentuximab-F(ab')2as a tracer to image hypoxia related marker CAIX expression in head and neck cancer xenografts.

    Science.gov (United States)

    Huizing, Fokko J; Hoeben, Bianca A W; Franssen, Gerben; Lok, Jasper; Heskamp, Sandra; Oosterwijk, Egbert; Boerman, Otto C; Bussink, Johan

    2017-09-01

    Hypoxia is a major cause of radio- and chemoresistance. Carbonic anhydrase IX (CAIX) is an endogenous hypoxia-related marker and an important prognostic marker. Assessment of CAIX expression may allow patient selection for hypoxia or CAIX-targeted treatment. The radioactive tracer 111 In-girentuximab-F(ab') 2 targets CAIX and can be used for SPECT imaging. Aim of this study was to validate and optimize 111 In-girentuximab-F(ab') 2 for imaging of CAIX expression in head and neck tumor xenografts. Affinity and internalization kinetics of 111 In-girentuximab-F(ab') 2 were determined in vitro using CAIX-expressing SK-RC-52 cells. Tumor targeting characteristics were determined in athymic mice with six different head and neck squamous cell carcinoma (SCCNij) xenografts. Tracer uptake was measured by ex vivo radioactivity counting. Intratumoral distribution of tracer uptake was measured using autoradiography and CAIX expression was determined immunohistochemically. 26% of the tracer was internalized into the SK-RC-52 cells within 24h. The half maximal inhibitory concentration (IC 50 ) was 0.69±0.08nM. In biodistribution studies SCCNij153 tumors showed the highest tracer uptake: 4.1±0.8ID/g at 24h p.i. Immunohistochemical and autoradiographic analyses of the xenografts showed a distinct spatial correlation between localization of the tracer and CAIX expression. 111 In-girentuximab-F(ab') 2 has a high affinity for CAIX. In vivo tumor uptake correlated strongly with CAIX expression in different head and neck xenografts. These results suggest that 111 In-girentuximab-F(ab') 2 is a promising tracer for imaging of hypoxia-related CAIX expression. Copyright © 2017 Elsevier B.V. All rights reserved.

  19. Yield Improvement and Energy Savings Uing Phosphonates as Additives in Kraft pulping

    Energy Technology Data Exchange (ETDEWEB)

    Ulrike W. Tschirner; Timothy Smith

    2007-03-31

    Project Objective: Develop a commercially viable modification to the Kraft process resulting in energy savings, increased yield and improved bleachability. Evaluate the feasibility of this technology across a spectrum of wood species used in North America. Develop detailed fundamental understanding of the mechanism by which phosphonates improve KAPPA number and yield. Evaluate the North American market potential for the use of phosphonates in the Kraft pulping process. Examine determinants of customer perceived value and explore organizational and operational factors influencing attitudes and behaviors. Provide an economic feasibility assessment for the supply chain, both suppliers (chemical supply companies) and buyers (Kraft mills). Provide background to most effectively transfer this new technology to commercial mills.

  20. Modification to ORIGEN2 for generating N Reactor source terms. Volume 2: ORIGEN2 N-Reactor output files

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1997-06-01

    This text is intended to be a brief outline of the ORIGEN2 computer code, which is a revised and updated version of the ORIGEN documented i report ORNL-4628 (May 1973). Included here are: a brief description of the functions of ORIGEN2; a listing of the major data sources; a listing of the published documentation concerning ORIGEN2; and an outline of the ORIGEN2 output organization. ORIGEN2 is a available from the ORNL Radiation Shielding Information Center (RSIC). Past experience has indicated that many users encounter considerable difficulty in finding the desired information in ORIGEN2 output which is sometimes rather massive. This section is intended as a brief outline of the organization of ORIGEN2 output.

  1. PCU arrangement of a supercritical CO2 cooled micro modular reactor

    International Nuclear Information System (INIS)

    Kim, Seong Gu; Baik, Seungjoon; Cho, Seong Kuk; Oh, Bong Seong; Lee, Jeong Ik

    2016-01-01

    As part of the SMR(Small Modular Reactor)s development effort, the authors propose a concept of supercritical CO 2 (S-CO 2 ) cooled fast reactor combined with the S-CO 2 Brayton cycle. The reactor concept is named as KAIST Micro Modular Reactor (MMR). The S-CO 2 Brayton cycle has many strong points when it is used for SMR's power conversion unit. It occupies small footprints due to the compact cycle components and simple layout. Thus, a concept of one module containing the S-CO 2 cooled fast reactor and power conversion system is possible. This module can be shipped via ground transportation (by trailer) or marine transportation. In this study, the authors propose a new conceptual layout for the S-CO 2 cooled direct cycle while considering various issues for arranging cycle components. The new design has an improved cycle efficiency (from 31% to 34%) than the earlier version of MMR by reducing pressure drops in the heat exchangers. As a more efficient option, a recompression recuperated cycle was also designed. It improves 5% of thermal efficiency while 18tons of mass can be added in comparison to the simple recuperated cycle. Even if we adopt recompression cycle as a PCU, the weight of module (152tons) is less than the ground transportable limit (260tons)

  2. Communication: Hole localization in Al-doped quartz SiO{sub 2} within ab initio hybrid-functional DFT

    Energy Technology Data Exchange (ETDEWEB)

    Gerosa, Matteo [Department of Energy, Politecnico di Milano, via Ponzio 34/3, 20133 Milano (Italy); Di Valentin, Cristiana; Pacchioni, Gianfranco [Dipartimento di Scienza dei Materiali, Università di Milano-Bicocca, via R. Cozzi 55, 20125 Milan (Italy); Bottani, Carlo Enrico, E-mail: carlo.bottani@polimi.it [Department of Energy, Politecnico di Milano, via Ponzio 34/3, 20133 Milano (Italy); Center for Nano Science and Technology @Polimi, Istituto Italiano di Tecnologia, via Pascoli 70/3, 20133 Milano (Italy); Onida, Giovanni [Dipartimento di Fisica dell’ Universita’ degli Studi di Milano and European Theoretical Spectroscopy Facility (ETSF), Via Celoria 16, 20133 Milan (Italy)

    2015-09-21

    We investigate the long-standing problem of hole localization at the Al impurity in quartz SiO{sub 2}, using a relatively recent DFT hybrid-functional method in which the exchange fraction is obtained ab initio, based on an analogy with the static many-body COHSEX approximation to the electron self-energy. As the amount of the admixed exact exchange in hybrid functionals has been shown to be determinant for properly capturing the hole localization, this problem constitutes a prototypical benchmark for the accuracy of the method, allowing one to assess to what extent self-interaction effects are avoided. We obtain good results in terms of description of the charge localization and structural distortion around the Al center, improving with respect to the more popular B3LYP hybrid-functional approach. We also discuss the accuracy of computed hyperfine parameters, by comparison with previous calculations based on other self-interaction-free methods, as well as experimental values. We discuss and rationalize the limitations of our approach in computing defect-related excitation energies in low-dielectric-constant insulators.

  3. The Raman Spectrum of the Squarate (C4O4-2 Anion: An Ab Initio Basis Set Dependence Study

    Directory of Open Access Journals (Sweden)

    Miranda Sandro G. de

    2002-01-01

    Full Text Available The Raman excitation profile of the squarate anion, C4O4-2 , was calculated using ab initio methods at the Hartree-Fock using Linear Response Theory (LRT for six excitation frequencies: 632.5, 514.5, 488.0, 457.9, 363.8 and 337.1 nm. Five basis set functions (6-31G*, 6-31+G*, cc-pVDZ, aug-cc-pVDZ and Sadlej's polarizability basis set were investigated aiming to evaluate the performance of the 6-31G* set for numerical convergence and computational cost in relation to the larger basis sets. All basis sets reproduce the main spectroscopic features of the Raman spectrum of this anion for the excitation interval investigated. The 6-31G* basis set presented, on average, the same accuracy of numerical results as the larger sets but at a fraction of the computational cost showing that it is suitable for the theoretical investigation of the squarate dianion and its complexes and derivatives.

  4. Structure and electronic properties of the V 2O 3(0001) surface: ab initio density functional theory cluster studies

    Science.gov (United States)

    Czekaj, I.; Witko, M.; Hermann, K.

    2003-02-01

    Electronic properties of the V 2O 3(0001) surface are studied using ab initio density functional theory method. In addition, the nature of surface V-O bonding as well as the electronic states of the structurally different surface oxygen and vanadium sites are discussed and compared with bulk oxygen/vanadium centers. The (0001) surface of vanadium sesquioxide is modeled using clusters of different size where the three ideal bulk-terminated surfaces, denoted as VV 'O (terminated by a double layer of vanadium atoms), V 'OV (terminated by one layer of V atoms), and OVV ' (terminated by one layer of oxygen atoms), are considered. For these surface terminations electronic properties of various surface and bulk centers are discussed. The results confirm bonding in vanadium sesquioxide as a mixture of ionic and covalent characters. Further, charging of structurally non-equivalent surface vanadium and oxygen sites is found to increase with the corresponding coordination number. Large differences in charging between surface and bulk vanadium atoms are found. In addition, the strong interaction between neighboring vanadium ions are observed.

  5. Transfer of Cry1Ac and Cry2Ab proteins from genetically engineered Bt cotton to herbivores and predators.

    Science.gov (United States)

    Meissle, Michael; Romeis, Jörg

    2017-04-04

    With the cultivation of Bt cotton, the produced insecticidal Cry proteins are ingested by herbivores and potentially transferred along the food chain to natural enemies, such as predators. In laboratory experiments with Bollgard II cotton, concentrations of Cry1Ac and Cry2Ab were measured in Lepidoptera larvae (Spodoptera littoralis, Heliothis virescens), plant bugs (Euschistus heros), aphids (Aphis gossypii), whiteflies (Bemisia tabaci), thrips (Thrips tabaci, Frankliniella occidentalis), and spider mites (Tetranychus urticae). Tritrophic experiments were conducted with caterpillars of S. littoralis as prey and larvae of ladybird beetles (Harmonia axyridis, Adalia bipunctata) and lacewings (Chrysoperla carnea) as predators. Immunological measurements (ELISA) indicated that herbivores feeding on Bt cotton contained 5%-50% of the Bt protein concentrations in leaves except whiteflies and aphids, which contained no or only traces of Bt protein, and spider mites, which contained 7 times more Cry1Ac than leaves. Similarly, predators contained 1%-30% of the Cry protein concentration in prey. For the nontarget risk assessment, this indicates that Bt protein concentrations decrease considerably from one trophic level to the next in the food web, except for spider mites that contain Bt protein concentrations higher than those measured in the leaves. Exposure of phloem sucking hemipterans is negligible. © 2017 Institute of Zoology, Chinese Academy of Sciences.

  6. Ab initio studies of disorder in the full Heusler alloy Co2FexMn1-xSi

    Science.gov (United States)

    Hasnip, P. J.; Smith, J. H.; Lazarov, V. K.

    2013-05-01

    Co-based full Heusler alloys have been predicted to be half-metals, with 100% spin polarisation at the Fermi level, yet this has yet to be realised in practice. Heusler thin-films often exhibit a degree of atomic disorder, and this is believed to be one cause of the low magnetoresistance in Heusler-based spin valves' devices. We present an ab initio density functional theory + U investigation into the effect of disorder on the electronic properties of Co2Fe0.5Mn0.5Si. It is found that the half-metallicity depends strongly on the kind of disorder present, with low or even reversed spin-polarisation when the Co sublattice mixes with either the Fe/Mn or Si sublattice, but keeps the high spin polarisation when the Mn/Fe and Si sublattices are mixed. Calculations of the formation energy show that this latter kind of disorder is by far the most likely to occur, an encouraging result which means that it may not be necessary to produce perfectly ordered Heusler alloys in order to achieve 100% spin polarisation.

  7. Dissociation and recombination of D2 on Cu(111): Ab initio molecular dynamics calculations and improved analysis of desorption experiments

    Science.gov (United States)

    Nattino, Francesco; Genova, Alessandro; Guijt, Marieke; Muzas, Alberto S.; Díaz, Cristina; Auerbach, Daniel J.; Kroes, Geert-Jan

    2014-09-01

    Obtaining quantitative agreement between theory and experiment for dissociative adsorption of hydrogen on and associative desorption of hydrogen from Cu(111) remains challenging. Particularly troubling is the fact that theory gives values for the high energy limit to the dissociative adsorption probability that is as much as two times larger than experiment. In the present work we approach this discrepancy in three ways. First, we carry out a new analysis of the raw experimental data for D2 associatively desorbing from Cu(111). We also perform new ab initio molecular dynamics (AIMD) calculations that include effects of surface atom motion. Finally, we simulate time-of-flight (TOF) spectra from the theoretical reaction probability curves and we directly compare them to the raw experimental data. The results show that the use of more flexible functional forms for fitting the raw TOF spectra gives fits that are in slightly better agreement with the raw data and in considerably better agreement with theory, even though the theoretical reaction probabilities still achieve higher values at high energies. The mean absolute error (MAE) for the energy E0 at which the reaction probability equals half the experimental saturation value is now lower than 1 kcal/mol, the limit that defines chemical accuracy, while a MAE of 1.5 kcal/mol was previously obtained. The new AIMD results are only slightly different from the previous static surface results and in slightly better agreement with experiment.

  8. Ab initio and shell model studies of structural, thermoelastic and vibrational properties of SnO2 under pressure.

    Science.gov (United States)

    Casali, R A; Lasave, J; Caravaca, M A; Koval, S; Ponce, C A; Migoni, R L

    2013-04-03

    The pressure dependences of the structural, thermoelastic and vibrational properties of SnO2 in its rutile phase are studied, as well as the pressure-induced transition to a CaCl2-type phase. These studies have been performed by means of ab initio (AI) density functional theory calculations using the localized basis code SIESTA. The results are employed to develop a shell model (SM) for application in future studies of nanostructured SnO2. A good agreement of the SM results for the pressure dependences of the above properties with the ones obtained from present and previous AI calculations as well as from experiments is achieved. The transition is characterized by a rotation of the Sn-centered oxygen octahedra around the tetragonal axis through the Sn. This rotation breaks the tetragonal symmetry of the lattice and an orthorhombic distortion appears above the critical pressure P(c). A zone-center phonon of B1g symmetry in the rutile phase involves such rotation and softens on approaching Pc. It becomes an Ag mode which stabilizes with increasing pressure in the CaCl2 phase. This behavior, together with the softening of the shear modulus (C11-C12)/2 related to the orthorhombic distortion, allows a precise determination of a value for Pc. An additional determination is provided by the splitting of the basal plane lattice parameters. Both the AI and the experimentally observed softening of the B(1g) mode are incomplete, indicating a small discontinuity at the transition. However, all results show continuous changes in volume and lattice parameters, indicating a second-order transition. All these results indicate that there should be sufficient confidence for the future employment of the shell model.

  9. Ab initio localized basis set study of structural parameters and elastic properties of HfO{sub 2} polymorphs

    Energy Technology Data Exchange (ETDEWEB)

    Caravaca, M A [Facultad de Ingenieria, Universidad Nacional del Nordeste, Avenida Las Heras 727, 3500-Resistencia (Argentina); Casali, R A [Facultad de Ciencias Exactas y Naturales y Agrimensura, Universidad Nacional del Nordeste, Avenida Libertad, 5600-Corrientes (Argentina)

    2005-09-21

    The SIESTA approach based on pseudopotentials and a localized basis set is used to calculate the electronic, elastic and equilibrium properties of P 2{sub 1}/c, Pbca, Pnma, Fm3m, P4{sub 2}nmc and Pa3 phases of HfO{sub 2}. Using separable Troullier-Martins norm-conserving pseudopotentials which include partial core corrections for Hf, we tested important physical properties as a function of the basis set size, grid size and cut-off ratio of the pseudo-atomic orbitals (PAOs). We found that calculations in this oxide with the LDA approach and using a minimal basis set (simple zeta, SZ) improve calculated phase transition pressures with respect to the double-zeta basis set and LDA (DZ-LDA), and show similar accuracy to that determined with the PPPW and GGA approach. Still, the equilibrium volumes and structural properties calculated with SZ-LDA compare better with experiments than the GGA approach. The bandgaps and elastic and structural properties calculated with DZ-LDA are accurate in agreement with previous state of the art ab initio calculations and experimental evidence and cannot be improved with a polarized basis set. These calculated properties show low sensitivity to the PAO localization parameter range between 40 and 100 meV. However, this is not true for the relative energy, which improves upon decrease of the mentioned parameter. We found a non-linear behaviour in the lattice parameters with pressure in the P 2{sub 1}/c phase, showing a discontinuity of the derivative of the a lattice parameter with respect to external pressure, as found in experiments. The common enthalpy values calculated with the minimal basis set give pressure transitions of 3.3 and 10.8?GPa for P2{sub 1}/c {yields} Pbca and Pbca {yields} Pnma, respectively, in accordance with different high pressure experimental values.

  10. Ab initio and shell model studies of structural, thermoelastic and vibrational properties of SnO2 under pressure

    International Nuclear Information System (INIS)

    Casali, R A; Ponce, C A; Lasave, J; Koval, S; Migoni, R L; Caravaca, M A

    2013-01-01

    The pressure dependences of the structural, thermoelastic and vibrational properties of SnO 2 in its rutile phase are studied, as well as the pressure-induced transition to a CaCl 2 -type phase. These studies have been performed by means of ab initio (AI) density functional theory calculations using the localized basis code SIESTA. The results are employed to develop a shell model (SM) for application in future studies of nanostructured SnO 2 . A good agreement of the SM results for the pressure dependences of the above properties with the ones obtained from present and previous AI calculations as well as from experiments is achieved. The transition is characterized by a rotation of the Sn-centered oxygen octahedra around the tetragonal axis through the Sn. This rotation breaks the tetragonal symmetry of the lattice and an orthorhombic distortion appears above the critical pressure P c . A zone-center phonon of B 1g symmetry in the rutile phase involves such rotation and softens on approaching P c . It becomes an A g mode which stabilizes with increasing pressure in the CaCl 2 phase. This behavior, together with the softening of the shear modulus (C 11 −C 12 )/2 related to the orthorhombic distortion, allows a precise determination of a value for P c . An additional determination is provided by the splitting of the basal plane lattice parameters. Both the AI and the experimentally observed softening of the B 1g mode are incomplete, indicating a small discontinuity at the transition. However, all results show continuous changes in volume and lattice parameters, indicating a second-order transition. All these results indicate that there should be sufficient confidence for the future employment of the shell model. (paper)

  11. Ab initio localized basis set study of structural parameters and elastic properties of HfO2 polymorphs

    International Nuclear Information System (INIS)

    Caravaca, M A; Casali, R A

    2005-01-01

    The SIESTA approach based on pseudopotentials and a localized basis set is used to calculate the electronic, elastic and equilibrium properties of P 2 1 /c, Pbca, Pnma, Fm3m, P4 2 nmc and Pa3 phases of HfO 2 . Using separable Troullier-Martins norm-conserving pseudopotentials which include partial core corrections for Hf, we tested important physical properties as a function of the basis set size, grid size and cut-off ratio of the pseudo-atomic orbitals (PAOs). We found that calculations in this oxide with the LDA approach and using a minimal basis set (simple zeta, SZ) improve calculated phase transition pressures with respect to the double-zeta basis set and LDA (DZ-LDA), and show similar accuracy to that determined with the PPPW and GGA approach. Still, the equilibrium volumes and structural properties calculated with SZ-LDA compare better with experiments than the GGA approach. The bandgaps and elastic and structural properties calculated with DZ-LDA are accurate in agreement with previous state of the art ab initio calculations and experimental evidence and cannot be improved with a polarized basis set. These calculated properties show low sensitivity to the PAO localization parameter range between 40 and 100 meV. However, this is not true for the relative energy, which improves upon decrease of the mentioned parameter. We found a non-linear behaviour in the lattice parameters with pressure in the P 2 1 /c phase, showing a discontinuity of the derivative of the a lattice parameter with respect to external pressure, as found in experiments. The common enthalpy values calculated with the minimal basis set give pressure transitions of 3.3 and 10.8?GPa for P2 1 /c → Pbca and Pbca → Pnma, respectively, in accordance with different high pressure experimental values

  12. Adsorption of ethanol on V2O5 (010) surface for gas-sensing applications: Ab initio investigation

    International Nuclear Information System (INIS)

    Qin, Yuxiang; Cui, Mengyang; Ye, Zhenhua

    2016-01-01

    Highlights: • Ethanol adsorbed on V 2 O 5 (010) surface was investigated by ab initio calculations. • Ethanol prefers to adsorb on “Hill”-like surface, rather than“Valley”-like region. • Surface O 1(H) site plays a key role to dominate the ethanol adsorption process. • Sensing mechanism is related with electronic structure and electron redistribution. • Gas sensitivity is reflected by quantitative electron population analysis. - Abstract: The adsorption of ethanol on V 2 O 5 (010) surface was investigated by means of density functional theory (DFT) with a combined generalized gradient approximation (GGA) plus Hubbard U approach to exploit the potential sensing applications. The adsorption configurations were first constructed by considering different orientations of ethanol molecule to V and O sites on the “Hill”- and “Valley”-like regions of corrugated (010) surface. It is found that ethanol molecule can adsorb on whole surface in multiple stable configurations. Nevertheless the molecular adsorption on the “Hill”-like surface is calculated to occur preferentially, and the single coordinated oxygen on “Hill”-like surface (O 1(H) ) acting as the most energetically favorable adsorption site shows the strongest adsorption ability to ethanol molecule. Surface adsorption of ethanol tunes the electronic structure of V 2 O 5 and cause an n-doping effect. As a consequence, the Fermi levels shift toward the conductive bond increasing the charge carrier concentration of electrons in adsorbed V 2 O 5 . The sensitive electronic structure and the multiple stable configurations to ethanol adsorption highlight the high adsorption activity and then the potential of V 2 O 5 (010) surface applied to high sensitive sensor for ethanol vapor detection. Further Mulliken population and Natural bond orbital (NBO) calculations quantify the electron transfer from the adsorbed ethanol to the surface, and correlates the adsorption ability of surface sites

  13. Ab-initio Calculations of Electronic Properties of Calcium Fluoride (CaF2)

    Science.gov (United States)

    Bohara, Bir; Franklin, Lashounda; Malozovsky, Yuriy; Bagayoko, Diola

    We have performed first principle, local density approximation (LDA) calculations of electronic and related properties of cubic calcium fluorite (CaF2) . Our non-relativistic computations employed the Ceperley and Alder LDA potential and the linear combination of atomic orbitals (LCAO) formalism. The implementation of the LCAO formalism followed the Bagayoko, Zhao, and Williams (BZW) method, as enhanced by Ekuma and Franklin (BZW-EF). We discuss the electronic energy bands, including the large band gap, total and partial density of states, electron and hole effective masses, and the bulk modulus. Our calculated, indirect (X- Γ) band gap is 12.98 eV; it is 1 eV above an experimental value of 11.8 eV. The calculated bulk modulus (82.89 GPA) is excellent agreement with the experimental result of 82.0 +/-0.7. Our predicted equilibrium lattice constant is 5.42Å. Acknowledgments: This work is funded in part by the National Science Foundation (NSF) and the Louisiana Board of Regents, through LASiGMA [Award Nos. EPS- 1003897, NSF (2010-15)-RII-SUBR], and NSF HRD-1002541, the US Department of Energy, National, Nuclear Security Administration (NNSA) (Award No. DE-NA-0002630), LaSPACE, and LONI-SUBR.

  14. Status of IVO-FR2-Vg7 experiment for irradiation of fast reactor fuel rods

    International Nuclear Information System (INIS)

    Elbel, H.; Kummerer, K.; Bojarsky, K.; Lopez Jimenez, J.; Otero de la Gandara, J.L.

    1979-01-01

    Report on the Seminar celebrated in Madrid between KfK (Karlsruhe) and JEN (Madrid) concerning a Joint Irradiation Program of Fast Reactor Fuel Rods. The design of fuel rods in general is defined, and, in particular of those with a density 94% DT and diameter 7.6 mm up to a burn-up of 7% FIMA, to be irradiated in the FR2 Reactor (Karlsruhe). Together with the design of NaK and single-wall capsules used in this irradiation, other possibilities of irradiation in the reactor will also be described. (auth.)

  15. Keeping research reactors relevant: A pro-active approach for SLOWPOKE-2

    International Nuclear Information System (INIS)

    Cosby, L.R.; Bennett, L.G.I.; Nielsen, K.; Weir, R.

    2010-01-01

    The SLOWPOKE is a small, inherently safe, pool-type research reactor that was engineered and marketed by Atomic Energy of Canada Limited (AECL) in the 1970s and 80s. The original reactor, SLOWPOKE-1, was moved from Chalk River to the University of Toronto in 1970 and was operated until upgraded to the SLOWPOKE-2 reactor in 1973. In all, eight reactors in the two versions were produced and five are still in operation today, three having been decommissioned. All of the remaining reactors are designated as SLOWPOKE-2 reactors. These research reactors are prone to two major issues: aging components and lack of relevance to a younger audience. In order to combat these problems, one SLOWPOKE -2 facility has embraced a strategy that involves modernizing their reactor in order to keep the reactor up to date and relevant. In 2001, this facility replaced its aging analogue reactor control system with a digital control system. The system was successfully commissioned and has provided a renewed platform for student learning and research. The digital control system provides a better interface and allows flexibility in data storage and retrieval that was never possible with the analogue control system. This facility has started work on another upgrade to the digital control and instrumentation system that will be installed in 2010. The upgrade includes new computer hardware, updated software and a web-based simulation and training system that will allow licensed operators, students and researchers to use an online simulation tool for training, education and research. The tool consists of: 1) A dynamic simulation for reactor kinetics (e.g., core flux, power, core temperatures, etc). This tool is useful for operator training and student education; 2) Dynamic mapping of the reactor and pool container gamma and neutron fluxes as well as the vertical neutron beam tube flux. This research planning tool is used for various researchers who wish to do irradiations (e.g., neutron

  16. Caffeic acid production by simultaneous saccharification and fermentation of kraft pulp using recombinant Escherichia coli.

    Science.gov (United States)

    Kawaguchi, Hideo; Katsuyama, Yohei; Danyao, Du; Kahar, Prihardi; Nakamura-Tsuruta, Sachiko; Teramura, Hiroshi; Wakai, Keiko; Yoshihara, Kumiko; Minami, Hiromichi; Ogino, Chiaki; Ohnishi, Yasuo; Kondo, Ahikiko

    2017-07-01

    Caffeic acid (3,4-dihydroxycinnamic acid) serves as a building block for thermoplastics and a precursor for biologically active compounds and was recently produced from glucose by microbial fermentation. To produce caffeic acid from inedible cellulose, separate hydrolysis and fermentation (SHF) and simultaneous saccharification and fermentation (SSF) reactions were compared using kraft pulp as lignocellulosic feedstock. Here, a tyrosine-overproducing Escherichia coli strain was metabolically engineered to produce caffeic acid from glucose by introducing the genes encoding a 4-hydroxyphenyllactate 3-hydroxylase (hpaBC) from Pseudomonas aeruginosa and tyrosine ammonia lyase (fevV) from Streptomyces sp. WK-5344. Using the resulting recombinant strain, the maximum yield of caffeic acid in SSF (233 mg/L) far exceeded that by SHF (37.9 mg/L). In the SSF with low cellulase loads (≤2.5 filter paper unit/g glucan), caffeic acid production was markedly increased, while almost no glucose accumulation was detected, indicating that the E. coli cells experienced glucose limitation in this culture condition. Caffeic acid yield was also negatively correlated with the glucose concentration in the fermentation medium. In SHF, the formation of by-product acetate and the accumulation of potential fermentation inhibitors increased significantly with kraft pulp hydrolysate than filter paper hydrolysate. The combination of these inhibitors had synergistic effects on caffeic acid fermentation at low concentrations. With lower loads of cellulase in SSF, less potential fermentation inhibitors (furfural, 5-hydroxymethyfurfural, and 4-hydroxylbenzoic acid) accumulated in the medium. These observations suggest that glucose limitation in SSF is crucial for improving caffeic acid yield, owing to reduced by-product formation and fermentation inhibitor accumulation.

  17. COSTANZA, 1-D 2 Group Space-Dependent Reactor Dynamics of Spatial Reactor with 1 Group Delayed Neutrons

    International Nuclear Information System (INIS)

    Agazzi, A.; Gavazzi, C.; Vincenti, E.; Monterosso, R.

    1964-01-01

    1 - Nature of physical problem solved: The programme studies the spatial dynamics of reactor TESI, in the two group and one space dimension approximation. Only one group of delayed neutrons is considered. The programme simulates the vertical movement of the control rods according to any given movement law. The programme calculates the evolution of the fluxes and temperature and precursor concentration in space and time during the power excursion. 2 - Restrictions on the complexity of the problem: The maximum number of lattice points is 100

  18. Irradiated graphite studies prior to decommissioning of G1, G2 and G3 reactors

    International Nuclear Information System (INIS)

    Bonal, J.P.; Vistoli, J.Ph.; Combes, C.

    2005-01-01

    G1 (46 MW th ), G2 (250 MW th ) and G3 (250 MW th ) are the first French plutonium production reactors owned by CEA (Commissariat a l'Energie Atomique). They started to be operated in 1956 (G1), 1959 (G2) and 1960 (G3); their final shutdown occurred in 1968, 1980 and 1984 respectively. Each reactor used about 1200 tons of graphite as moderator, moreover in G2 and G3, a 95 tons graphite wall is used to shield the rear side concrete from neutron irradiation. G1 is an air cooled reactor operated at a graphite temperature ranging from 30 C to 230 C; G2 and G3 are CO 2 cooled reactors and during operation the graphite temperature is higher (140 C to 400 C). These reactors are now partly decommissioned, but the graphite stacks are still inside the reactors. The graphite core radioactivity has decreased enough so that a full decommissioning stage may be considered. Conceming this decommissioning, the studies reported here are: (i) stored energy in graphite, (ii) graphite radioactivity measurements, (iii) leaching of radionuclide ( 14 C, 36 Cl, 63 Ni, 60 Co, 3 H) from graphite, (iv) chlorine diffusion through graphite. (authors)

  19. Fourier transform infrared and FT-Raman spectra, assignment, ab initio, DFT and normal co-ordinate analysis of 2-chloro-4-methylaniline and 2-chloro-6-methylaniline.

    Science.gov (United States)

    Arjunan, V; Mohan, S

    2009-03-01

    The Fourier transform infrared (FTIR) and FT-Raman spectra of 2-chloro-4-methylaniline and 2-chloro-6-methylaniline have been measured in the range 4000-400 and 4000-100cm(-1), respectively. Utilising the observed FTIR and FT-Raman data, a complete vibrational assignment and analysis of the fundamental modes of the compounds were carried out. The vibrational frequency which were determined experimentally are compared with those obtained theoretically from ab initio HF and DFT gradient calculations employing the HF/6-31G(d,p) and B3LYP/6-31G(d,p) methods for optimised geometries. The geometries and normal modes of vibration obtained from the HF and DFT methods are in good agreement with the experimental data. The normal co-ordinate analysis was also carried out on the basis of ab initio force fields utilising Wilson's FG matrix method. The manifestations of NH-pi interactions and the influence of bulky chlorine and methyl group on the vibrational modes of the amino group are investigated.

  20. Accurate ab initio potential energy surface, thermochemistry, and dynamics of the Br(2P, 2P(3∕2)) + CH4 → HBr + CH3 reaction.

    Science.gov (United States)

    Czakó, Gábor

    2013-04-07

    Chemically accurate full-dimensional non-spin-orbit and spin-orbit (SO) ground-state potential energy surfaces (PESs) are obtained for the Br + CH4 → HBr + CH3 reaction by fitting 21 574 composite ab initio energy points. The composite method considers electron correlation methods up to CCSD(T), basis sets up to aug-cc-pwCVTZ-PP, correlation of the core electrons, scalar relativistic effects via an effective core potential (ECP), and SO corrections, thereby achieving an accuracy better than 0.5 kcal∕mol. Benchmark structures and relative energies are computed for the stationary points using the ab initio focal-point analysis (FPA) scheme based on both ECP and Douglas-Kroll approaches providing all-electron relativistic CCSDT(Q)∕complete-basis-set quality energies. The PESs accurately describe the saddle point of the abstraction reaction and the van der Waals complexes in the entrance and product channels. The SO-corrected PES provides a classical barrier height of 7285(7232 ± 50) cm(-1), De values of 867(799 ± 10) and 399(344 ± 10) cm(-1) for the complexes CH3-HBr and CH3-BrH, respectively, and reaction endothermicity of 7867(7857 ± 50) cm(-1), in excellent agreement with the new, FPA-based benchmark data shown in parentheses. The difference between the Br + CH4 asymptotes of the non-SO and SO PESs is 1240 cm(-1), in good agreement with the experiment (1228 cm(-1)). Quasiclassical trajectory calculations based on more than 13 million trajectories for the late-barrier Br + CH4(vk = 0, 1) [k = 1, 2, 3, 4] reactions show that the vibrational energy, especially the excitation of the stretching modes, activates the reaction much more efficiently than translational energy, in agreement with the extended Polanyi rules. Angular distributions show dominant backward scattering for the ground-state reaction and forward scattering for the stretching-excited reactions. The reactivity on the non-SO PES is about 3-5 times larger than that on the SO PES in a wide

  1. Estimation of power feedback parameters of the IBR-2M reactor by square wave reactivity

    International Nuclear Information System (INIS)

    Pepelyshev, Yu.N.; Popov, A.K.; Sumkhuu, D.

    2016-01-01

    Parameters of the IBR-2M reactor power feedback (PFB) are estimated based on the analysis of power transients caused by deliberate square wave reactivity when the pulsed reactor operates in the self-regulation mode. The PFB of the IBR-2M is described by three linear first-order differential equations. Two components of the PFB are responsible for the negative feedback and one, for the positive. The overall feedback is negative, i.e., it has a stabilizing effect for the operation of the reactor. The slowest negative component of the PFB is probably caused by heating of the fuel. Periodically repeated in the process of exploitation, estimation of the PFB parameters is one of the methods to ensure safety operation of the reactor. [ru

  2. Ab initio MO calculations on the Structure and Raman and Infrared Spectra of the [Al4O2Cl10]2- oxide species in chloroaluminate melts

    DEFF Research Database (Denmark)

    Berg, Rolf W.

    2007-01-01

    system of staggered (approximate D3d symmetry), in analogy with the linear Al-O-Al geometry of the analogous [Al2OF6]2- ion, found previously. The calculations included determination of the vibrational harmonic normal modes and the infrared and Raman spectra, (vibrational band wavenumbers and intensities......), without any empiric adjustments of the harmonic force constants, using constants directly predicted from the Gaussian 03W program. Previously obtained IR absorption and Raman scattering spectra of melts are assigned, by comparing to the ab initio quantum mechanical vibrational analysis results....... It is concluded that the small oxide content commonly found in basic and neutral tetrachloroaluminate melts, most probably consist of [Al4O2Cl10]2- ions and the vibrational spectra are given....

  3. Magnetic and electronic properties of double perovskite Lu2MnCoO6: Ab-initio calculations and Monte Carlo simulation

    Science.gov (United States)

    Sidi Ahmed, S.; Boujnah, M.; Bahmad, L.; Benyoussef, A.; El Kenz, A.

    2017-10-01

    The magnetic and electronic properties of the double perovskite Lu2MnCoO6 are studied by combining the ab-initio calculations and Monte Carlo simulation (MCs) based on the Ising model. This compound is constituted of two magnetic cubic sublattices: one occupied by Mn4+ with spin (s = 3/2) and other occupied by Co2+ with spin (σ = 3/2). By using ab-initio calculations we compute the exchange coupling between Mn-Co sublattices. We also investigate the phase transitions and the magnetic stability of this compound. The Curie temperature is determined as well as the critical exponents. We show that the Lu2MnCoO6 compound belongs to the 3D-Ising universality class.

  4. Synergistic Water-Treatment Reactors Using a TiO2-Modified Ti-Mesh Filter

    Directory of Open Access Journals (Sweden)

    Akira Fujishima

    2013-07-01

    Full Text Available The recent applications of a TiO2-modified Ti-mesh filter (TMiP™ for water purification are summarized with newly collected data including biological assays as well as sewage water treatment. The water purification reactors consist of the combination of a TMiP, a UV lamp, an excimer VUV lamp, and an ozonation unit. The water purification abilities of the reactor were evaluated by decomposition of organic contaminants, inactivation of waterborne pathogens, and treatment efficiency for sewage water. The UV-C/TMiP/O3 reactor disinfected E. coli in aqueous suspension in approximately 1 min completely, and also decreased the number of E. coli in sewage water in 15 min dramatically. The observed rate constants of 7.5 L/min and 1.3 L/min were calculated by pseudo-first-order kinetic analysis respectively. Although organic substances in sewage water were supposed to prevent the UV-C/TMiP/O3 reactor from purifying water, the reactor reduced E. coli in sewage water continuously. On the other hand, although much higher efficiencies for decomposition of organic pollutants in water were achieved in the excimer/TMiP reactor, the disinfection activity of the reactor for waterborne pathogens was not as effective as the other reactors. The difference of efficiency between organic pollutants and waterborne pathogens in the excimer/TMiP reactor may be due to the size, the structure, and the decomposition mechanism of the organic pollutants and waterborne pathogens. These results show that a suitable system assisted by synergy of photocatalysts and other technologies such as ozonation has a huge potential as a practical wastewater purification system.

  5. Synergistic Water-Treatment Reactors Using a TiO2-Modified Ti-Mesh Filter

    OpenAIRE

    Akira Fujishima; Yuko Morito; Masahiko Ikekita; Tomonori Suzuki; Masayuki Hara; Yasuhiro Nojima; Ryuichi Nakano; Kazuya Nakata; Shoko Tago; Ken Masuko; Tsuyoshi Ochiai

    2013-01-01

    The recent applications of a TiO2-modified Ti-mesh filter (TMiP™) for water purification are summarized with newly collected data including biological assays as well as sewage water treatment. The water purification reactors consist of the combination of a TMiP, a UV lamp, an excimer VUV lamp, and an ozonation unit. The water purification abilities of the reactor were evaluated by decomposition of organic contaminants, inactivation of waterborne pathogens, and treatment efficiency for sewage ...

  6. Structural and vibrational study of 2-MethoxyEthylAmmonium Nitrate (2-OMeEAN): Interpretation of experimental results with ab initio molecular dynamics

    International Nuclear Information System (INIS)

    Campetella, M.; Caminiti, R.; Bencivenni, L.; Gontrani, L.; Bovi, D.; Guidoni, L.

    2016-01-01

    In this work we report an analysis of the bulk phase of 2-methoxyethylammonium nitrate based on ab initio molecular dynamics. The structural and dynamical features of the ionic liquid have been characterized and the computational findings have been compared with the experimental X-ray diffraction patterns, with infrared spectroscopy data, and with the results obtained from molecular dynamics simulations. The experimental infrared spectrum was interpreted with the support of calculated vibrational density of states as well as harmonic frequency calculations of selected gas phase clusters. Particular attention was addressed to the high frequency region of the cation (ω > 2000 cm −1 ), where the vibrational motions involve the NH 3 + group responsible for hydrogen bond formation, and to the frequency range 1200-1400 cm −1 where the antisymmetric stretching mode (ν 3 ) of nitrate is found. Its multiple absorption lines in the liquid arise from the removal of the degeneracy present in the D 3h symmetry of the isolated ion. Our ab initio molecular dynamics leads to a rationalization of the frequency shifts and splittings, which are inextricably related to the structural modifications induced by a hydrogen bonding environment. The DFT calculations lead to an inhomogeneous environment.

  7. Structural and vibrational study of 2-MethoxyEthylAmmonium Nitrate (2-OMeEAN): Interpretation of experimental results with ab initio molecular dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Campetella, M.; Caminiti, R.; Bencivenni, L.; Gontrani, L., E-mail: lorenzo.gontrani@uniroma1.it [Dipartimento di Chimica, Università di Roma, “La Sapienza,” P. le Aldo Moro 5, I-00185 Roma (Italy); Bovi, D. [Dipartimento di Fisica, Università di Roma, “La Sapienza,” P. le Aldo Moro 5, I-00185 Roma (Italy); Guidoni, L. [Dipartimento di Scienze Fisiche e Chimiche, Università degli Studi dell’Aquila, Via Vetoio, Coppito, I-67100 L’Aquila (Italy)

    2016-07-14

    In this work we report an analysis of the bulk phase of 2-methoxyethylammonium nitrate based on ab initio molecular dynamics. The structural and dynamical features of the ionic liquid have been characterized and the computational findings have been compared with the experimental X-ray diffraction patterns, with infrared spectroscopy data, and with the results obtained from molecular dynamics simulations. The experimental infrared spectrum was interpreted with the support of calculated vibrational density of states as well as harmonic frequency calculations of selected gas phase clusters. Particular attention was addressed to the high frequency region of the cation (ω > 2000 cm{sup −1}), where the vibrational motions involve the NH{sub 3}+ group responsible for hydrogen bond formation, and to the frequency range 1200-1400 cm{sup −1} where the antisymmetric stretching mode (ν{sub 3}) of nitrate is found. Its multiple absorption lines in the liquid arise from the removal of the degeneracy present in the D{sub 3h} symmetry of the isolated ion. Our ab initio molecular dynamics leads to a rationalization of the frequency shifts and splittings, which are inextricably related to the structural modifications induced by a hydrogen bonding environment. The DFT calculations lead to an inhomogeneous environment.

  8. Nordic study on reactor waste. Technical part 1 and 2

    International Nuclear Information System (INIS)

    1981-08-01

    An important part of the Nordic studies on system- and safety analysis of the management of low and medium level radioactive waste from nuclear power plants, is the safety analysis of a Reference System. This reference system was established within the study and is described in this Technical Part 1. The reference system covers waste management Schemes that are potential possibilities in either one of the four participating Nordic countries. The reference system is based on: a power reactor system consisting of 6 BWR's of 500 MWe each, operated simultaneously over the same 30 year period, and deep bed granular ion exchange resin wastes from the Reactor Water Clean-Up System (RWCS and powdered ion exchange resin from the Spent Fuel Pool Cleanup System (SFPCS)). Both waste types are supposed to be solidified by mixing with cement and bitumen. Two basic types of containers are considered. Standard 200 liter steel drums and specially made cubicreinforced concrete moulds with a net volume of 1 m 3 . The Nordic study assumes temporary storage of the solidified waste for a maximum of 50 years before the waste is transferred to the disposal site. Transportation of the waste from the storage facilitiy to the disposal site will be by road or sea. Three different disposal facilities are considered: Shallow land burial, near surface concrete bunker, and rock cavern with about 30 m granite cover. (EG)

  9. Alteration of reactor installation (alteration of No.1, No.2 and No.5 reactor facilities) in Kashiwazaki-Kariwa Nuclear Power Station, Tokyo Electric Power Co., Inc. (Report)

    International Nuclear Information System (INIS)

    1988-01-01

    The Nuclear Safety Commission presented the report to the Minister of International Trade and Industry on this alteration, on which the inguiry was made on July 17, 1987, after the prudent investigation and deliberation. The technical capability of the applicant was recognized as appropriate as the result of examination. It was judged that the safety after this alteration of reactor facilities can be ensured, as the result of examination. The main items of investigation were as follows: the safety related to the removal of leak control system from main steam isolation valves of No.2 and No.5 reactors, the safety related to the change of the number of relief safety valves of No.2 and No.5 reactors from 18 to 15, the safety related to the change of residual heat removal system of No.2 and No.5 reactors, the safety related to the change of power source for neutron flux monitors and reactor emergency shutdown system circuits of No.2 and No.5 reactors, the safety related to the change of liquid waste treatment system of No.5 reactor, the effect of incinerating spent resin to the environment, and the analysis of abnormal transient change during operation. (Kako, I.)

  10. Theoretical studies of H2--H2 collisions. II. Scattering and transport cross sections of hydrogen at low energies: Tests of a new ab initio vibrotor potential

    International Nuclear Information System (INIS)

    Close-coupled calculations of scattering amplitudes have been carried out for H 2 --H 2 collisions for a new ab initio potential energy surface, treating the hydrogen molecules as true vibrotors. The amplitudes were inserted into the kinetic theory expressions for integral and transport cross sections and used to compute (1) the elastic scattering of (j=0, v=0) para-hydrogen for relative velocities between 1000 and 2500 m/sec; (2) the viscosity differences of ortho- and para-hydrogen for temperatures less than 25 0 K; and (3) the thermal diffusion ratio of ortho- and para-hydrogen for temperatures between 50 and 150 0 K. The agreement with experiment is highly satisfactory and provides a thoroughgoing test of the new potential energy surface

  11. Vahur Kraft kraamis eile oma sahtlid Eesti Pangas tühjaks / Urmas Tooming

    Index Scriptorium Estoniae

    Tooming, Urmas

    2005-01-01

    6. juunil oli Vahur Krafti viimane tööpäev Eesti Panga presidendina. Lisad: CV; Keskpanga ekspresident Vahur Kraft juhtis 10 aastat Eesti pangandust. Kommenteerivad Eesti Panga endine asepresident Heldur Meerits ja endine Hansapanga juht Indrek Neivelt

  12. Bioconversion of oxygen-pretreated Kraft lignin to microbial lipid with oleaginous Rhodococcus opacus DSM 1069

    Energy Technology Data Exchange (ETDEWEB)

    Wei, Zhen [Hunan Univ. Changsha (China); Zeng, Guangming [Hunan Univ. Changsha (China); Huang, Fang [Georgia Inst. of Technology, Atlanta, GA (United States); Kosa, Matyas [Georgia Inst. of Technology, Atlanta, GA (United States); Huang, Danlian [Hunan Univ. Changsha (China); Ragauskas, Arthur J. [Georgia Inst. of Technology, Atlanta, GA (United States); Univ. of Tennessee, Knoxville, TN (United States)

    2015-04-09

    Kraft lignin (KL) from black liquor is an abundantly available, inexpensive aromatic resource that is regarded as a low value compound by the pulp and paper industry, necessitating the development of new applications.

  13. Removal of COD and color loads in bleached kraft pulp effluents by bottom ashes from boilers.

    Science.gov (United States)

    Van Tran, A

    2008-07-01

    The effectiveness of the bottom ashes from biomass and coal-fired boilers in removing chemical oxygen demand (COD) and colorloads in effluents of a kraft pulp bleachery plant is investigated. The effluents tested are those of the sulfuric acid treatment (A stage) of a hardwood kraft pulp, and of the first acidic (chlorine or chlorine dioxide) and second alkaline (extraction) stages in the chlorine and elemental chlorine-free (ECF) bleaching lines of hardwood and softwood kraft pulps. The coal-fired boiler's bottom ashes are unable to remove either COD or color load in the bleached kraft pulp effluents. However, the bottom ashes of the biomass boiler are effective in removing COD and color loads of the acidic and alkaline effluents irrespective of the bleaching process or wood species. In particular, these ashes increase the pH of all the effluents examined.

  14. The Kraft Pulp And Paper Properties of Sweet Sorghum Bagasse (Sorghum bicolor L Moench

    Directory of Open Access Journals (Sweden)

    Widya Fatriasari

    2015-05-01

    Full Text Available This study investigated the potency of sweet sorghum (Sorghum bicolor bagasse as raw material for pulp and paper using kraft pulping. The effects of alkali and sulfidity loading on kraft pulp and paper properties were also investigated. The pulping condition of the kraft pulp consisted of three levels of alkali loading (17, 19 and 22% and sulfidity loading (20, 22 and 24%. The maximum cooking temperature was 170°C for 4 h with a liquid to wood ratio of 10:1. Kraft pulping of this Numbu bagasse produced good pulp indicated by high screen yield and delignification selectivity with a low Kappa number (< 10. The unbleached pulp sheet produced a superior brightness level and a high burst index. The increase of active alkali loading tended to produce a negative effect on the pulp yield, Kappa number and paper sheet properties. Therefore, it is suggested to use a lower active alkaline concentration.

  15. Jens Kraft og "De vilde Folk" (1760) - manden, forfatterskbet, værket

    DEFF Research Database (Denmark)

    Langkjær, Michael Alexander

    2000-01-01

    that all cultures have passed through similar stages of development? C. What contemporary intellectual and institutional circumstances in Denmark and what personal motives might have induced Kraft to write a secular history of human development? In attempting to answere these and other questions, I put......Jens Kraft and his Brief Account of the Principal Institutions, Customs and Ideas of the Savage Peoples, to Inform about the General Origins and Development of Humanity, Sorø, 1760 - The man, his writings, his book. The present dissertation presents some results of my research on Jens Kraft...... Norse peoples, thus offering an explanation of the general development of human culture: how it originates, and, more importantly, why, in some cases it did not progress beyond a certain level. Kraft shows that man's natural mode of development is a slow, uncertain process, quickened only...

  16. Precipitation and characterisation of lignin obtained from South African kraft mill black liquor

    CSIR Research Space (South Africa)

    Namane, M

    2014-07-01

    Full Text Available International Conference on Chemical Thermodynamics and South African Institution of Chemical Engineering Conference, Durban, South Africa, 27 July - 1 August 2014 Precipitation and characterisation of lignin obtained from South African kraft mill black...

  17. Application of thermoalkalophilic xylanase from Arthrobacter sp. MTCC 5214 in biobleaching of kraft pulp

    Digital Repository Service at National Institute of Oceanography (India)

    Khandeparker, R.; Bhosle, N.B.

    released by enzyme treatment showed a characteristic peak at 280 nm indicating the presence of lignin in the released coloring matter. Enzymatic prebleaching of kraft pulp showed 20 % reduction in kappa number of the pulp without much change in viscosity...

  18. Flux measurements in the LEU refueled Slowpoke-2 reactor of Ecole Polytechnique de Montreal

    Energy Technology Data Exchange (ETDEWEB)

    EL Hajjaji, O.; Kennedy, G.; Rozon, D. [Ecole Polytechnique de Montreal, Quebec (Canada). Institut de Genie Nucleaire]. E-mail: elhajj@meca.polymtl.ca

    1998-07-01

    The HEU (93%) SLOWPOKE-2 reactor of Ecole Polytechnique de Montreal was refueled in September 1997 with (20%) LEU fuel after twenty years of operation. Upon completion of refueling the thermal and epithermal neutron fluxes were measured at four radii in the new core by irradiating gold and copper wire at 20 W for 10 minutes. These flux profiles were normalized to the values measured in an irradiation site in the beryllium reflector. We have also used the DRAGON/DONJON chain of codes and a detailed SLOWPOKE reactor model to calculate the flux distribution in the core and in the irradiation site. The calculated flux profiles along the four vertical lines are in agreement with the experimental values. This work also enable us to validate our codes, normally used for power reactors, for a low power research reactor. (author)

  19. Flux measurements in the LEU refueled Slowpoke-2 reactor of Ecole Polytechnique de Montreal

    International Nuclear Information System (INIS)

    EL Hajjaji, O.; Kennedy, G.; Rozon, D.

    1998-01-01

    The HEU (93%) SLOWPOKE-2 reactor of Ecole Polytechnique de Montreal was refueled in September 1997 with (20%) LEU fuel after twenty years of operation. Upon completion of refueling the thermal and epithermal neutron fluxes were measured at four radii in the new core by irradiating gold and copper wire at 20 W for 10 minutes. These flux profiles were normalized to the values measured in an irradiation site in the beryllium reflector. We have also used the DRAGON/DONJON chain of codes and a detailed SLOWPOKE reactor model to calculate the flux distribution in the core and in the irradiation site. The calculated flux profiles along the four vertical lines are in agreement with the experimental values. This work also enable us to validate our codes, normally used for power reactors, for a low power research reactor. (author)

  20. Irradiation embrittlement of reactor pressure vessel steel outside the astm specification A508 CL2

    Science.gov (United States)

    Pachur, D.; Krawczynski, S. J.; Derz, H.; Pott, G.

    1990-04-01

    Radiation embrittlement of reactor pressure vessel steels is of considerable significance for safety engineering. Steel manufacturers must therefore comply with specifications defined by national design codes. The extent to which a steel deviating from the specification is influenced by irradiation is being examined under the German Research Programme on the Integrity of Reactor Components. Charpy-V specimens were taken from a forged steel block longitudinally and vertically to the direction of main deformation and irradiated in the FRJ-1 research reactor at a temperature of 288 °C corresponding to the operating temperature of power reactors. The neutron fluences obtained ranged between 0.8 × 10 19 and 8 × 10 19n/ cm2. Instrumented pendulum impact tests have been evaluated and the load signals measured were analysed, fitting and calculating transition temperature curves and trend curves.

  1. Economics and utilization of thorium in nuclear reactors. Technical annexes 1 and 2

    Energy Technology Data Exchange (ETDEWEB)

    1978-05-01

    An assessment of the impact of utilizing the /sup 233/U/thorium fuel cycle in the U.S. nuclear economy is strongly dependent upon several decisions involving nuclear energy policy. These decisions include: (1) to recycle or not recycle fissile material; (2) if fissile material is recycled, to recycle plutonium, /sup 233/U, or both; and (3) to deploy or not to deploy advanced reactor designs such as Fast Breeder Reactors (FBR's), High Temperature Gas Reactors (HTGR's), and Canadian Deuterium Uranium Reactors (CANDU's). This report examines the role of thorium in the context of the above policy decisions while focusing special attention on economics and resource utilization.

  2. Treatment of snake envenomations by a new polyvalent antivenom composed of highly purified F(ab')2 : results of a clinical trial in northern Cameroon

    OpenAIRE

    Chippaux, Jean-Philippe; Lang, J.; Amadi-Eddine, S.; Fagot, P.; Le Mener, V.

    1999-01-01

    A clinical trail was conducted in 2 health centers in northern Cameroon to assess the safety and efficacy of a new polyvalent antivenom composed of higly purified and pasteurized F(ab')2 (FAV-Africa). Forty-six patients with objective signs of envenomation, including 67% with hemorrhage, were included in the study. Each patient received at least 20 ml of FAV-Africa by direct, slow intravenous injection ; 172 10-ml ampules were administered. All patients were clinically cured after treatment. ...

  3. Study on the Modification of Bleached Eucalyptus Kraft Pulp Using Birch Xylan

    Science.gov (United States)

    Wenjia Han; Chuanshan Zhao; Thomas Elder; Rendang Yang; Dongho Kim; Yunqiao Pu; Jeffery Hsieh; Arthur J. Ragauskas

    2012-01-01

    In this study, birch xylan was deposited onto elementally chlorine free (ECF) bleached eucalyptus kraft pulp, and the corresponding changes in physical properties were determined. An aqueous 5% birch xylan solution at pH 9 was added to 5 wt% slurry of bleached kraft eucalyptus fibers, with stirring at 70 C for 15 min after which the pH was adjusted to 5–6. The xylan...

  4. [Comparison of the clinical performance of the ECLusys HIV combi assay with the Lumipulse f and HISCL 2000-i HIV-1/2 ab screening assays].

    Science.gov (United States)

    Sugiura, Aya; Iwahara, Kunihiro; Suga, Yasuyuki; Uchiyama, Sachinori; Maekawa, Masato

    2012-04-01

    We compared the ECLusys HIV combi assay (ECL HIV Ag/Ab) to the Lumipulse Forte (LPf HIV 1/2 Ab) and HISCL (HIS HIV 1/2 Ab) assays. In a dilution sensitivity test using dilution panels of WHO HIV antibody international reference panel (HIV-1 Subtype A, B, C, E, HIV-1 Group O, HIV-2) and HIV-1/2 Ab CE marked material(HIV-1, HIV-2) parent specimens, the ECL assay enabled detection at a higher level of sensitivity than either the LPf assay or the HIS assay for all dilution panels. In an early detection test in the early phase of infection in which a BBI HIV seroconversion panel was used, the ECL assay enabled detection 7 days after initial blood sample collection, whereas the LPf and HIS assays enabled detection after 27 days. In a specificity test using high RF positive specimens (n=33), pregnancy specimens (n=35), cytomegalovirus antibody positive specimens (n=36), and high M protein positive specimens (n=21) that were confirmed negative for HIV-1/2 antibodies by the LPf assay, negative results were obtained for all specimens on both the ECL assay and the HIS assay. In a correlation test using routinely collected clinical specimens (n=121), including positive stock specimens, the ECL and HIS assays demonstrated the highest agreement rate 98.3%. The above results confirmed that the fourth-generation reagent ECL assay, which simultaneously detects both HIV-1/2 antibodies and p24 antigens, is both highly sensitive and specific, and is a suitable assay for use in routine testing.

  5. Magnetic anisotropy and spin fluctuations in the paramagnetic dimer [Fe(OMe)(dpm)2]2: Moessbauer spectroscopy and ab initio calculations

    International Nuclear Information System (INIS)

    Cianchi, L.; Del Giallo, F.; Moretti, P.; Spina, G.; Mancini, M.; Caneschi, A.; Lantieri, M.

    2008-01-01

    The magnetic anisotropy and the spin fluctuations of the paramagnetic molecule [Fe(OMe)(dpm) 2 ] 2 are analyzed by means of Moessbauer spectroscopy in the temperature range [7.6-33] K. Spectra in the presence of a 5 T magnetic field directed along the γ rays were collected, by using a sample of pseudo-single crystal prepared by oriented grains. From the fits of the spectra, the hyperfine parameters are determined. Fits give also the value and direction of the magnetic anisotropy, referred to the electric field gradient (EFG) principal axes. The latter, together with the EFG components, were evaluated by means of ROHF ab initio calculations. Lastly, the rate of the spin transitions in function of T is discussed

  6. Materials characterization for advanced pressurized water reactors: Pt. 2

    International Nuclear Information System (INIS)

    Little, E.A.; Gage, G.

    1994-01-01

    A compilation and overview is presented of the experimental techniques available for characterization of the microstructural changes induced by neutron irradiation of PWR pressure vessel steels, and directed towards monitoring of embrittlement processes by examination of surveillance samples from advanced reactor systems. The microstructural features of significance include copper precipitation, dislocation loop and/or microvoid matrix damage and grain boundary solute segregation. The techniques of transmission electron microscopy, field-emission gun scanning transmission electron microscopy, small angle neutron scattering, positron annihilation and field-ion microscopy have all developed to a degree of sophistication such that they are capable of providing detailed microstructural information in these areas, and afford considerable insight into embrittlement processes when used in combination. (author)

  7. Decommissioning plan for Tammuz-2 research reactor in Iraq

    International Nuclear Information System (INIS)

    Ahmed, A. A.; Jasim, H. I.

    2012-12-01

    For nuclear facilities, decommissioning is the final phase in the life cycle after sitting, design, construction, commissioning and operation. It is a process involving operations such as decontamination, dismantling of plant equipment of result in materials. All these activities take into account health and safety requirements for operating personnel and the general public, and any implications for the environment. (1) In several projects to decommission various type of nuclear facilities, it has been shown that technical methods and equipment are available today to dismantle safely nuclear facilities, of whatever type or size. Much experience in the use of these techniques has the decommissioning of prototype, demonstration, and small power reactors or other nuclear facilities. In Iraq these activities will be done by the cooperation with (IAEA) International Atomic Energy Agency and the other national regulatory bodies such as (IRSRA) Iraqi Radioactive Sources Regulatory Authority, and (RPC/MoEn) Radiation Protection Center/ Ministry of Environment in Iraq. (Author)

  8. Radioimmunoscintigraphy using {sup 99m}Tc-anti-CEA F(ab's){sub 2} fragment in rectal cancer and a pilot study for radioimmunoguided surgery

    Energy Technology Data Exchange (ETDEWEB)

    Ryu, Jin Sook; Kim, Jin Choen; Kim, Chang Nam; Gong, Gyung Yub; Lee, Hee Kyung [Ulsan Univ. College of Medicine, Seoul (Korea, Republic of)

    2000-06-01

    This prospective study was performed to evaluate the usefulness of preoperative radioimmunoscintigraphy and intraoperative scintimetric examination (radioimmunoguided surger: RIGS) using{sup 99m}Tc-anti-CEA F(ab'){sub 2} fragment. Nineteen patients with rectal cancer underwent preoperative whole body planar scintigraphy at 4 hours after injection of {sup 99m}Tc-anti-CEA F(ab'){sub 2} fragment and SPECT imaging at 18 hours. Surgical operation was performed at 24 hours after injection. During laparotomy, radioactivities from intraabdominal viscera were measured by gamma probe. The radioactivities from excised tumor and lymph nodes were also measured and compared with pathology. All nineteen patients were confirmed to have adenocarcinomas in the rectum. Twenty-seven of 97 excised lymph node groups had metastasis and 2 patients had liver metastasis in pathology. Preoperative radioimmunoscintigraphy detected primary tumors in 11 patients (sensitivity 55%) and it could not detect any lymph nodes or liver metastasis. All patients showed high radioactivity in the kidneys, liver, spleen, and major vessels in intraoperative measurement by gamma probe, and tumor activity was not discriminated from background activity. However, radioactivity from excised tumor was higher than normal rectum (T/B ratio; 3,47{+-}2.25). When excised lymph node activity/background activity ratio >1.5 was considered as positive criteria of metastasis, sensitivity, specificity, positive and negative predictive values were 78.6%, 73.9%, 55.0% and 89.5%, respectively. Radioimmunoscintigraphy using {sup 99m}Tc-anti-CEA F(ab'){sub 2} has no additional value for preoperative staging and use of early RIGS using {sup 99m}Tc-anti-CEA F(ab'){sub 2} is inappropriate. For early RIGS using {sup 99m}Tc labeled antibodies in rectal cancer patients, further development of more specific antibodies and methods to reduce background activity are needed.

  9. Enhanced robustness in acetone-butanol-ethanol fermentation with engineered Clostridium beijerinckii overexpressing adhE2 and ctfAB.

    Science.gov (United States)

    Lu, Congcong; Yu, Le; Varghese, Saju; Yu, Mingrui; Yang, Shang-Tian

    2017-11-01

    Clostridium beijerinckii CC101 was engineered to overexpress aldehyde/alcohol dehydrogenase (adhE2) and CoA-transferase (ctfAB). Solvent production and acid assimilation were compared between the parental and engineered strains expressing only adhE2 (CC101-SV4) and expressing adhE2, ald and ctfAB (CC101-SV6). CC101-SV4 showed an early butanol production from glucose but stopped pre-maturely at a low butanol concentration of ∼6g/L. Compared to CC101, CC101-SV6 produced more butanol (∼12g/L) from glucose and was able to re-assimilate more acids, which prevented "acid crash" and increased butanol production, under all conditions studied. CC101-SV6 also showed better ability in using glucose and xylose present in sugarcane bagasse hydrolysate, and produced 9.4g/L solvents (acetone, butanol and ethanol) compared to only 2.6g/L by CC101, confirming its robustness and better tolerance to hydrolysate inhibitors. The engineered strain of C. beijerinckii overexpressing adhE2 and ctfAB should have good potential for producing butanol from lignocellulosic biomass hydrolysates. Copyright © 2017 Elsevier Ltd. All rights reserved.

  10. Overtone vibrational spectroscopy in H2-H2O complexes: a combined high level theoretical ab initio, dynamical and experimental study.

    Science.gov (United States)

    Ziemkiewicz, Michael P; Pluetzer, Christian; Nesbitt, David J; Scribano, Yohann; Faure, Alexandre; van der Avoird, Ad

    2012-08-28

    First results are reported on overtone (v(OH) = 2 ← 0) spectroscopy of weakly bound H(2)-H(2)O complexes in a slit supersonic jet, based on a novel combination of (i) vibrationally mediated predissociation of H(2)-H(2)O, followed by (ii) UV photodissociation of the resulting H(2)O, and (iii) UV laser induced fluorescence on the nascent OH radical. In addition, intermolecular dynamical calculations are performed in full 5D on the recent ab initio intermolecular potential of Valiron et al. [J. Chem. Phys. 129, 134306 (2008)] in order to further elucidate the identity of the infrared transitions detected. Excellent agreement is achieved between experimental and theoretical spectral predictions for the most strongly bound van der Waals complex consisting of ortho (I = 1) H(2) and ortho (I = 1) H(2)O (oH(2)-oH(2)O). Specifically, two distinct bands are seen in the oH(2)-oH(2)O spectrum, corresponding to internal rotor states in the upper vibrational manifold of Σ and Π rotational character. However, none of the three other possible nuclear spin modifications (pH(2)-oH(2)O, pH(2)-pH(2)O, or oH(2)-pH(2)O) are observed above current signal to noise level, which for the pH(2) complexes is argued to arise from displacement by oH(2) in the expansion mixture to preferentially form the more strongly bound species. Direct measurement of oH(2)-oH(2)O vibrational predissociation in the time domain reveals lifetimes of 15(2) ns and <5(2) ns for the Σ and Π states, respectively. Theoretical calculations permit the results to be interpreted in terms of near resonant energy levels and intermolecular alignment of the H(2) and H(2)O wavefunctions, providing insight into predissociation dynamical pathways from these metastable levels.

  11. Conditioning of spent fuel assemblies from the Rossendorf RFR research reactor in transport and storage containers of the type CASTOR MTR 2

    International Nuclear Information System (INIS)

    Schneider, B.; Hofmann, G.

    1994-09-01

    Most of the spent fuel assemblies are temporarily stored in the flooded fuel ponds AB 1 and AB 2 of the RFR, and some are still in the reactor core. The conditioning task described here is part of the RFR spent fuel management concept and covers the safe emplacement of the spent fuel elements in the CASTOR MTR 2 shipping containers and the sealing of the containers in compliance with the nuclear licence issued for the conditioning task. The transfer of the spent fuel assemblies from the present wet storage conditions to the dry storage conditions in the CASTOR MTR 2 containers is done by a mobile manipulation equipment consisting essentially of the transfer sluice gate and a transfer container. Subsequent to conditioning, the shipping containers are to be transported to a licensed intermediate storage facility to await their transport to a national radwaste repository. The technical handling tools for the transfer and manipulation are briefly described, as well as the process steps involved, putting emphasis on the detailed description of processes and the accompanying time frame, so that the conditioning task can be incorporated into the work plan of the entire project. The report further presents the EDP concept established for the task, including the required data archivation and documentation. (orig.) [de

  12. Effect of nitrogen fertigation and sowing time on the expression of Cry2Ab and on mortality of Spodoptera litura in Bollgard II cotton.

    Science.gov (United States)

    Saini, Manpreet Kaur; Dhawan, A K

    2014-03-01

    Toxin expression of Cry2Ab was studied in plant parts of Bollgard II cotton genotype MRC 7031 sown under different treatments of nitrogen application and planting dates. The expression was quantified by using Cry2Aa ELISA kit. Mean per cent mortality of one-day-old, 3rd and 5th instar larvae of Spodoptera litura was observed on different plant parts of MRC 7031 and their respective non-Bt cotton genotypes. The study deduced that mean maximum expression (19.24, 20.93 and 20.71 microg g(-1) in leaves, squares and bolls, respectively) of Cry2Ab was observed at higher nitrogen dose @ 300 kg ha(-1) (N3), while it was minimum (18.67, 20.44 and 20.14 microg g(-1) in leaves, squares and bolls, respectively) at low nitrogen dose @ 150 kg ha(-1) (N1). Studies conducted for different planting dates showed mean maximum expression (18.98, 20.72 and 20.42 microg g(-1) in leaves, squares and bolls, respectively) of Cry2Ab during late sown crop (15th May) as compared to early sown crop (15th April), the expression was 18.66, 20.32 and 20.06 microg g(-1) in leaves, squares and bolls, respectively. Quantitative expression of Cry2Ab was found to vary among different plant parts, i.e more in squares followed by bolls and leaves. Regarding mortality of different instars of S. litura, it was significantly more at higher nitrogen doses and it ranged from 83.04 to 96.27, 53.38 to 61.87 and 16.87 to 22.58% in case of S. litura one-day-old larvae, 3rd and 5th instar, respectively. While, non significant difference in mortalitywas observed during different sowing dates.

  13. Absorbed Doses and Risk Estimates of (211)At-MX35 F(ab')2 in Intraperitoneal Therapy of Ovarian Cancer Patients

    DEFF Research Database (Denmark)

    Cederkrantz, Elin; Andersson, Håkan; Bernhardt, Peter

    2015-01-01

    PURPOSE: Ovarian cancer is often diagnosed at an advanced stage with dissemination in the peritoneal cavity. Most patients achieve clinical remission after surgery and chemotherapy, but approximately 70% eventually experience recurrence, usually in the peritoneal cavity. To prevent recurrence...... dose associated with i.p. administration of (211)At-MX35 F(ab')2. METHODS AND MATERIALS: Patients in clinical remission after salvage chemotherapy for peritoneal recurrence of ovarian cancer underwent i.p. infusion of (211)At-MX35 F(ab')2. Potassium perchlorate was given to block unwanted accumulation...... of the infused therapy solution. RESULTS: The urinary bladder, thyroid, and kidneys (1.9, 1.8, and 1.7 mGy per MBq/L) received the 3 highest estimated absorbed doses. When the tissue-weighting factors were applied, the largest contributors to the effective dose were the lungs, stomach, and urinary bladder. Using...

  14. Bone marrow dosimetry in rats using direct tissue counting after injection of radio-iodinated intact monoclonal antibodies or F(ab')2 fragments

    International Nuclear Information System (INIS)

    Buchegger, F.; Chalandon, Y.; Pelegrin, A.; Hardman, N.; Mach, J.P.

    1991-01-01

    Normal rats were injected intravenously with 131I- and 125I-labeled intact murine and chimeric mouse-human monoclonal antibodies directed against carcinoembryonic antigen or with the corresponding F(ab')2 fragments. At different times after injection, individual animals were killed and radioactivity of blood and major organs, including bones and bone marrow, was determined. Ratios comparing radioactivity concentration in different tissues with that of bone marrow were calculated and found to remain stable during several effective half-lives of the antibodies. Mean bone marrow radioactivity was 35% (range, 29%-40%) of that of blood and 126% (range, 108%-147%) of that of liver after injection of intact Mabs or F(ab')2 fragments. In nude rats bearing human colon carcinoma xenografts producing carcinoembryonic antigen, relative bone marrow radioactivity was slightly lower than that in normal rats

  15. CO2 conversion by plasma technology: insights from modeling the plasma chemistry and plasma reactor design

    Science.gov (United States)

    Bogaerts, A.; Berthelot, A.; Heijkers, S.; Kolev, St.; Snoeckx, R.; Sun, S.; Trenchev, G.; Van Laer, K.; Wang, W.

    2017-06-01

    In recent years there has been growing interest in the use of plasma technology for CO2 conversion. To improve this application, a good insight into the underlying mechanisms is of great importance. This can be obtained from modeling the detailed plasma chemistry in order to understand the chemical reaction pathways leading to CO2 conversion (either in pure form or mixed with another gas). Moreover, in practice, several plasma reactor types are being investigated for CO2 conversion, so in addition it is essential to be able to model these reactor geometries so that their design can be improved, and the most energy efficient CO2 conversion can be achieved. Modeling the detailed plasma chemistry of CO2 conversion in complex reactors is, however, very time-consuming. This problem can be overcome by using a combination of two different types of model: 0D chemical reaction kinetics models are very suitable for describing the detailed plasma chemistry, while the characteristic features of different reactor geometries can be studied by 2D or 3D fluid models. In the first instance the latter can be developed in argon or helium with a simple chemistry to limit the calculation time; however, the ultimate aim is to implement the more complex CO2 chemistry in these models. In the present paper, examples will be given of both the 0D plasma chemistry models and the 2D and 3D fluid models for the most common plasma reactors used for CO2 conversion in order to emphasize the complementarity of both approaches. Furthermore, based on the modeling insights, the paper discusses the possibilities and limitations of plasma-based CO2 conversion in different types of plasma reactors, as well as what is needed to make further progress in this field.

  16. CYLFUX, Fast Reactor Reactivity Transients Simulation in LWR by 2-D 2 Group Diffusion

    International Nuclear Information System (INIS)

    Schmidt, A.

    1973-01-01

    1 - Nature of physical problem solved: A 2-dimensional calculation of the 2-group, space-dependent neutron diffusion equations is performed in r-z geometry using an arbitrary number of groups of delayed neutron precursors. The program is designed to simulate fast reactivity excursions in light water reactors taking into account Doppler feedback via adiabatic heatup of fuel. Axial motions of control rods may be considered including scram action on option. 2 - Method of solution: The differential equations are solved at each time step by an explicit finite difference method using two time levels. The stationary distributions are obtained by using the same algorithm. 3 - Restrictions on the complexity of the problem: No restriction to the number of space points and delayed neutron energy groups besides the computer size

  17. Development of a Novel Catalytic Membrane Reactor for Heterogeneous Catalysis in Supercritical CO2

    Directory of Open Access Journals (Sweden)

    Toshiro Yokoyama

    2010-01-01

    Full Text Available A novel type of high-pressure membrane reactor has been developed for hydrogenation in supercritical carbon dioxide (scCO2. The main objectives of the design of the reactor are the separate feeding of hydrogen and substrate in scCO2 for safe reactions in a continuous flow process, and to reduce the reaction time. By using this new reactor, hydrogenation of cinnamaldehyde into hydrocinnamaldehyde has been successfully carried out with 100% selectivity at 50 °C in 10 MPa (H2: 1 MPa, CO2: 9 MPa with a flow rate of substrate ranging from 0.05 to 1.0 mL/min.

  18. Immunoglobulin G and F(ab')2 polyvalent antivenoms do not differ in their ability to neutralize hemorrhage, edema and myonecrosis induced by Bothrops asper (terciopelo) snake venom

    OpenAIRE

    León Montero, Guillermo; Rojas Céspedes, Gustavo; Lomonte, Bruno; Gutiérrez, José María

    1997-01-01

    The ability of whole immunoglobulin G (IgG) and F(ab')2 polyvalent (Crotalinae) antivenoms to neutralize the hemorrhagic, edema-forming and myotoxic activities of Bothrops asper venom was studied. Both antivenoms were adjusted to the same neutralizing potency against lethal and hemorrhagic activities in experiments where venom and antivenoms were incubated before injection. Thus, in these experimental conditions, differences in the neutralizing ability in experiments involving independent inj...

  19. Clinical safety of a polyvalent F(ab')2 equine antivenom in 223 African snake envenomations : a field trial in Cameroon

    OpenAIRE

    Chippaux, Jean-Philippe; Lang, J.; Amadi Eddine, S; Fagot, P.; Rage, V.; Peyrieux, J.C.; Le Mener, V.

    1998-01-01

    A large-scale clinical trial was conducted, according to World Health Organization Good Clinical Practice guidelines, in 7 centres in North Cameroon to determine the safety and efficacy of a polyvalent antivenom composed of purified F(ab')2. This study included 223 patients presenting clinically with an obvious snake bite, predominantly due to #Echis ocellatus$ (viper), the most abundant species in this savannah region. Clinical surveillance was maintained for 5 d in all patients and until th...

  20. TiO2 Solar Photocatalytic Reactor Systems: Selection of Reactor Design for Scale-up and Commercialization—Analytical Review

    Directory of Open Access Journals (Sweden)

    Yasmine Abdel-Maksoud

    2016-09-01

    Full Text Available For the last four decades, viability of photocatalytic degradation of organic compounds in water streams has been demonstrated. Different configurations for solar TiO2 photocatalytic reactors have been used, however pilot and demonstration plants are still countable. Degradation efficiency reported as a function of treatment time does not answer the question: which of these reactor configurations is the most suitable for photocatalytic process and optimum for scale-up and commercialization? Degradation efficiency expressed as a function of the reactor throughput and ease of catalyst removal from treated effluent are used for comparing performance of different reactor configurations to select the optimum for scale-up. Comparison included parabolic trough, flat plate, double skin sheet, shallow ponds, shallow tanks, thin-film fixed-bed, thin film cascade, step, compound parabolic concentrators, fountain, slurry bubble column, pebble bed and packed bed reactors. Degradation efficiency as a function of system throughput is a powerful indicator for comparing the performance of photocatalytic reactors of different types and geometries, at different development scales. Shallow ponds, shallow tanks and fountain reactors have the potential of meeting all the process requirements and a relatively high throughput are suitable for developing into continuous industrial-scale treatment units given that an efficient immobilized or supported photocatalyst is used.