Sample records for reformate benzene toluene

  1. Detection of Benzene, Toluene, Ethyl Benzene, and Xylenes (BTEX) Using Toluene Dioxygenase-Peroxidase Coupling Reactions

    E-Print Network [OSTI]

    Chen, Wilfred

    Detection of Benzene, Toluene, Ethyl Benzene, and Xylenes (BTEX) Using Toluene Dioxygenase, whole-cell bioassay for the detection of bioavailable benzene, toluene, ethyl benzene, and xylenes (BTEX of the response obtained from the blank) of 10, 10, 20, and 50 µM was observed for benzene, toluene, ethyl benzene

  2. Reactions of the CN Radical with Benzene and Toluene: Product Detection and Low-Temperature Kinetics

    E-Print Network [OSTI]

    Trevitt, Adam J.

    2010-01-01T23:59:59.000Z

    of the CN Radical with Benzene and Toluene: Productare measured for the CN + benzene and CN + toluene reactionsdetection. The CN + benzene reaction rate coefficient at

  3. Comparative Investigation of Benzene Steam Reforming over Spinel...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Investigation of Benzene Steam Reforming over Spinel Supported Rh and Ir Catalysts. Comparative Investigation of Benzene Steam Reforming over Spinel Supported Rh and Ir Catalysts....

  4. Low temperature oxidation of benzene and toluene in mixture with ndecane

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Low temperature oxidation of benzene and toluene in mixture with ndecane Olivier Herbinet Abstract The oxidation of two blends, benzene/ndecane and toluene/ndecane, was studied in a jetstirred of benzene, only phenol could be quantified. In the case of toluene, significant amounts

  5. Assessment of dermal exposure to benzene and toluene in shoe manufacturing by activated carbon cloth patches

    E-Print Network [OSTI]

    California at Berkeley, University of

    Assessment of dermal exposure to benzene and toluene in shoe manufacturing by activated carbon activated carbon cloth (ACC) patches to study the probability and extent of dermal exposure to benzene for the contribution from the air through passive absorption of benzene and toluene on the ACC patches. Systemic

  6. www.rsc.org/analyst The airliquid interface of benzene, toluene, m-xylene, and

    E-Print Network [OSTI]

    ANALYST FULLPAPER THE www.rsc.org/analyst The air­liquid interface of benzene, toluene, m as an Advance Article on the web 10th April 2003 The air­liquid interface and the liquid-phase of benzene-zero hyperpolarizabilities of benzene and 1,3,5-trimethylbenzene. The orientation of the aromatic rings of these compounds

  7. Primary and Secondary Glyoxal Formation from Aromatics: Experimental Evidence for the Bicycloalkyl-Radical Pathway from Benzene, Toluene, and p-Xylene

    E-Print Network [OSTI]

    -Radical Pathway from Benzene, Toluene, and p-Xylene R. Volkamer,*, U. Platt, and K. Wirtz Centro de Estudios Form: May 16, 2001 A new approach is presented to study the ring-cleavage process of benzene, toluene for the troposphere. The yield of glyoxal was determined to be 35% ( 10% for benzene and about 5% higher for toluene

  8. Autoignition of toluene and benzene at elevated pressures in a rapid compression machine

    SciTech Connect (OSTI)

    Mittal, Gaurav; Sung, Chih-Jen [Department of Mechanical and Aerospace Engineering, Case Western Reserve University, Cleveland, OH 44106 (United States)

    2007-09-15T23:59:59.000Z

    Autoignition of toluene and benzene is investigated in a rapid compression machine at conditions relevant to HCCI (homogeneous charge compression ignition) combustion. Experiments are conducted for homogeneous mixtures over a range of equivalence ratios at compressed pressures from 25 to 45 bar and compressed temperatures from 920 to 1100 K. Experiments varying oxygen concentration while keeping the mole fraction of toluene constant reveal a strong influence of oxygen in promoting ignition. Additional experiments varying fuel mole fraction at a fixed equivalence ratio show that ignition delay becomes shorter with increasing fuel concentration. Moreover, autoignition of benzene shows significantly higher activation energy than that of toluene. In addition, the experimental pressure traces for toluene show behavior of heat release significantly different from the results of Davidson et al. [D.F. Davidson, B.M. Gauthier, R.K. Hanson, Proc. Combust. Inst. 30 (2005) 1175-1182]. Predictability of various detailed kinetic mechanisms is also compared. Results demonstrate that the existing mechanisms for toluene and benzene fail to predict the experimental data with respect to ignition delay and heat release. Flux analysis is further conducted to identify the dominant reaction pathways and the reactions responsible for the mismatch of experimental and simulated data. (author)

  9. Reactions of the CN Radical with Benzene and Toluene: Product Detection and Low-Temperature Kinetics

    SciTech Connect (OSTI)

    Trevitt, Adam J.; Goulay, Fabien; Taatjes, Craig A.; Osborn, David L.; Leone, Stephen R.

    2009-12-23T23:59:59.000Z

    Low temperature rate coefficients are measured for the CN + benzene and CN + toluene reactions using the pulsed Laval nozzle expansion technique coupled with laser-induced fluorescence detection. The CN + benzene reaction rate coefficient at 105, 165 and 295 K is found to be relatively constant over this temperature range, 3.9 - 4.9 x 10-10 cm3 molecule-1 s-1. These rapid kinetics, along with the observed negligible temperature dependence, are consistent with a barrierless reaction entrance channel and reaction efficiencies approaching unity. The CN + toluene reaction is measured to have a slower rate coefficient of 1.3 x 10-10 cm3 molecule-1 s-1 at 105 K. At room temperature, non-exponential decay profiles are observed for this reaction that may suggest significant back-dissociation of intermediate complexes. In separate experiments, the products of these reactions are probed at room temperature using synchrotron VUV photoionization mass spectrometry. For CN + benzene, cyanobenzene (C6H5CN) is the only product recorded with no detectable evidence for a C6H5 + HCN product channel. In the case of CN + toluene, cyanotoluene (NCC6H4CH3) constitutes the only detected product. It is not possible to differentiate among the ortho, meta and para isomers of cyanotoluene because of their similar ionization energies and the ~;; 40 meV photon energy resolution of the experiment. There is no significant detection of benzyl radicals (C6H5CH2) that would suggest a H-abstraction or a HCN elimination channel is prominent at these conditions. As both reactions are measured to be rapid at 105 K, appearing to have barrierless entrance channels, it follows that they will proceed efficiently at the temperatures of Saturn?s moon Titan (~;;100 K) and are also likely to proceed at the temperature of interstellar clouds (10-20 K).

  10. Mobility of Supercooled liquid Toluene, Ethylbenzene, and Benzene near their Glass Transition Temperatures Investigated using Inert Gas Permeation

    SciTech Connect (OSTI)

    May, Robert A.; Smith, R. Scott; Kay, Bruce D.

    2013-11-21T23:59:59.000Z

    We investigate the mobility of supercooled liquid toluene, ethylbenzene, and benzene near their respective glass transition temperatures (Tg). The permeation rate of Ar, Kr, and Xe through the supercooled liquid created when initially amorphous overlayers heated above their glass transition temperature is used to determine the diffusivity. Amorphous benzene crystallizes at temperatures well below its Tg and as a result the inert gas underlayer remains trapped until the onset of benzene desorption. In contrast, for toluene and ethylbenzene the onset of inert gas permeation is observed at temperatues near Tg. The inert gas desorption peak temperature as a function of the heating rate and overlayer thickness is used to quantify the diffusivity of supercooled liquid toluene and ethylbenzene from 115 K to 135 K. In this temperature range, diffusivities are found to vary across five orders of magnitude (~10-14 to 10-9 cm2/s). These data are compared to viscosity measurements and used to determine the low temperature fractional Stokes-Einstein exponent. Efforts to determine the diffusivity of a mixture of benzene and ethylbenzene are detailed, and the effect of mixing these materials on benzene crystallization is explored using infrared spectroscopy.

  11. Genotoxicity and apoptosis in Drosophila melanogaster exposed to benzene, toluene and xylene: Attenuation by quercetin and curcumin

    SciTech Connect (OSTI)

    Singh, Mahendra P. [Embryotoxicology Section, Indian Institute of Toxicology Research (CSIR), Mahatma Gandhi Marg, Lucknow 226001, Uttar Pradesh (India); Mishra, M.; Sharma, A.; Shukla, A.K. [Embryotoxicology Section, Indian Institute of Toxicology Research (CSIR), Mahatma Gandhi Marg, Lucknow 226001, Uttar Pradesh (India); Council of Scientific and Industrial Research (CSIR), New Delhi (India); Mudiam, M.K.R.; Patel, D.K. [Analytical Chemistry Section, Indian Institute of Toxicology Research, Mahatma Gandhi Marg, Lucknow 226 001, Uttar Pradesh (India); Council of Scientific and Industrial Research (CSIR), New Delhi (India); Ram, K. Ravi [Embryotoxicology Section, Indian Institute of Toxicology Research (CSIR), Mahatma Gandhi Marg, Lucknow 226001, Uttar Pradesh (India); Council of Scientific and Industrial Research (CSIR), New Delhi (India); Chowdhuri, D. Kar, E-mail: dkarchowdhuri@rediffmail.com [Embryotoxicology Section, Indian Institute of Toxicology Research (CSIR), Mahatma Gandhi Marg, Lucknow 226001, Uttar Pradesh (India); Council of Scientific and Industrial Research (CSIR), New Delhi (India)

    2011-05-15T23:59:59.000Z

    Monocyclic aromatic hydrocarbons (MAHs) such as benzene, toluene and xylene are being extensively used for various industrial and household purposes. Exposure to these hydrocarbons, occupationally or non-occupationally, is harmful to organisms including human. Several studies tested for toxicity of benzene, toluene and xylene, and interestingly, only a few studies looked into the attenuation. We used Drosophila model to test the genotoxic and apoptotic potential of these compounds and subsequently evaluated the efficiency of two phytochemicals, namely, quercetin and curcumin in attenuating test chemical induced toxicity. We exposed third instar larvae of wild type Drosophila melanogaster (Oregon R{sup +}) to 1.0-100.0 mM benzene, toluene or xylene, individually, for 12, 24 and 48 h and examined their apoptotic and genotoxic potential. We observed significantly (P < 0.001) increased apoptotic markers and genotoxicity in a concentration- and time-dependent manner in organisms exposed to benzene, toluene or xylene. We also observed significantly (P < 0.001) increased cytochrome P450 activity in larvae exposed to test chemicals and this was significantly reduced in the presence of 3',4'-dimethoxyflavone, a known Aryl hydrocarbon receptor (AhR) blocker. Interestingly, we observed a significant reduction in cytochrome P450 activity, GST levels, oxidative stress parameters, genotoxic and apoptotic endpoints when organisms were exposed simultaneously to test chemical along with quercetin or curcumin. The study further suggests the suitability of D. melanogaster as an alternate animal model for toxicological studies involving benzene, toluene and xylene and its potential in studying the protective role(s) of phytochemicals.

  12. Liquid-liquid equilibria for the ternary systems sulfolane + octane + benzene, sulfolane + octane + toluene and sulfolane + octane + p-xylene

    SciTech Connect (OSTI)

    Lee, S.; Kim, H. [Seoul National Univ. (Korea, Republic of). Dept. of Chemical Engineering

    1995-03-01T23:59:59.000Z

    Sulfolane is widely used as a solvent for the extraction of aromatic hydrocarbons. Ternary phase equilibrium data are essential for the proper understanding of the solvent extraction process. Liquid-liquid equilibrium data for the systems sulfolane + octane + benzene, sulfolane + octane + toluene and sulfolane + octane + p-xylene were determined at 298.15, 308.15, and 318.15 K. Tie line data were satisfactorily correlated by the Othmer and Tobias method. The experimental data were compared with the values calculated by the UNIQUAC and NRTL models. Good quantitative agreement was obtained with these models. However, the calculated values based on the NRTL model were found to be better than those based on the UNIQUAC model.

  13. Comparative Investigation of Benzene Steam Reforming over Spinel Supported Rh and Ir Catalysts

    SciTech Connect (OSTI)

    Mei, Donghai; Lebarbier, Vanessa MC; Rousseau, Roger J.; Glezakou, Vassiliki Alexandra; Albrecht, Karl O.; Kovarik, Libor; Flake, Matthew D.; Dagle, Robert A.

    2013-06-01T23:59:59.000Z

    In a combined experimental and first-principles density functional theory (DFT) study, benzene steam reforming (BSR) over MgAl2O4 supported Rh and Ir catalysts was investigated. Experimentally, it has been found that both highly dispersed Rh and Ir clusters (1-2 nm) on the MgAl2O4 spinel support are stable during the BSR in the temperature range of 700-850?C. Compared to the Ir/MgAl2O4 catalyst, the Rh/MgAl2O4 catalyst is more active with higher benzene turnover frequency and conversion. At typical steam conditions with the steam-to-carbon ratio > 12, the benzene conversion is only a weak function of the H2O concentration in the feed. This suggests that the initial benzene decomposition step rather than the benzene adsorption is most likely the rate-determined step in BSR over supported Rh and Ir catalysts. In order to understand the differences between the two catalysts, we followed with a comparative DFT study of initial benzene decomposition pathways over two representative model systems for each supported metal (Rh and Ir) catalysts. A periodic terrace (111) surface and an amorphous 50-atom metal cluster with a diameter of 1.0 nm were used to represent the two supported model catalysts under low and high dispersion conditions. Our DFT results show that the decreasing catalyst particle size enhances the benzene decomposition on supported Rh catalysts by lowering both C-C and C-H bond scission. The activation barriers of the C-C and the C-H bond scission decrease from 1.60 and 1.61 eV on the Rh(111) surface to 1.34 and 1.26 eV on the Rh50 cluster. For supported Ir catalysts, the decreasing particle size only affects the C-C scission. The activation barrier of the C-C scission of benzene decreases from 1.60 eV on the Ir(111) surface to 1.35 eV on the Ir50 cluster while the barriers of the C-H scission are practically the same. The experimentally measured higher BSR activity on the supported highly dispersed Rh catalyst can be rationalized by the thermodynamic limitation for the very first C-C bond scission of benzene on the small Ir50 catalyst. The C-C bond scission of benzene on the small Ir50 catalyst is highly endothermic although the barrier is competitive with the barriers of both the C-C and the C-H bond-breakings on the small Rh50 catalyst. The calculations also imply that, for the supported Rh catalysts the C-C and C-H bond scissions are competitive, independently of the Rh cluster sizes. After the initial dissociation step via either the C-C or the C-H bond scission, the C-H bond breaking seems to be more favorable rather than the C-C bond breaking on the larger Rh terrace surface. This work was financially supported by the United States Department of Energy’s Office of Biomass Program’s. Computing time was granted by a user project at the Molecular Science Computing Facility in the William R. Wiley Environmental Molecular Sciences Laboratory (EMSL), a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory.

  14. ForReview.Confidential-ACS Catalytic Transformation of 1,3,5 -Trimethyl Benzene over USY Zeolite

    E-Print Network [OSTI]

    Al-Khattaf, Sulaiman

    and trimethylbenzenes (TMB) coming from the reforming and pyrolysis of gasoline, into benzene and xylenes via

  15. Polyfunctional catalyst for processiing benzene fractions

    SciTech Connect (OSTI)

    G. Byakov; B.D. Zubitskii; B.G. Tryasunov; I.Ya. Petrov [Kuznetsk Basin State Technical University, Kemerovo (Russian Federation)

    2009-05-15T23:59:59.000Z

    A by-product of the coke industry is a raw benzene fraction benzene- 1 which may serve as for catalytic processes. The paper reports a study on the influence of the composition and temperatures on the activity and selectivity of NiO-V{sub 2}O{sub 6}-MoO{sub 3}/{gamma}-Al{sub 2}O{sub 3} catalysts and the corresponding binary and tertiary subsystems are studied by a pulse method in model reactions; the hydrodealkylating of toluene and the hydrodesulfurizing of thioprhene. The optimal catalyst composition is established. The new catalyst is compared with industrial catalysts.

  16. Dissociation of Benzene Dication [C6H6]2+: Exploring the Potential Energy Surface Smriti Anand and H. Bernhard Schlegel*

    E-Print Network [OSTI]

    Schlegel, H. Bernhard

    Dissociation of Benzene Dication [C6H6]2+: Exploring the Potential Energy Surface Smriti Anand The singlet potential energy surface for the dissociation of benzene dication has been explored, and its three such as acetylene, cyclopropane, butadiene, cyclohexane, benzene, toluene, and naphthalene. The Coulomb explosion

  17. Mobility of Supercooled liquid Toluene, Ethylbenzene, and Benzene...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    across five orders of magnitude (10-14 to 10-9 cm2s). These data are compared to viscosity measurements and used to determine the low temperature fractional Stokes-Einstein...

  18. Degradative capacities and bioaugmentation potential of an anaerobic benzene-degrading bacterium strain DN11

    SciTech Connect (OSTI)

    Yuki Kasai; Yumiko Kodama; Yoh Takahata; Toshihiro Hoaki; Kazuya Watanabe [Marine Biotechnology Institute, Kamaishi (Japan)

    2007-09-15T23:59:59.000Z

    Azoarcus sp. strain DN11 is a denitrifying bacterium capable of benzene degradation under anaerobic conditions. The present study evaluated strain DN11 for its application to bioaugmentation of benzene-contaminated underground aquifers. Strain DN11 could grow on benzene, toluene, m-xylene, and benzoate as the sole carbon and energy sources under nitrate-reducing conditions, although o- and p-xylenes were transformed in the presence of toluene. Phenol was not utilized under anaerobic conditions. Kinetic analysis of anaerobic benzene degradation estimated its apparent affinity and inhibition constants to be 0.82 and 11 {mu}M, respectively. Benzene-contaminated groundwater taken from a former coal-distillation plant site in Aichi, Japan was anaerobically incubated in laboratory bottles and supplemented with either inorganic nutrients (nitrogen, phosphorus, and nitrate) alone, or the nutrients plus strain DN11, showing that benzene was significantly degraded only when DN11 was introduced. Denaturing gradient gel electrophoresis of PCR-amplified 16S rRNA gene fragments, and quantitative PCR revealed that DN11 decreased after benzene was degraded. Following the decrease in DN11 16S rRNA gene fragments corresponding to bacteria related to Owenweeksia hongkongensis and Pelotomaculum isophthalicum, appeared as strong bands, suggesting possible metabolic interactions in anaerobic benzene degradation. Results suggest that DN11 is potentially useful for degrading benzene that contaminates underground aquifers at relatively low concentrations. 50 refs., 6 figs., 1 tab.

  19. Modeling theta-theta Interactions with the Effective Fragment Potential Method: The Benzene Dimer and Substituents

    SciTech Connect (OSTI)

    Toni Smithl; Lyudmila V. Slipchenko; Mark S. Gordon

    2008-02-27T23:59:59.000Z

    This study compares the results of the general effective fragment potential (EFP2) method to the results of a previous combined coupled cluster with single, double, and perturbative triple excitations [CCSD(T)] and symmetry-adapted perturbation theory (SAPT) study [Sinnokrot and Sherrill, J. Am. Chem. Soc., 2004, 126, 7690] on substituent effects in {pi}-{pi} interactions. EFP2 is found to accurately model the binding energies of the benzene-benzene, benzene-phenol, benzene-toluene, benzene-fluorobenzene, and benzene-benzonitrile dimers, as compared with high-level methods [Sinnokrot and Sherrill, J. Am. Chem. Soc., 2004, 126, 7690], but at a fraction of the computational cost of CCSD(T). In addition, an EFP-based Monte Carlo/simulated annealing study was undertaken to examine the potential energy surface of the substituted dimers.

  20. Drinking Water Problems: Benzene

    E-Print Network [OSTI]

    Dozier, Monty; Lesikar, Bruce J.

    2009-04-16T23:59:59.000Z

    on their property, live within a half-mile of a gasoline station or petroleum storage or refining facility, or notice a sweet, chemical smell in their water should have their water wells tested for benzene. Benzene attacks the central nervous system; acute ex... of red and white blood cells and platelets. Breathing high levels of benzene for a long time can cause leukemia and/or disruptions of the bone marrow. Long-term exposures also can damage chromosomes, depress the immune system, reduce the size...

  1. Drinking Water Problems: Benzene 

    E-Print Network [OSTI]

    Dozier, Monty; Lesikar, Bruce J.

    2009-04-16T23:59:59.000Z

    Drinking water in Texas sometimes contains potentially harmful chemicals, including benzene. Well owners can learn how to treat their well water to remove these chemicals. 4 pages, 3 images...

  2. DUNCAN PRITCHARD Reforming Reformed Epistemology*

    E-Print Network [OSTI]

    Edinburgh, University of

    DUNCAN PRITCHARD Reforming Reformed Epistemology* 0. Introduction There has been a renaissance-called "reformed" defence of the rationality of reli- gious belief. The starting-point for this reformed conception concern here. Instead, I will be outlining one way in which the reformed epistemological stance can

  3. Soot precursor measurements in benzene and hexane diffusion flames

    SciTech Connect (OSTI)

    Kobayashi, Y.; Furuhata, T.; Amagai, K.; Arai, M. [Department of Mechanical System Engineering, Graduate School of Engineering, Gunma University, 1-5-1 Tenjin-cho, Kiryu-shi, Gunma 376-8515 (Japan)

    2008-08-15T23:59:59.000Z

    To clarify the mechanism of soot formation in diffusion flames of liquid fuels, measurements of soot and its precursors were carried out. Sooting diffusion flames formed by a small pool combustion equipment system were used for this purpose. Benzene and hexane were used as typical aromatic and paraffin fuels. A laser-induced fluorescence (LIF) method was used to obtain spatial distributions of polycyclic aromatic hydrocarbons (PAHs), which are considered as soot particles. Spatial distributions of soot in test flames were measured by a laser-induced incandescence (LII) method. Soot diameter was estimated from the temporal change of LII intensity. A region of transition from PAHs to soot was defined from the results of LIF and LII. Flame temperatures, PAH species, and soot diameters in this transition region were investigated for both benzene and hexane flames. The results show that though the flame structures of benzene and hexane were different, the temperature in the PAHs-soot transition region of the benzene flame was similar to that of the hexane flame. Furthermore, the relationship between the PAH concentrations measured by gas chromatography in both flames and the PAH distributions obtained from LIF are discussed. It was found that PAHs with smaller molecular mass, such as benzene and toluene, remained in both the PAHs-soot transition and sooting regions, and it is thought that molecules heavier than pyrene are the leading candidates for soot precursor formation. (author)

  4. HCCI experiments with toluene reference fuels modeled by a semidetailed chemical kinetic model

    SciTech Connect (OSTI)

    Andrae, J.C.G. [Department of Chemical Engineering and Technology, Royal Institute of Technology (KTH), SE-100 44 Stockholm (Sweden); Brinck, T. [Department of Physical Chemistry, Royal Institute of Technology (KTH), SE-100 44 Stockholm (Sweden); Kalghatgi, G.T. [Shell Global Solutions (UK), P.O. Box 1, Chester CH1 3SH (United Kingdom)

    2008-12-15T23:59:59.000Z

    A semidetailed mechanism (137 species and 633 reactions) and new experiments in a homogeneous charge compression ignition (HCCI) engine on the autoignition of toluene reference fuels are presented. Skeletal mechanisms for isooctane and n-heptane were added to a detailed toluene submechanism. The model shows generally good agreement with ignition delay times measured in a shock tube and a rapid compression machine and is sensitive to changes in temperature, pressure, and mixture strength. The addition of reactions involving the formation and destruction of benzylperoxide radical was crucial to modeling toluene shock tube data. Laminar burning velocities for benzene and toluene were well predicted by the model after some revision of the high-temperature chemistry. Moreover, laminar burning velocities of a real gasoline at 353 and 500 K could be predicted by the model using a toluene reference fuel as a surrogate. The model also captures the experimentally observed differences in combustion phasing of toluene/n-heptane mixtures, compared to a primary reference fuel of the same research octane number, in HCCI engines as the intake pressure and temperature are changed. For high intake pressures and low intake temperatures, a sensitivity analysis at the moment of maximum heat release rate shows that the consumption of phenoxy radicals is rate-limiting when a toluene/n-heptane fuel is used, which makes this fuel more resistant to autoignition than the primary reference fuel. Typical CPU times encountered in zero-dimensional calculations were on the order of seconds and minutes in laminar flame speed calculations. Cross reactions between benzylperoxy radicals and n-heptane improved the model predictions of shock tube experiments for {phi}=1.0 and temperatures lower than 800 K for an n-heptane/toluene fuel mixture, but cross reactions had no influence on HCCI simulations. (author)

  5. Reforming process

    SciTech Connect (OSTI)

    Buss, W.C.

    1987-02-24T23:59:59.000Z

    A reforming process is described comprising: (a) contacting a hydrocarbon feed with a first reforming catalyst at conditions which favor reforming to form a product stream. The first reforming catalyst is bifunctional and comprises a metallic oxide support which contains acidic sites having disposed therein a Group VIII metal; and (b) contacting the product stream with a second reforming catalyst at conditions which favor reforming. The second reforming catalyst is a monofunctional, non-acidic catalyst comprising a large-pore zeolite containing at least one Group VIII metal.

  6. Quantum chromodynamics quark benzene

    E-Print Network [OSTI]

    Jialun Ping; Chengrong Deng; Fan Wang; T. Goldman

    2007-11-28T23:59:59.000Z

    A six-quark state with the benzene-like structure is proposed and studied based on color string model. The calculation with the quadratic confinement show that such structure has the lowest energy among the various hidden color six-quark structures proposed so far. Its possible effect on $NN$ scattering is discussed.

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

    SciTech Connect (OSTI)

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

    1993-12-01T23:59:59.000Z

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

  8. Fuel Dependence of Benzene Pathways

    SciTech Connect (OSTI)

    Zhang, H; Eddings, E; Sarofim, A; Westbrook, C

    2008-07-14T23:59:59.000Z

    The relative importance of formation pathways for benzene, an important precursor to soot formation, was determined from the simulation of 22 premixed flames for a wide range of equivalence ratios (1.0 to 3.06), fuels (C{sub 1}-C{sub 12}), and pressures (20 to 760 torr). The maximum benzene concentrations in 15 out of these flames were well reproduced within 30% of the experimental data. Fuel structural properties were found to be critical for benzene production. Cyclohexanes and C{sub 3} and C{sub 4} fuels were found to be among the most productive in benzene formation; and long-chain normal paraffins produce the least amount of benzene. Other properties, such as equivalence ratio and combustion temperatures, were also found to be important in determining the amount of benzene produced in flames. Reaction pathways for benzene formation were examined critically in four premixed flames of structurally different fuels of acetylene, n-decane, butadiene, and cyclohexane. Reactions involving precursors, such as C{sub 3} and C{sub 4} species, were examined. Combination reactions of C{sub 3} species were identified to be the major benzene formation routes with the exception of the cyclohexane flame, in which benzene is formed exclusively from cascading fuel dehydrogenation via cyclohexene and cyclohexadiene intermediates. Acetylene addition makes a minor contribution to benzene formation, except in the butadiene flame where C{sub 4}H{sub 5} radicals are produced directly from the fuel, and in the n-decane flame where C{sub 4}H{sub 5} radicals are produced from large alkyl radical decomposition and H atom abstraction from the resulting large olefins.

  9. Collision lifetimes of polyatomic molecules at low temperatures: Benzene–benzene vs benzene–rare gas atom collisions

    SciTech Connect (OSTI)

    Cui, Jie; Krems, Roman V. [Department of Chemistry, University of British Columbia, Vancouver, British Columbia V6T 1Z1 (Canada); Li, Zhiying [Department of Physics, Harvard University, Cambridge, Massachusetts 02138 (United States)

    2014-10-28T23:59:59.000Z

    We use classical trajectory calculations to study the effects of the interaction strength and the geometry of rigid polyatomic molecules on the formation of long-lived collision complexes at low collision energies. We first compare the results of the calculations for collisions of benzene molecules with rare gas atoms He, Ne, Ar, Kr, and Xe. The comparison illustrates that the mean lifetimes of the collision complexes increase monotonically with the strength of the atom–molecule interaction. We then compare the results of the atom–benzene calculations with those for benzene–benzene collisions. The comparison illustrates that the mean lifetimes of the benzene–benzene collision complexes are significantly reduced due to non-ergodic effects prohibiting the molecules from sampling the entire configuration space. We find that the thermally averaged lifetimes of the benzene–benzene collisions are much shorter than those for Xe with benzene and similar to those for Ne with benzene.

  10. Catalytic autothermal reforming increases fuel cell flexibility

    SciTech Connect (OSTI)

    Flytzani-Stephanopoulos, M.; Voecks, G.E.

    1981-12-01T23:59:59.000Z

    To give a better understanding of autothermal reforming (ATR), a process which offers an advantageous alternative to steam reforming for H/sub 2/ production for fuel cells because of the wider range of fuels which can be converted, the conversion of individual fuel components was studied. Attempts have been made to characterize the chemical reactions of light and heavy paraffins and aromatics in ATR. Results of studies to determine the effects of operating parameters on the carbon-forming tendency of each hydrocarbon type are reported. The catalyst used for the ATR process was three-layers of supported nickel catalysts, Norton NC-100 spheres in the top zone, cylindrical G-56B tablets in the bottom one, and either ICI 46-I or ICI 46-4 Raschig rings in the middle zone. A summary of the experimental studies of the ATR of n-hexane, n-tetradecane, benzene, and benzene solutions of naphthalene is presented. (BLM)

  11. Process for the preparation of ethyl benzene

    DOE Patents [OSTI]

    Smith, L.A. Jr.; Arganbright, R.P.; Hearn, D.

    1995-12-19T23:59:59.000Z

    Ethyl benzene is produced in a catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 50 C to 300 C, using as the catalyst a mole sieve characterized as acidic by feeding ethylene to the catalyst bed while benzene is conveniently added through the reflux to result in a molar excess present in the reactor to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene and diethyl benzene in the bottoms. The bottoms are fractionated, the ethyl benzene recovered and the bottoms are contacted with benzene in the liquid phase in a fixed bed straight pass reactor under conditions to transalkylate the benzene thereby converting most of the diethyl benzene to ethyl benzene which is again separated and recovered. 2 figs.

  12. Process for the preparation of ethyl benzene

    DOE Patents [OSTI]

    Smith, Jr., Lawrence A. (Houston, TX); Arganbright, Robert P. (Houston, TX); Hearn, Dennis (Houston, TX)

    1995-01-01T23:59:59.000Z

    Ethyl benzene is produced in a catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 50.degree. C. to 300.degree. C., using as the catalyst a mole sieve characterized as acidic by feeding ethylene to the catalyst bed while benzene is conveniently added through the reflux to result in a molar excess present in the reactor to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene and diethyl benzene in the bottoms. The bottoms are fractionated, the ethyl benzene recovered and the bottoms are contacted with benzene in the liquid phase in a fixed bed straight pass reactor under conditions to transalkylate the benzene thereby converting most of the diethyl benzene to ethyl benzene which is again separated and recovered.

  13. Acquisition Reform

    E-Print Network [OSTI]

    Sapolsky, Harvey

    This report reviews the six most recent major acquisition reform reports, starting in 1949 with the Hoover Commissions and including McNamara's Total Package Procurement, Fitzhugh Commission, the Commission on Government ...

  14. The atmospheric release of benzene, toluene, ethylbenzene, and xylene from contaminated soils

    E-Print Network [OSTI]

    Ramsey, Ronald Roland

    1993-01-01T23:59:59.000Z

    ,000 sites will be reported leaking by 1997. The Environmental Protection Agency (EPA) estimates that it will take 20 to 30 years and an average of $ 1 00, 000 to $400, 000 per site to remediate all sites. Many techniques have been developed...

  15. Slab reformer

    DOE Patents [OSTI]

    Spurrier, Francis R. (Whitehall, PA); DeZubay, Egon A. (Mt. Lebanon, PA); Murray, Alexander P. (Murrysville, PA); Vidt, Edward J. (Churchill, PA)

    1985-03-12T23:59:59.000Z

    Slab-shaped high efficiency catalytic reformer configurations particularly useful for generation of fuels to be used in fuel cell based generation systems. A plurality of structures forming a generally rectangular peripheral envelope are spaced about one another to form annular regions, an interior annular region containing a catalytic bed and being regeneratively heated on one side by a hot combustion gas and on the other side by the gaseous products of the reformation. An integrally mounted combustor is cooled by impingement of incoming oxidant.

  16. Slab reformer

    DOE Patents [OSTI]

    Spurrier, Francis R. (Whitehall, PA); DeZubay, Egon A. (Mt. Lebanon, PA); Murray, Alexander P. (Murrysville, PA); Vidt, Edward J. (Churchill, PA)

    1984-02-07T23:59:59.000Z

    Slab-shaped high efficiency catalytic reformer configurations particularly useful for generation of fuels to be used in fuel cell based generation systems. A plurality of structures forming a generally rectangular peripheral envelope are spaced about one another to form annular regions, an interior annular region containing a catalytic bed and being regeneratively heated on one side by a hot comubstion gas and on the other side by the gaseous products of the reformation. An integrally mounted combustor is cooled by impingement of incoming oxidant.

  17. Slab reformer

    DOE Patents [OSTI]

    Spurrier, F.R.; DeZubay, E.A.; Murray, A.P.; Vidt, E.J.

    1984-02-07T23:59:59.000Z

    Slab-shaped high efficiency catalytic reformer configurations are disclosed particularly useful for generation of fuels to be used in fuel cell based generation systems. A plurality of structures forming a generally rectangular peripheral envelope are spaced about one another to form annular regions, an interior annular region containing a catalytic bed and being regeneratively heated on one side by a hot combustion gas and on the other side by the gaseous products of the reformation. An integrally mounted combustor is cooled by impingement of incoming oxidant. 14 figs.

  18. Interphase Cytogenetics of Workers Exposed to Benzene

    E-Print Network [OSTI]

    California at Berkeley, University of

    Interphase Cytogenetics of Workers Exposed to Benzene Luoping Zhang,1 Nathaniel Rothman,2 Yunxia has been used to demonstrate that the benzene metabolites hydroquinone and 1,2,4-benzenetriol induce FISH procedure to perform cytogenetic analyses on the blood cells of 43 workers exposed to benzene

  19. Catalytic autothermal reforming increases fuel cell flexibility

    SciTech Connect (OSTI)

    Flytzani-Stephanopoulos, M.; Voecks, G.E.

    1981-12-01T23:59:59.000Z

    Experimental results are presented for the autothermal reforming (ATR) of n-hexane, n-tetradecane, benzene and benzene solutions of naphthalene. The tests were run at atmospheric pressure and at moderately high reactant preheat temperatures in the 800-900 K range. Carbon formation lines were determined for paraffinic and aromatic liquids. Profiles were determined for axial bed temperature and composition. Space velocity efforts were assessed, and the locations and types of carbon were recorded. Significant reactive differences between hydrocarbons were identified. Carbon formation characteristics were hydrocarbon specific. The differing behavior of paraffinic and aromatic fuels with respect to their carbon formation may be important in explaining the narrow range of carbon-free operating conditions found in the ATR of number two fuel oil.

  20. Products of the Benzene + O(3P) Reaction

    E-Print Network [OSTI]

    Osborn, David L.

    2010-01-01T23:59:59.000Z

    Chemistry Products of the Benzene + O( 3 P) Reaction CraigThe gas-phase reaction of benzene with O( 3 P) is ofthe addition of the O atom to benzene, forming an initial

  1. ON THE PURPORTED FISCHER-TROPSCH ALKYLATION OF BENZENE: THE REACTION OF BENZENE WITH ALUMINUM TRICHLORIDE REVISITED

    E-Print Network [OSTI]

    Benner, Linda S.

    2014-01-01T23:59:59.000Z

    ON THE PURPORTED FISCHER-TROPSCH ALKYLATION OF BENZENE: THEOn the Purported Fischer-Tropsch Alkylation of Benzene: TheAbstract The purported Fischer-Tropsch alkylation of benzene

  2. Benzene Dimer: Dynamic Structure and Thermodynamics Derived from...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Benzene Dimer: Dynamic Structure and Thermodynamics Derived from On-the-Fly ab initio DFT-D Molecular Dynamic Simulations. Benzene Dimer: Dynamic Structure and Thermodynamics...

  3. Development of Probabilistic Emission Inventories of Benzene, Formaldehyde

    E-Print Network [OSTI]

    Frey, H. Christopher

    Development of Probabilistic Emission Inventories of Benzene, Formaldehyde And Chromium emission inventories (EI) of benzene, formaldehyde and chromium for the Houston area. This project

  4. LIGHT SCATTERING SPECTROSCOPY OF PULYDIMETHYLSILOXANE-TOLUENE GELS

    E-Print Network [OSTI]

    Boyer, Edmond

    1499 LIGHT SCATTERING SPECTROSCOPY OF PULYDIMETHYLSILOXANE-TOLUENE GELS J. P. MUNCH, P. LEMARÉCHAL varie avec la concentration en polymère selon une loi de puissance avec un exposant plus élevé que celui- siloxane-toluene gels formed either by swelling permanent networks or by dissolving linear macro- molecules

  5. Benzene Dimer DOI: 10.1002/anie.201300653

    E-Print Network [OSTI]

    Benzene Dimer DOI: 10.1002/anie.201300653 Structure of the Benzene Dimer--Governed by Dynamics van der Avoird* The benzene dimer is a prototypical system for studying noncovalent interactions in the structure and dynamic behavior of proteins and DNA. The first (1975) experimental study of the benzene dimer

  6. Original article 789 Genetic polymorphisms and benzene metabolism in humans

    E-Print Network [OSTI]

    California at Berkeley, University of

    Original article 789 Genetic polymorphisms and benzene metabolism in humans exposed to a wide Range on levels of benzene metabolites in 250 benzene-exposed and 136 control workers in Tianjin, China (for all, catechol, and hydroquinone) and nine polymorphisms in seven genes coding for key enzymes in benzene

  7. Formation and distribution of benzene on Titan V. Vuitton,1

    E-Print Network [OSTI]

    Yelle, Roger V.

    Formation and distribution of benzene on Titan V. Vuitton,1 R. V. Yelle,1 and J. Cui1 Received 29 a study of the formation and distribution of benzene (C6H6) on Titan. Analysis of the Cassini Mass Spectrometer (INMS) measurements of benzene densities on 12 Titan passes shows that the benzene signal exhibits

  8. Californians and Immigration Reform

    E-Print Network [OSTI]

    Sekhon, Jasjeet S.

    June 2013 Californians and Immigration Reform Alternatives Jack Citrin Morris Levy Gabriel Lenz, include: · Even when alternative reforms are included in the ques- tion, most respondents support some about immigration reform remains a com- plex subject," said IGS Director Jack Citrin, who led the re

  9. Protein Adducts of 1,4-Benzoquinone and Benzene Oxide among Smokers and Nonsmokers Exposed to Benzene in China1

    E-Print Network [OSTI]

    California at Berkeley, University of

    Protein Adducts of 1,4-Benzoquinone and Benzene Oxide among Smokers and Nonsmokers Exposed to Benzene in China1 Karen Yeowell-O'Connell, Nathaniel Rothman, Suramya Waidyanatha, Martyn T. Smith [W. E. B.] Abstract Hemoglobin (Hb) and albumin (Alb) adducts of the benzene metabolites benzene

  10. Steam reforming analyzed

    SciTech Connect (OSTI)

    Wagner, E.S. (KTI Corp., San Dimas, CA (US)); Froment, G.F. (Ghent Rijksuniversiteit (Belgium))

    1992-07-01T23:59:59.000Z

    This paper reports that maximum steam reformer operation without excessive coking reactions requires careful control of thermodynamic and kinetic conditions. Regardless of the syngas-based feedstock composition, carbon formation problems can be avoided while increasing reformer CO or H{sub 2} production. Steam reforming technology is best understood via: Primary steam reformer developments, Kinetics of methane steam reforming, Simulation of an industrial steam/CO{sub 2} reformer, Example conditions (steam/CO{sub 2} reforming), Thermodynamic approach (minimum to steam ratio). Hydrogen and carbon monoxide are two of the most important building blocks in the chemical industry. Hydrogen is mainly used in ammonia and methanol synthesis and petroleum refining. Carbon monoxide is used to produce pains, plastics, foams, pesticides and insecticides, to name a few. Production of H{sub 2} and CO is usually carried out by the following processes: Steam reforming (primary and secondary) of hydrocarbons, Partial oxidation of hydrocarbons, Coal gasification. Coal gasification and partial oxidation do not use catalysts and depend on partial combustion of the feedstock to internally supply reaction heat. Secondary (autothermal) reforming is a type of steam reforming that also uses the heat of partial combustion but afterwards uses a catalyst of promote the production of hydrogen and CO.

  11. Benzene waste NESHAP update and requirements

    SciTech Connect (OSTI)

    Bennett, C.D. (Ashland Petroleum Co., Russell, KY (United States))

    1993-01-01T23:59:59.000Z

    On January 7, 1993, USEPA promulgated the clarified National Emission Standard for Hazardous Air Pollutants (NESHAP) for Benzene Waste Operations, 40 CFR 61 Subpart FF. This rule limits benzene emissions from petroleum refinery wastewater systems and other waste management units. Since the time of initial promulgation, March 7, 1990, EPA admits that there has been widespread confusion among refiners concerning the key provisions of the rule. This paper provides clarifications of the new final rule and an overview of both the new alternative compliance options and the compliance waiver provisions.

  12. Exposure Evaluation for Benzene, Lead and Noise in Vehicle and Equipment Repair Shops

    SciTech Connect (OSTI)

    Sweeney, Lynn C.

    2013-04-10T23:59:59.000Z

    An exposure assessment was performed at the equipment and vehicle maintenance repair shops operating at the U. S. Department of Energy Hanford site, in Richland, Washington. The maintenance shops repair and maintain vehicles and equipment used in support of the Hanford cleanup mission. There are three general mechanic shops and one auto body repair shop. The mechanics work on heavy equipment used in construction, cranes, commercial motor vehicles, passenger-type vehicles in addition to air compressors, generators, and farm equipment. Services include part fabrication, installation of equipment, repair and maintenance work in the engine compartment, and tire and brake services. Work performed at the auto body shop includes painting and surface preparation which involves applying body filler and sanding. 8-hour time-weighted-average samples were collected for benzene and noise exposure and task-based samples were collected for lead dust work activities involving painted metal surfaces. Benzene samples were obtained using 3M™ 3520 sampling badges and were analyzed for additional volatile organic compounds. These compounds were selected based on material safety data sheet information for the aerosol products used by the mechanics for each day of sampling. The compounds included acetone, ethyl ether, toluene, xylene, VM&P naphtha, methyl ethyl ketone, and trichloroethylene. Laboratory data for benzene, VM&P naphtha, methyl ethyl ketone and trichloroethylene were all below the reporting detection limit. Airborne concentrations for acetone, ethyl ether, toluene and xylene were all less than 10% of their occupational exposure limit. The task-based samples obtained for lead dusts were submitted for a metal scan analysis to identify other metals that might be present. Laboratory results for lead dusts were all below the reporting detection limit and airborne concentration for the other metals observed in the samples were less than 10% of the occupational exposure limit. Noise dosimetry sampling was performed on a random basis and was representative of the different work activities within the four shops. Twenty three percent of the noise samples exceeded the occupational exposure limit of 85 decibels for an 8-hour time-weightedaverage. Work activities where noise levels were higher included use of impact wrenches and grinding wheels.

  13. Immigration reform and California agriculture

    E-Print Network [OSTI]

    Martin, Philip

    2013-01-01T23:59:59.000Z

    reform and California agriculture Philip Martin Professor,proposals for California agriculture. Immigration reformCenter. 196 CALIFORNIA AGRICULTURE • VOLUME 67 , NUMBER 4

  14. Pilot-Scale Benzene Retention and Release Demonstration

    SciTech Connect (OSTI)

    Marek, J.C.

    2003-11-10T23:59:59.000Z

    During the initial months of In-Tank Precipitation radioactive operation in 1995 the process experienced high rates of tetraphenylborate decomposition with assumed corresponding high rates of benzene generation. In March 1996 after a two month quiescent period, a water addition to Tank 48H resulted in an unexpected benzene release to the tank vapor phase. This was the first time a low energy input resulted in a significant release rate. This led to questions about how benzene, generated in-situ by TPB decomposition, was retained in the surrounding potassium tetraphenylborate slurry. It was postulated the retention mechanism may have changed during the quiescent period prior to March so the benzene present became readily releasable to the vapor phase with low energy input to the slurry or that enough benzene accumulated that some of it was in a different, more releasable form. Readily releasable is a qualitative term defined as a rapid release of benzene at a rate approaching evaporation of a free benzene layer. It is intended to distinguish between benzene in a form with high liquid phase resistance to mass transfer diffusion controlled from benzene in a form with minimal liquid phase resistance to mass transfer free benzene layer evaporation. If a readily releasable form of benzene was present, the vapor space profile during release tests was anticipated to have an initial benzene vapor space concentration peak followed by a lower vapor concentration, longer duration release.

  15. Modeling Human Metabolism of Benzene Following Occupational and Environmental Exposures

    E-Print Network [OSTI]

    California at Berkeley, University of

    Modeling Human Metabolism of Benzene Following Occupational and Environmental Exposures Sungkyoon) models to investigate nonlinear relationships between levels of benzene metabolites (E,E- muconic acid, S-phenylmercapturic acid, phenol, hydroqui- none, and catechol) and benzene exposure among 386 exposed and control workers

  16. BIOMARKERS IN THE MOLECULAR EPIDEMIOLOGY OF BENZENE-EXPOSED WORKERS

    E-Print Network [OSTI]

    California at Berkeley, University of

    BIOMARKERS IN THE MOLECULAR EPIDEMIOLOGY OF BENZENE-EXPOSED WORKERS Martyn T. Smith Division from workers exposed to high levels of benzene. The goal of these studies is to develop and validate (1) biomarkers of exposure to benzene, such as albumin or hemoglobin adducts; (2) molecular markers

  17. Products of the Benzene + O(3 P) Reaction

    E-Print Network [OSTI]

    Krylov, Anna I.

    Products of the Benzene + O(3 P) Reaction Craig A. Taatjes,*, David L. Osborn, Talitha M. Selby ReceiVed: January 7, 2010 The gas-phase reaction of benzene with O(3 P) is of considerable interest mainly through the addition of the O atom to benzene, forming an initial triplet diradical adduct, which

  18. Molecular dynamics of liquid benzene via femtosecond pulses laser excitation

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1749 Molecular dynamics of liquid benzene via femtosecond pulses laser excitation J. Etchepare, G moléculaires. Abstract. 2014 We analyse the complex response of liquid benzene to the applied 45 fs FHWM new results obtained by the transient grating temporal behaviour analysis of benzene, a molecule

  19. Reforming the Private Insurance Market

    E-Print Network [OSTI]

    Kammen, Daniel M.

    Reforming the Private Insurance Market: Lessons from California for National Health Reform Janet M and Community Medicine, University of California, San Francisco ADVANCING NATIONAL HEALTH REFORM POLICY BRIEF Security |Reforming the Private Insurance Market: Lessons from California ACKNOWLEDGMENTS I would like

  20. Reforming Undergraduate Education at UNLV

    E-Print Network [OSTI]

    Hemmers, Oliver

    Reforming Undergraduate Education at UNLV #12;Reforms Passed by Faculty Senate In 2011 the Faculty Senate Passed Two Reforms: 1. University Undergraduate Learning Outcomes (UULOs) ­ The skills Reform · Improving quality of our undergraduate education · Greater Coherence of Gen Ed and Undergraduate

  1. Catalytic reforming methods

    DOE Patents [OSTI]

    Tadd, Andrew R; Schwank, Johannes

    2013-05-14T23:59:59.000Z

    A catalytic reforming method is disclosed herein. The method includes sequentially supplying a plurality of feedstocks of variable compositions to a reformer. The method further includes adding a respective predetermined co-reactant to each of the plurality of feedstocks to obtain a substantially constant output from the reformer for the plurality of feedstocks. The respective predetermined co-reactant is based on a C/H/O atomic composition for a respective one of the plurality of feedstocks and a predetermined C/H/O atomic composition for the substantially constant output.

  2. NETL - Fuel Reforming Facilities

    SciTech Connect (OSTI)

    None

    2013-06-12T23:59:59.000Z

    Research using NETL's Fuel Reforming Facilities explores catalytic issues inherent in fossil-energy related applications, including catalyst synthesis and characterization, reaction kinetics, catalyst activity and selectivity, catalyst deactivation, and stability.

  3. NETL - Fuel Reforming Facilities

    ScienceCinema (OSTI)

    None

    2014-06-27T23:59:59.000Z

    Research using NETL's Fuel Reforming Facilities explores catalytic issues inherent in fossil-energy related applications, including catalyst synthesis and characterization, reaction kinetics, catalyst activity and selectivity, catalyst deactivation, and stability.

  4. Natural Gas Reforming | Department of Energy

    Broader source: Energy.gov (indexed) [DOE]

    Hydrogen Production Natural Gas Reforming Natural Gas Reforming Photo of Petroleum Refinery Natural gas reforming is an advanced and mature production process that builds upon...

  5. Nonlinear diffusion in Acetone-Benzene Solution

    E-Print Network [OSTI]

    Obukhovsky, Vjacheslav V

    2010-01-01T23:59:59.000Z

    The nonlinear diffusion in multicomponent liquids under chemical reactions influence has been studied. The theory is applied to the analysis of mass transfer in a solution of acetone-benzene. It has been shown, that the creation of molecular complexes should be taken into account for the explanation of the experimental data on concentration dependence of diffusion coefficients. The matrix of mutual diffusivities has been found and effective parameters of the system have been computed.

  6. Catalytic Transformation of Toluene over High Acidity Y-Zeolite Based S. Al-Khattaf*

    E-Print Network [OSTI]

    Al-Khattaf, Sulaiman

    Catalytic Transformation of Toluene over High Acidity Y-Zeolite Based Catalyst S. Al Abstract Catalytic transformation of toluene has been investigated over Y-zeolite based catalysts in the temperature range of 400-500o C to understand the transformation of toluene over high acidity Y-based zeolite

  7. Continuous Operation of Foamed Emulsion Bioreactors Treating Toluene Vapors

    E-Print Network [OSTI]

    Continuous Operation of Foamed Emulsion Bioreactors Treating Toluene Vapors Eunsung Kan, Marc A.interscience.wiley.com). DOI: 10.1002/bit.20619 Abstract: Continuous operation of a new bioreactor for air pollution control called the foamed emulsion bioreactor (FEBR) has been investigated. The effect of several liquid feeding

  8. Benzene-derived N2-(4-hydroxyphenyl)-deoxyguanosine adduct: UvrABC incision and its conformation in DNA

    E-Print Network [OSTI]

    Hang, Bo

    2010-01-01T23:59:59.000Z

    in a historical UK cohort of benzene exposed workers. OccupEnvironmental exposure to benzene: an update. Environ Health2004. Genotoxicity of benzene and its metabolites. Mutat Res

  9. Remediation of overlapping benzene/MTBE and MTBE-only plumes: A case study

    SciTech Connect (OSTI)

    Carpenter, P.L. [TolTest, Inc., Pittsburgh, PA (United States); Vinch, C.A. [Ryder Transportation Services, Lawrenceville, NJ (United States)

    1997-12-31T23:59:59.000Z

    Two overlapping dissolved hydrocarbon plumes were identified in the shallow water-bearing zone at a commercial vehicle service and fueling facility. Plume 1 originated from a pre-1993 gasoline product line/dispenser leak. This plume contained a relatively common mix of benzene, toluene, ethylbenzene, xylenes (BTEX), and methyl tert-butyl ether (MTBE); benzene and MTBE were identified as the Plume 1 contaminants of concern based on their detection at approximately 200 {mu}g/l each, which exceeded regulatory guidance. Plume 2, which was detected in the tank cavity during UST removal, resulted from gasoline line leaks/underground storage tank overfills. Although the majority of impacted soils in both the dispenser and tank cavity areas were removed during UST excavation, rainfall during impacted soil removal mobilized the MTBE contained in the soils to groundwater. As a result, Plume 2 contained approximately 900 {mu}g/l MTBE while BTEX compounds were non-detect. Although the impacted zone sustained an approximate yield of only 0.3 gallon per minute, Pennsylvania regulations dictate that this zone must be treated as an aquifer. The failure of remediating gasoline plumes using pump-and-treat has been predominantly due to BTEX`s tendency to adsorb onto soil, creating a residual-phase product layer which acts as a continuing source of dissolved-phase BTEX. Based on this experience, most groundwater and remediation professionals reject pump-and-treat as a viable remedial option, except in situations where controlling groundwater movement is the predominant goal.

  10. FOOD REFORM MOVEMENTS Nicolas Larchet

    E-Print Network [OSTI]

    Boyer, Edmond

    FOOD REFORM MOVEMENTS Nicolas Larchet Social historians have broadly defined two cycles of American history characterized by an efflorescence of social movements aiming to reform both the individual to the 1920s. The reform impulse thrived wherever there was a perceived vice, abuse or corruption

  11. Autothermal reforming catalyst and process

    SciTech Connect (OSTI)

    Setzer, H. J.; Karavolis, S.; Lesieur, R. R.; Wnuck, W. G.

    1984-09-25T23:59:59.000Z

    High activity steam reforming catalysts are described particularly adapted for use in autothermal reforming processes. A rhodium catalyst on a calcium oxide impregnated alumina substrate allow the autothermal reforming process to take place with substantially no carbon plugging at oxygen to carbon ratios below what had been considered critical for avoiding carbon plugging of the catalyst in the past.

  12. Resonant ion-dip infrared spectroscopy of the S4 and D2d water octamers in benzene-,,water...8 and benzene2-,,water...8

    E-Print Network [OSTI]

    Zwier, Timothy S.

    Resonant ion-dip infrared spectroscopy of the S4 and D2d water octamers in benzene-,,water...8 and benzene2-,,water...8 Christopher J. Gruenloh, Joel R. Carney, Fredrick C. Hagemeister, Caleb A. Arrington the hydrogen-bonding topologies of two isomers each of the benzene- water)8 and (benzene 2 water)8 gas

  13. 28 VOLUME 115 | NUMBER 1 | January 2007 Environmental Health Perspectives Benzene is a ubiquitous environmental conta-

    E-Print Network [OSTI]

    California at Berkeley, University of

    28 VOLUME 115 | NUMBER 1 | January 2007 · Environmental Health Perspectives Research Benzene matter, including cigarette smoking. Air concentra- tions of benzene are typically environments but can exceed 10 ppm in industrial settings where benzene- containing products are used

  14. Methanol partial oxidation reformer

    DOE Patents [OSTI]

    Ahmed, Shabbir (Bolingbrook, IL); Kumar, Romesh (Naperville, IL); Krumpelt, Michael (Naperville, IL)

    1999-01-01T23:59:59.000Z

    A partial oxidation reformer comprising a longitudinally extending chamber having a methanol, water and an air inlet and an outlet. An igniter mechanism is near the inlets for igniting a mixture of methanol and air, while a partial oxidation catalyst in the chamber is spaced from the inlets and converts methanol and oxygen to carbon dioxide and hydrogen. Controlling the oxygen to methanol mole ratio provides continuous slightly exothermic partial oxidation reactions of methanol and air producing hydrogen gas. The liquid is preferably injected in droplets having diameters less than 100 micrometers. The reformer is useful in a propulsion system for a vehicle which supplies a hydrogen-containing gas to the negative electrode of a fuel cell.

  15. Methanol partial oxidation reformer

    DOE Patents [OSTI]

    Ahmed, Shabbir (Bolingbrook, IL); Kumar, Romesh (Naperville, IL); Krumpelt, Michael (Naperville, IL)

    2001-01-01T23:59:59.000Z

    A partial oxidation reformer comprising a longitudinally extending chamber having a methanol, water and an air inlet and an outlet. An igniter mechanism is near the inlets for igniting a mixture of methanol and air, while a partial oxidation catalyst in the chamber is spaced from the inlets and converts methanol and oxygen to carbon dioxide and hydrogen. Controlling the oxygen to methanol mole ratio provides continuous slightly exothermic partial oxidation reactions of methanol and air producing hydrogen gas. The liquid is preferably injected in droplets having diameters less than 100 micrometers. The reformer is useful in a propulsion system for a vehicle which supplies a hydrogen-containing gas to the negative electrode of a fuel cell.

  16. Methanol partial oxidation reformer

    DOE Patents [OSTI]

    Ahmed, S.; Kumar, R.; Krumpelt, M.

    1999-08-24T23:59:59.000Z

    A partial oxidation reformer is described comprising a longitudinally extending chamber having a methanol, water and an air inlet and an outlet. An igniter mechanism is near the inlets for igniting a mixture of methanol and air, while a partial oxidation catalyst in the chamber is spaced from the inlets and converts methanol and oxygen to carbon dioxide and hydrogen. Controlling the oxygen to methanol mole ratio provides continuous slightly exothermic partial oxidation reactions of methanol and air producing hydrogen gas. The liquid is preferably injected in droplets having diameters less than 100 micrometers. The reformer is useful in a propulsion system for a vehicle which supplies a hydrogen-containing gas to the negative electrode of a fuel cell. 7 figs.

  17. Methanol partial oxidation reformer

    DOE Patents [OSTI]

    Ahmed, S.; Kumar, R.; Krumpelt, M.

    1999-08-17T23:59:59.000Z

    A partial oxidation reformer is described comprising a longitudinally extending chamber having a methanol, water and an air inlet and an outlet. An igniter mechanism is near the inlets for igniting a mixture of methanol and air, while a partial oxidation catalyst in the chamber is spaced from the inlets and converts methanol and oxygen to carbon dioxide and hydrogen. Controlling the oxygen to methanol mole ratio provides continuous slightly exothermic partial oxidation reactions of methanol and air producing hydrogen gas. The liquid is preferably injected in droplets having diameters less than 100 micrometers. The reformer is useful in a propulsion system for a vehicle which supplies a hydrogen-containing gas to the negative electrode of a fuel cell. 7 figs.

  18. Catalytic reforming catalyst

    SciTech Connect (OSTI)

    Buss, W.C.; Kluksdahl, H.E.

    1980-12-09T23:59:59.000Z

    An improved catalyst, having a reduced fouling rate when used in a catalytic reforming process, said catalyst comprising platinum disposed on an alumina support wherein the alumina support is obtained by removing water from aluminum hydroxide produced as a by-product from a ziegler higher alcohol synthesis reaction, and wherein the alumina is calcined at a temperature of 1100-1400/sup 0/F so as to have a surface area of 165 to 215 square meters per gram.

  19. Steam reformer with catalytic combustor

    DOE Patents [OSTI]

    Voecks, Gerald E. (La Crescenta, CA)

    1990-03-20T23:59:59.000Z

    A steam reformer is disclosed having an annular steam reforming catalyst bed formed by concentric cylinders and having a catalytic combustor located at the center of the innermost cylinder. Fuel is fed into the interior of the catalytic combustor and air is directed at the top of the combustor, creating a catalytic reaction which provides sufficient heat so as to maintain the catalytic reaction in the steam reforming catalyst bed. Alternatively, air is fed into the interior of the catalytic combustor and a fuel mixture is directed at the top. The catalytic combustor provides enhanced radiant and convective heat transfer to the reformer catalyst bed.

  20. ENVIRONMENTAL BENZENE EXPOSURE ASSESSMENT FOR PARENT-CHILD PAIRS IN ROUEN, FRANCE

    E-Print Network [OSTI]

    Boyer, Edmond

    1 ENVIRONMENTAL BENZENE EXPOSURE ASSESSMENT FOR PARENT-CHILD PAIRS IN ROUEN, FRANCE Amin KOUNIALIa environmental benzene exposure. In this study we compared personal benzene exposure and inhalation uptake in a group of children to those of their parents. We also compared levels of urinary benzene metabolites

  1. Modeling the Pi-electrons of Benzene as Particles in a Ring Frank Rioux

    E-Print Network [OSTI]

    Rioux, Frank

    Modeling the Pi-electrons of Benzene as Particles in a Ring Frank Rioux In this exercise benzene circumference is approximated as six benzene carbon-carbon bond lengths. h 6.6260755 10 34 joule sec c 2 in the ultraviolet just outside the visible range of the electromagnetic spectrum and benzene is a colorless liquid

  2. Phenol-benzene complexation dynamics: Quantum chemistry calculation, molecular dynamics simulations, and two dimensional IR spectroscopy

    E-Print Network [OSTI]

    Fayer, Michael D.

    Phenol-benzene complexation dynamics: Quantum chemistry calculation, molecular dynamics simulations the nature and dynamics of the phenol-benzene complex in the mixed solvent, benzene/CCl4. Under thermal used for the phenol-benzene interaction in the MD simulations is in good accord with the highest level

  3. The water-benzene interaction: Insight from electronic structure theories Jie Ma,1,2,3

    E-Print Network [OSTI]

    Alfè, Dario

    The water-benzene interaction: Insight from electronic structure theories Jie Ma,1,2,3 Dario Alfè,2 theories is challenging. Here we assess the ability of a variety of theories to describe a water-benzene- tween water and benzene. Water benzene is an interesting model system because it is a reasonably small

  4. Benzene quadrupolarity and arene-arene interactions Zhengyu Wu and Rainer Glaser*

    E-Print Network [OSTI]

    Glaser, Rainer

    1 Benzene quadrupolarity and arene-arene interactions Zhengyu Wu and Rainer Glaser* Department in employing benzenes as lateral synthons in crystal engineering. We recently synthesized a series of perfectly organic NLO crystals. The benzene-benzene T-contact plays a critical role in stabilizing the crystal

  5. AEDP & Healthcare Reform Dipti Patel, FSA, MAAA

    E-Print Network [OSTI]

    Hong, Don

    Cigna AEDP & Healthcare Reform Dipti Patel, FSA, MAAA March 19, 2012 #12; Introductions Introducing... Cigna An overview of the AEDP Healthcare Reform Questions and Answers Overview #12 Branding ­ "GO YOU" · Things are changing ­ Health Care Reform · Young, energetic, executive leadership

  6. What's right SHIP & Healthcare Reform Forum

    E-Print Network [OSTI]

    Walker, Matthew P.

    &Health Reform What's right for you SHIP & Healthcare Reform Forum: What's Right for You This session will help you: * demystify the healthcare reform changes * explore your options * learn how

  7. Hydrology Days 2014 Thermally Enhanced Attenuation of Substituted Benzenes

    E-Print Network [OSTI]

    at temperatures ranging from 10°C to 30°C, and biogas production has been monitored. Thus far, substituted benzene microcosms have produced less biogas than previous petroleum microcosm studies. This suggests

  8. Quantitative Measurement of Integrated Band Intensities of Benzene...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    cm-1. The spectra were recorded at a resolution of 0.112 cm-1 using a commercial Fourier transform spectrometer. The pressure of each benzene vapor sample was measured using...

  9. Understanding Educational Reforms: Physics Education Research

    E-Print Network [OSTI]

    Colorado at Boulder, University of

    Understanding Educational Reforms: Impacts of Physics Education Research Steven Pollock Physics Science Education Scientifically Theoretical frames Student concepts and engagement Curricular reforms

  10. Atmosphere-Water Interaction of Chloroform, Toluene, and MTBE in Small Perennial Urban Streams

    E-Print Network [OSTI]

    Atmosphere-Water Interaction of Chloroform, Toluene, and MTBE in Small Perennial Urban Streams-butyl ether (MTBE) are frequently detected VOCs in the atmosphere, surface water, and ground water in urban not be the predominant source of chloroform and toluene in the two urban streams. In contrast, MTBE may be coming from

  11. Intermolecular CH bond activation of benzene and pyridines by a vanadium(III) alkylidene including a stepwise conversion of benzene to

    E-Print Network [OSTI]

    McQuade, D. Tyler

    Intermolecular C­H bond activation of benzene and pyridines by a vanadium(III) alkylidene including a stepwise conversion of benzene to a vanadium-benzyne complex Jose G. Andino,a Uriah J. Kilgore,a Maren Pink of benzene and pyridine is observed with (PNP)V(CH2tBu)2 (1), and in the case of benzene, the formation

  12. One-Photon Mass-Analyzed Threshold Ionization Spectroscopy of Bis(6-benzene)chromium and Its Benzene and Ar Clusters

    E-Print Network [OSTI]

    Kim, Sang Kyu

    One-Photon Mass-Analyzed Threshold Ionization Spectroscopy of Bis(6-benzene)chromium and Its Benzene and Ar Clusters Kyo-Won Choi and Sang Kyu Kim* Department of Chemistry and School of Molecular-analyzed threshold ionization (MATI) spectroscopy of bis(6-benzene)chromium is reported. The adiabatic ionization

  13. Microbial degradation of toluene under sulfate-reducing conditions and the influence of iron on the process

    SciTech Connect (OSTI)

    Beller, H.R.; Grbic-Galic, D.; Reinhard, M.

    1992-01-01T23:59:59.000Z

    Toluene degradation occurred concomitantly with sulfate reduction in anaerobic microcosms inoculated with contaminated subsurface soil from an aviation fuel storage facility near the Patuxent River (Md.). Similar results were obtained from enrichment cultures in which toluene was the sole carbon source. Several lines of evidence suggest that toluene degradation was directly coupled to sulfate reduction in Patuxent River microcosms and enrichment cultures: (1) the two processes were synchronous and highly correlated, (2) the observed stoichiometric ratios of moles of sulfate consumed per mole of toluene consumed were consistent with the theoretical ratio for the oxidation of toluene to CO2 coupled with the reduction of sulfate to hydrogen sulfide, and (3) toluene degradation ceased when sulfate was depleted, and conversely, sulfate reduction ceased when toluene was depleted. Mineralization of toluene was confirmed in experiments with (ring-U-14C)toluene. The addition of millimolar concentrations of amorphous Fe(OH)3 to Patuxent River microcosms and enrichment cultures either greatly facilitated the onset of toluene degradation or accelerated the rate once degradation had begun. In iron-amended microcosms and enrichment cultures, ferric iron reduction proceeded concurrently with toluene degradation and sulfate reduction. Stoichiometric data and other observations indicate that ferric iron reduction was not directly coupled to toluene oxidation but was a secondary, presumably abiotic, reaction between ferric iron and biogenic hydrogen sulfide. (Copyright (c) 1992, American Society for Microbiology.)

  14. Microbial degradation of toluene under sulfate-reducing conditions and the influence of iron on the process

    SciTech Connect (OSTI)

    Beller, H.R.; Grbic-Galic, D.; Reinhard, M. (Stanford Univ., CA (United States))

    1992-03-01T23:59:59.000Z

    Toluene degradation occurred concomitantly with sulfate reduction in anaerobic microcosms inoculated with contaminated subsurface soil from an aviation fuel storage facility near the Patuxent River (Md.). Similar results were obtained for enrichment cultures in which toluene was the sole carbon source. Several lines of evidence suggest that toluene degradation was directly coupled to sulfate reduction in Patuxent River microcosms and enrichment cultures: (1) the two processes were synchronous and highly correlated, (2) the observed stoichiometric ratios of moles of sulfate consumed per mole of toluene consumed were consistent with the theoretical ratio for the oxidation of toluene to CO{sub 2} coupled with the reduction of sulfate to hydrogen sulfide, and (3) toluene degradation ceased when sulfate was depleted, and conversely, sulfate reduction ceased when toluene was depleted. Mineralization of toluene was confirmed in experiments with (ring-U-{sup 14}C)toluene. The addition of millimolar concentrations of amorphous Fe(OH){sub 3} to Patuxent River microcosms and enrichment cultures either greatly facilitated the onset of toluene degradation or accelerated the rate once degradation had begun. In iron-amended microcosms and enrichment cultures, ferric iron reduction proceeded concurrently with toluene degradation and sulfate reduction. Stoichiometric data and other observations indicate that ferric iron reduction was not directly coupled to toluene oxidation but was a secondary, presumably abiotic, reaction between ferric iron and biogenic hydrogen sulfide.

  15. SYNTHESIS OF THE FULLY PROTECTED PHOSPHORAMIDITE OF THE BENZENE-DNA ADDUCT, N2- (4-HYDROXYPHENYL)-2'-DEOXYGUANOSINE AND INCORPORATION OF THE LATER INTO DNA OLIGOMERS

    E-Print Network [OSTI]

    Huang, Bo

    2008-01-01T23:59:59.000Z

    associated with low-level benzene exposure. EpidemiologyC. C. An overview of benzene metabolism. Environ. Healthstudies of human exposure to benzene in China and Europe An

  16. Autothermal reforming of sulfur-free and sulfur-containing hydrocarbon liquids

    SciTech Connect (OSTI)

    Not Available

    1981-10-01T23:59:59.000Z

    The mechanisms by which various fuel component hydrocarbons related to both heavy petroleum and coal-derived liquids are converted to hydrogen without forming carbon were investigated. Reactive differences between paraffins and aromatics in autothermal reforming (ATR) were shown to be responsible for the observed fuel-specific carbon formation characteristics. The types of carbon formed in the reformer were identified by SEM and XRD analyses of catalyst samples and carbon deposits. From tests with both light and heavy paraffins and aromatics, it is concluded that high boiling point hydrocarbons and polynuclear aromatics enhance the propensity for carbon formation. The effects of propylene addition on the ATR performance of benzene are described. In ATR tests with mixtures of paraffins and aromatics, synergistic effects on conversion characteristics were identified. Indications that the sulfur content of the fuel may be the limiting factor for efficient ATR operation were found. The conversion and degradation effects of the sulfur additive (thiophene) were examined.

  17. The Mathematician and the Mathematics Education Reform

    E-Print Network [OSTI]

    Wu, Hung-Hsi

    The Mathematician and the Mathematics Education Reform H. Wu Department of Mathematics #3840 of [education] reform?" ([EW], p.671) With the current mathematics education reform movement in place for al- most a decade, Moore's words of a century ago become all the more relevant now. The "reform" referred

  18. Multipath Curved Planar Reformation of the Peripheral

    E-Print Network [OSTI]

    Multipath Curved Planar Reformation of the Peripheral Arterial Tree in CT Angiography1 Justus that cause artifacts in multipath curved planar reformations (MPCPRs) of the peripheral arterial tree in 10-oblique multiplanar reformations perpendicular to the ves- sel centerline (10), and curved planar reformations

  19. Optimization of Multiplanar Reformations from Isotropic

    E-Print Network [OSTI]

    Optimization of Multiplanar Reformations from Isotropic Data Sets Acquired with 16­ Detector Row coronal reformations at vari- ous thicknesses were ranked qualitatively by three radiol- ogists. Effective reformations of data acquired in the custom phantom were compared, coronal reformations obtained with the 16

  20. Toward a Reformalization of QSIM Benjamin Shults

    E-Print Network [OSTI]

    Kuipers, Benjamin

    Toward a Reformalization of QSIM Benjamin Shults Department of Mathematics University of Texas is to reformalize part of the framework of the Guaranteed Coverage Theorem for QSIM. The intention is not to reformalize every detail of the proof but merely to mention some areas whose reformalization lends deeper

  1. Products of the Benzene + O(3P) Reaction

    SciTech Connect (OSTI)

    Taatjes, Craig A.; Osborn, David L.; Selby, Talitha M.; Meloni, Giovanni; Trevitt, Adam J.; Epifanovsky, Evgeny; Krylov, Anna I.; Sirjean, Baptiste; Dames, Enoch; Wang, Hai

    2010-01-01T23:59:59.000Z

    The gas-phase reaction of benzene with O(3P) is of considerable interest for modeling of aromatic oxidation, and also because there exist fundamental questions concerning the prominence of intersystem crossing in the reaction. While its overall rate constant has been studied extensively, there are still significant uncertainties in the product distribution. The reaction proceeds mainly through the addition of the O atom to benzene, forming an initial triplet diradical adduct, which can either dissociate to form the phenoxy radical and H atom or undergo intersystem crossing onto a singlet surface, followed by a multiplicity of internal isomerizations, leading to several possible reaction products. In this work, we examined the product branching ratios of the reaction between benzene and O(3P) over the temperature range 300?1000 K and pressure range 1?10 Torr. The reactions were initiated by pulsed-laser photolysis of NO2 in the presence of benzene and helium buffer in a slow-flow reactor, and reaction products were identified by using the multiplexed chemical kinetics photoionization mass spectrometer operating at the Advanced Light Source (ALS) of Lawrence Berkeley National Laboratory. Phenol and phenoxy radical were detected and quantified. Cyclopentadiene and cyclopentadienyl radical were directly identified for the first time. Finally, ab initio calculations and master equation/RRKM modeling were used to reproduce the experimental branching ratios, yielding pressure-dependent rate expressions for the reaction channels, including phenoxy + H, phenol, cyclopentadiene + CO, which are proposed for kinetic modeling of benzene oxidation.

  2. Products of the Benzene + O(3P) Reaction

    SciTech Connect (OSTI)

    Taatjes, Craig A.; Osborn, David L.; Selby, Talitha M.; Meloni, Giovanni; Trevitt, Adam J.; Epifanovsky, Evgeny; Krylov, Anna I.; Sirjean, Baptiste; Dames, Enoch; Wang, Hai

    2009-12-21T23:59:59.000Z

    The gas-phase reaction of benzene with O(3P) is of considerable interest for modeling of aromatic oxidation, and also because there exist fundamental questions concerning the prominence of intersystem crossing in the reaction. While its overall rate constant has been studied extensively, there are still significant uncertainties in the product distribution. The reaction proceeds mainly through the addition of the O atom to benzene, forming an initial triplet diradical adduct, which can either dissociate to form the phenoxy radical and H atom, or undergo intersystem crossing onto a singlet surface, followed by a multiplicity of internal isomerizations, leading to several possible reaction products. In this work, we examined the product branching ratios of the reaction between benzene and O(3P) over the temperature range of 300 to 1000 K and pressure range of 1 to 10 Torr. The reactions were initiated by pulsed-laser photolysis of NO2 in the presence of benzene and helium buffer in a slow-flow reactor, and reaction products were identified by using the multiplexed chemical kinetics photoionization mass spectrometer operating at the Advanced Light Source (ALS) of Lawrence Berkeley National Laboratory. Phenol and phenoxy radical were detected and quantified. Cyclopentadiene and cyclopentadienyl radical were directly identified for the first time. Finally, ab initio calculations and master equation/RRKM modeling were used to reproduce the experimental branching ratios, yielding pressure-dependent rate expressions for the reaction channels, including phenoxy + H, phenol, cyclopentadiene + CO, which are proposed for kinetic modeling of benzene oxidation.

  3. Autoignition of toluene reference fuels at high pressures modeled with detailed chemical kinetics

    SciTech Connect (OSTI)

    Andrae, J.C.G. [Department of Chemical Engineering and Technology, Royal Institute of Technology, SE-100 44 Stockholm (Sweden); Shell Global Solutions, P.O. Box 1, Chester CH1 3SH (United Kingdom); Bjoernbom, P. [Department of Chemical Engineering and Technology, Royal Institute of Technology, SE-100 44 Stockholm (Sweden); Cracknell, R.F.; Kalghatgi, G.T. [Shell Global Solutions, P.O. Box 1, Chester CH1 3SH (United Kingdom)

    2007-04-15T23:59:59.000Z

    A detailed chemical kinetic model for the autoignition of toluene reference fuels (TRF) is presented. The toluene submechanism added to the Lawrence Livermore Primary Reference Fuel (PRF) mechanism was developed using recent shock tube autoignition delay time data under conditions relevant to HCCI combustion. For two-component fuels the model was validated against recent high-pressure shock tube autoignition delay time data for a mixture consisting of 35% n-heptane and 65% toluene by liquid volume. Important features of the autoignition of the mixture proved to be cross-acceleration effects, where hydroperoxy radicals produced during n-heptane oxidation dramatically increased the oxidation rate of toluene compared to the case when toluene alone was oxidized. Rate constants for the reaction of benzyl and hydroperoxyl radicals previously used in the modeling of the oxidation of toluene alone were untenably high for modeling of the mixture. To model both systems it was found necessary to use a lower rate and introduce an additional branching route in the reaction between benzyl radicals and O{sub 2}. Good agreement between experiments and predictions was found when the model was validated against shock tube autoignition delay data for gasoline surrogate fuels consisting of mixtures of 63-69% isooctane, 14-20% toluene, and 17% n-heptane by liquid volume. Cross reactions such as hydrogen abstractions between toluene and alkyl and alkylperoxy radicals and between the PRF were introduced for completion of chemical description. They were only of small importance for modeling autoignition delays from shock tube experiments, even at low temperatures. A single-zone engine model was used to evaluate how well the validated mechanism could capture autoignition behavior of toluene reference fuels in a homogeneous charge compression ignition (HCCI) engine. The model could qualitatively predict the experiments, except in the case with boosted intake pressure, where the initial temperature had to be increased significantly in order to predict the point of autoignition. (author)

  4. Changes in the peripheral blood transcriptome associated with occupational benzene exposure identified by cross-comparison on two microarray platforms

    E-Print Network [OSTI]

    Ajo-Franklin, Jonathan

    Changes in the peripheral blood transcriptome associated with occupational benzene exposure Available online 20 January 2009 Keywords: Benzene exposure Gene expression Human blood Toxicogenomics expression changes associated with well-characterized occupational benzene exposure in the peripheral blood

  5. THE JOURNAL OF CHEMICAL PHYSICS 134, 134701 (2011) Binding of hydrogen on benzene, coronene, and graphene from quantum

    E-Print Network [OSTI]

    Alfè, Dario

    2011-01-01T23:59:59.000Z

    THE JOURNAL OF CHEMICAL PHYSICS 134, 134701 (2011) Binding of hydrogen on benzene, coronene the binding energy curves of hydrogen on benzene, coronene, and graphene. The DMC results on benzene agree

  6. Before the House Oversight and Government Reform Subcommittee...

    Office of Environmental Management (EM)

    Oversight and Government Reform Subcommittee on Technology, Information Policy, Intergovernmental Relations, and Procurement Reform Before the House Oversight and Government Reform...

  7. Benzene/nitrous oxide flammability in the precipitate hydrolysis process

    SciTech Connect (OSTI)

    Jacobs, R A [Du Pont de Nemours (E.I.) and Co., Aiken, SC (USA). Savannah River Lab.

    1989-09-18T23:59:59.000Z

    The HAN (hydroxylamine nitrate) process for destruction of nitrite in precipitate hydrolysis produces nitrous oxide (N2O) gas as one of the products. N2O can form flammable mixtures with benzene which is also present due to radiolysis and hydrolysis of tetraphenylborate. Extensive flame modeling and explosion testing was undertaken to define the minimum oxidant for combustion of N2O/benzene using both nitrogen and carbon dioxide as diluents. The attached memorandum interprets and documents the results of the studies.

  8. Benzene formation in the inner regions of protostellar disks

    E-Print Network [OSTI]

    Paul M. Woods; Karen Willacy

    2006-12-08T23:59:59.000Z

    Benzene (c-C6H6) formation in the inner 3 AU of a protostellar disk can be efficient, resulting in high abundances of benzene in the midplane region. The formation mechanism is different to that found in interstellar clouds and in protoplanetary nebulae, and proceeds mainly through the reaction between allene (C3H4) and its ion. This has implications for PAH formation, in that some fraction of PAHs seen in the solar system could be native rather than inherited from the interstellar medium.

  9. Synthesis of macroporous poly(styrene-divinyl benzene) microspheres by surfactant reverse micelles swelling method

    E-Print Network [OSTI]

    Gu, Tingyue

    Synthesis of macroporous poly(styrene-divinyl benzene) microspheres by surfactant reverse micelles poly(styrene-divinyl benzene) microspheres with pore size of about 500 nm were prepared by a new method

  10. Supramolecular assemblies of 1,4-benzene diboronic acid on KCl(001)

    E-Print Network [OSTI]

    Boyer, Edmond

    Supramolecular assemblies of 1,4-benzene diboronic acid on KCl(001) Rémy Pawlak, Laurent Nony The self-assembly of benzene diboronic acid molecules on KCl(001) is investigated at room temperature

  11. Sources and distribution of CuO-derived benzene carboxylic acids in soils and sediments

    E-Print Network [OSTI]

    Long, Bernard

    Sources and distribution of CuO-derived benzene carboxylic acids in soils and sediments Angela F vas- cular plant-derived OC, through the environment. The method produces a suite of benzene

  12. Insights into the different dioxygen activation pathways of methane and toluene monooxygenase hydroxylases

    E-Print Network [OSTI]

    Bochevarov, Arteum D.

    The methane and toluene monooxygenase hydroxylases (MMOH and TMOH, respectively) have almost identical active sites, yet the physical and chemical properties of their oxygenated intermediates, designated P*, H[subscript ...

  13. New packing in absorption systems for trapping benzene from coke-oven gas

    SciTech Connect (OSTI)

    V.V. Grabko; V.M. Li; T.A. Shevchenko; M.A. Solov'ev [Giprokoks, the State Institute for the Design of Coke-Industry Enterprises, Kharkov (Ukraine)

    2009-07-15T23:59:59.000Z

    The efficiency of benzene removal from coke-oven gas in absorption units OAO Alchevskkoks with new packing is assessed.

  14. Effect of ozonation on the composition of crude coal-tar benzene

    SciTech Connect (OSTI)

    Semenova, S.A.; Patrakov, Y.F. [Russian Academy of Sciences, Kemerovo (Russian Federation)

    2007-05-15T23:59:59.000Z

    The effect of ozonation on the composition of crude benzene produced by the coal-tar chemical industry was studied.

  15. Using urinary biomarkers to elucidate dose-related patterns of human benzene metabolism

    E-Print Network [OSTI]

    California at Berkeley, University of

    Using urinary biomarkers to elucidate dose-related patterns of human benzene metabolism Sungkyoon; Fax: þ1 919 966 0521; Email: stephen_rappaport@unc.edu Although the toxicity of benzene has been, particularly at low levels of exposure. We investigated unmetabolized benzene in urine (UBz) and all major

  16. Modeling benzene plume elongation mechanisms exerted by ethanol using RT3D with a general

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    Modeling benzene plume elongation mechanisms exerted by ethanol using RT3D with a general substrate ethanol on benzene fate and transport in fuel-contaminated groundwater and to discern the most influential benzene plume elongation mechanisms. The model, developed as a module for the Reactive Transport in 3

  17. Measurements of benzene concentration by difference-frequency laser absorption spectroscopy

    E-Print Network [OSTI]

    Measurements of benzene concentration by difference-frequency laser absorption spectroscopy Weidong Chen, Fabrice Cazier, Frank Tittel, and Daniel Boucher Measurements of benzene concentration based:sapphire lasers in a GaSe nonlinear optical crystal. A minimum benzene concentration detection of 11.5 parts

  18. The Mechanism of Benzene-induced Leukemia: A Hypothesis and Speculations on

    E-Print Network [OSTI]

    California at Berkeley, University of

    The Mechanism of Benzene-induced Leukemia: A Hypothesis and Speculations on the Causes of Leukemia hypothesis for benzene-induced leukemia is proposed. Key components of the hypothesis include a) activation of benzene in the liver to phenolic metabolites; b) transport of these metabo- lites to the bone marrow

  19. Carcinogenesis vol.19 no.9 pp.15651571, 1998 Hemoglobin and albumin adducts of benzene oxide among

    E-Print Network [OSTI]

    California at Berkeley, University of

    Carcinogenesis vol.19 no.9 pp.1565­1571, 1998 Hemoglobin and albumin adducts of benzene oxide among workers exposed to high levels of benzene Karen Yeowell-O'Connell, Nathaniel Rothman1, Martyn T.Smith2_rappaport@unc.edu Benzene oxide (BO) reacts with cysteinyl residues in hemo- globin (Hb) and albumin (Alb) to form protein

  20. Grain boundary premelting in crystalline benzene as studied by proton N.M.R.

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    2489 Grain boundary premelting in crystalline benzene as studied by proton N.M.R. C. J. Craven. 2014 The phenomenon of premelting has been investigated by proton n.m.r. in polycrystalline benzene in the case of polycrystalline benzene in which the molecular dynamics feature is essentially analogous

  1. Kekule's Benzene Structure: A Case Study of Teaching Usefulness of Symmetry

    E-Print Network [OSTI]

    Kreinovich, Vladik

    Kekul´e's Benzene Structure: A Case Study of Teaching Usefulness of Symmetry Olga Kosheleva1 at El Paso 500 W. University El Paso, TX 79968, USA olgak@utep.edu, vladik@utep.edu Abstract Benzene is one of the basic building blocks of organic molecules. One of the reasons for benzene's ubiquity

  2. Response to Comment on "Adsorption and Electronic States of Benzene on Ordered MgO

    E-Print Network [OSTI]

    Goodman, Wayne

    Response to Comment on "Adsorption and Electronic States of Benzene on Ordered MgO and Al2O3 Thin on the electronic states of benzene adsorbed on two metal oxides,1 particularly for pointing out a reference to recent work on the vibronic spectra of solid benzene,2 the dearth of which we lamented

  3. 946 volume 117 | number 6 | June 2009 Environmental Health Perspectives Benzene is an important industrial chem-

    E-Print Network [OSTI]

    California at Berkeley, University of

    946 volume 117 | number 6 | June 2009 · Environmental Health Perspectives Research Benzene smoke [International Agency for Research on Cancer (IARC) 1989]. In fact, benzene is truly ubiq- uitous million in some workplaces (IARC 1989; Wallace 1996). This is worrisome because benzene causes leukemia

  4. Discovery of benzene cation in a very long-lived excited electronic state Myung Soo Kima)

    E-Print Network [OSTI]

    Kim, Myung Soo

    Discovery of benzene cation in a very long-lived excited electronic state Myung Soo Kima) and Chan, University of Suwon, Suwon 440-600, Korea Received 19 May 2000; accepted 8 September 2000 Presence of benzene chemistry. © 2000 American Institute of Physics. S0021-9606 00 01745-1 I. INTRODUCTION The benzene molecular

  5. Thermal decomposition of norbornane (bicyclo[2.2.1]heptane) dissolved in benzene.

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Thermal decomposition of norbornane (bicyclo[2.2.1]heptane) dissolved in benzene. Experimental (dissolved in benzene) has been studied in a jet stirred reactor at temperatures between 873 and 973 K decomposition of the norbornane ­ benzene binary mixture has been performed. Reactions involved in the mechanism

  6. Population Toxicokinetics of Benzene Frederic Yves Bois,1 Elise T. Jackson,1 Kaija Pekari,2 and

    E-Print Network [OSTI]

    California at Berkeley, University of

    Population Toxicokinetics of Benzene Frederic Yves Bois,1 Elise T. Jackson,1 Kaija Pekari,2 these problems. As an example, we modeled the distribution and metabolism of benzene in humans. We derive statistical distributions for the parameters of a physiological model of benzene, on the basis of existing

  7. Electronvibration coupling in time-dependent density-functional theory: Application to benzene

    E-Print Network [OSTI]

    Bertsch George F.

    Electron­vibration coupling in time-dependent density-functional theory: Application to benzene G://jcp.aip.org/about/rights_and_permissions #12;Electron­vibration coupling in time-dependent density-functional theory: Application to benzene G for electron­vibration coupling, we apply it to the optical properties of the ­ * transitions in benzene

  8. Electronvibration coupling in time-dependent density-functional theory: Application to benzene

    E-Print Network [OSTI]

    Bertsch George F.

    Electron­vibration coupling in time-dependent density-functional theory: Application to benzene G for electron­vibration coupling, we apply it to the optical properties of the ­ * transitions in benzene with the electronic excitations. In this work, we have chosen the benzene model for an exploratory study

  9. Chemisorption of benzene and STM dehydrogenation products on Cu,,100... N. Lorente*

    E-Print Network [OSTI]

    Persson, Mats

    Chemisorption of benzene and STM dehydrogenation products on Cu,,100... N. Lorente* Laboratoire of individual chemisorbed benzene molecules on Cu 100 has recently been performed in atomic manipulation experiments J. Phys. Chem. A. 104, 2463 2000 ; Surf. Sci 451, 219 2000 . Benzene dissociates under controlled

  10. Electron Transfer Catalyzed [2 + 2] Cycloreversion of Benzene G. Devi Reddy and Olaf Wiest*

    E-Print Network [OSTI]

    Hudlicky, Tomas

    Electron Transfer Catalyzed [2 + 2] Cycloreversion of Benzene Dimers G. Devi Reddy and Olaf Wiest, Florida 32611-7200 Received December 8, 1998 The catalysis of the [2 + 2] cycloreversion of the anti-o,o-benzene dimer 1 and the syn-o,o- naphthalene-benzene dimer 2 through thermal and photoinduced electron transfer

  11. Anaerobic Benzene Oxidation in the Fe(III) Reduction Zone of

    E-Print Network [OSTI]

    Lovley, Derek

    Anaerobic Benzene Oxidation in the Fe(III) Reduction Zone of Petroleum-Contaminated Aquifers R O B North, University of Massachusetts, Amherst, Massachusetts 01003 The potential for anaerobic benzene. [14C]Benzene was not oxidized to 14CO2 at most sites examined, which is consistent with previous

  12. Benzene Increases Aneuploidy in the Lymphocytes of Exposed Workers: A Comparison of Data Obtained by

    E-Print Network [OSTI]

    California at Berkeley, University of

    Benzene Increases Aneuploidy in the Lymphocytes of Exposed Workers: A Comparison of Data Obtained Benzene is an established human leukemogen that increases the level of chromosome aberrations in lym and 8 in healthy benzene-exposed human subjects. Metaphase and interphase cells from the peripheral

  13. An Epidemiologic Study of Early Biologic Effects of Benzene in Chinese Workers

    E-Print Network [OSTI]

    California at Berkeley, University of

    An Epidemiologic Study of Early Biologic Effects of Benzene in Chinese Workers Nathaniel Rothman,1 and Anti-Epidemic Center, Shanghai, China Benzene is a recognized hematotoxin and leukemogen, but its a cross-sectional study of 44 healthy workers currently exposed to benzene (median 8-hr time

  14. Modulation of the Toxicity and Macromolecular Binding of Benzene Metabolites by NAD(P)H:Quinone

    E-Print Network [OSTI]

    California at Berkeley, University of

    Articles Modulation of the Toxicity and Macromolecular Binding of Benzene Metabolites by NAD, San Francisco, California 94143-0560 Received April 17, 1998 Benzene is oxidized in the liver of benzene metabolite toxicity. NQO1 expression reduced a class of hydroquinone- and benzenetriol-induced DNA

  15. Decreased levels of CXC-chemokines in serum of benzene-exposed workers identified by

    E-Print Network [OSTI]

    California at Berkeley, University of

    Decreased levels of CXC-chemokines in serum of benzene-exposed workers identified by array (received for review October 3, 2004) Benzene is an important industrial chemical and environmental contaminant that causes leukemia. To obtain mechanistic insight into benzene's mechanism of action, we

  16. Current Collapse in Tunneling Transport through Benzene M. H. Hettler,1

    E-Print Network [OSTI]

    Current Collapse in Tunneling Transport through Benzene M. H. Hettler,1 W. Wenzel,1 M. R. Wegewijs; published 20 February 2003) We investigate the electrical transport through a system of benzene coupled model for the electrons of the benzene is derived that includes general two-body interactions. After

  17. Mechanisms for the formation of benzene in the atmosphere of Titan E. H. Wilson1

    E-Print Network [OSTI]

    Atreya, Sushil

    Mechanisms for the formation of benzene in the atmosphere of Titan E. H. Wilson1 and S. K. Atreya (PAHs) are important interstellar species, and their precursor benzene (C6H6) has been detected in our solar system. In this study the possibility of benzene formation in the atmosphere of Titan

  18. Benzene is an important industrial chemical (> 2 billion gallons produced annually in the

    E-Print Network [OSTI]

    California at Berkeley, University of

    Benzene is an important industrial chemical (> 2 billion gallons produced annually in the United leukemia (Snyder 2002). However, the mechanisms of benzene-induced hematotoxicity and leukemo- genesis further light on these mechanisms and better understand the risk benzene poses, we examined the effects

  19. Negative Differential Conductance in a Benzene-Molecular Device Maarten R. Wegewijs1

    E-Print Network [OSTI]

    Negative Differential Conductance in a Benzene-Molecular Device Maarten R. Wegewijs1 , Matthias (Received August 14, 2002) KEYWORDS: molecular, tunneling, transport, benzene, blocking 1. Introduction of the molecular orbitals leads to nontrivial current voltage (I-V ) characteristics.6,7) Using benzene

  20. Evidence of a tilted columnar structure for mesomorphic phases of benzene-hexa-n-alkanoates

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1285 Evidence of a tilted columnar structure for mesomorphic phases of benzene-hexa-n-alkanoates F. 2014 Optical observations on the mesomorphs of benzene-hexa-n-alkanoates, and their admixtures with benzene, show that the planes of these discotic molecules are not perpendicular to the columns in which

  1. OH-initiated oxidation of benzene Part I. Phenol formation under atmospheric conditions

    E-Print Network [OSTI]

    OH-initiated oxidation of benzene Part I. Phenol formation under atmospheric conditions Rainer-radical initiated oxidation of benzene was studied in two simulation chambers: (1) the large-volume outdoor chamber-red spectroscopy (FTIR) were used to simultaneously measure phenol and benzene. The second study used only FTIR

  2. LETTER TO THE EDITOR Regarding ``Meta-analysis and Causal Inference: A Case Study of Benzene

    E-Print Network [OSTI]

    California at Berkeley, University of

    LETTER TO THE EDITOR Regarding ``Meta-analysis and Causal Inference: A Case Study of Benzene of a causal association between non-Hodgkin lymphoma (NHL) and benzene and between NHL and petroleum refinery identified provide ``further evidence that benzene exposure causes NHL.'' However, his review of each

  3. Molecular dynamics simulations of the effects of salts on the aggregation properties of benzene in water.

    SciTech Connect (OSTI)

    Smith, P. E.

    2003-07-16T23:59:59.000Z

    The specific aims of the project were: to provide an atomic level description of the interactions between benzene, water and ions in solutions. To determine the degree of association between two benzene molecules in aqueous and salt solutions. To investigate the structure and dynamics of the interface between benzene and water or salt solution.

  4. Group Theoretical Analysis of the Vibrational and Electronic Spectrum of Benzene Frank Rioux

    E-Print Network [OSTI]

    Rioux, Frank

    Group Theoretical Analysis of the Vibrational and Electronic Spectrum of Benzene Frank Rioux CSB|SJU This tutorial deals with the interpretation of the vibrational and electronic spectra of benzene using group benzene's electrons. The symmetry of the relevant -electron molecular orbitals is determined by examining

  5. Viscosity and reptation time in polystyrene-benzene semidilute solutions M. Adam and M. Delsanti

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    L-523 Viscosity and reptation time in polystyrene-benzene semidilute solutions M. Adam and M viscosity ~ and reptation time TR in semidilute polystyrene-benzene solutions. We have obtained, our aim is to study the viscoelastic properties of polystyrene-benzene systems in a well defined

  6. The benzene molecule as a molecular resonant-tunneling transistor M. Di Ventraa)

    E-Print Network [OSTI]

    Pantelides, Sokrates T.

    The benzene molecule as a molecular resonant-tunneling transistor M. Di Ventraa) and S. T of transport through a benzene-1, 4-dithiolate molecule with a third capacitive terminal gate . We find rectification was demonstrated in 1993.2 More recently, Reed et al. investigated the benzene-1, 4-dithiol rings

  7. Distorted benzene bearing two bulky substituents on adjacent positions: structure of

    E-Print Network [OSTI]

    Kaszynski, Piotr

    Distorted benzene bearing two bulky substituents on adjacent positions: structure of 1,2-bis(1,2-dicarba-closo-dodecaboran-1-yl)benzene Yasuyuki Endo,a,* Chalermkiat Songkram,b Kiminori Ohta,a Piotr analysis of 1,2-bis(o-carboranyl)benzene were performed to examine the steric effects of the two extremely

  8. EFFECTS OF BENZENE (A TOXIC COMPONENT OF PETROLEUM) ON SPAWNING PACIFIC HERRING, CLUPEA HARENGUS PALLASI

    E-Print Network [OSTI]

    EFFECTS OF BENZENE (A TOXIC COMPONENT OF PETROLEUM) ON SPAWNING PACIFIC HERRING, CLUPEA HARENGUS and larvae through yolk absorption, 43%. Exposure to benzene also induced premature spawning and resulted-labeled benzene and/or metabolites in ovarian eggs (14 times initial concentration in water in 24-48 h; 1.4 ILlig

  9. Resonant ion-dip infrared spectroscopy of benzene,,water...9: Expanding the cube

    E-Print Network [OSTI]

    Zwier, Timothy S.

    Resonant ion-dip infrared spectroscopy of benzene­,,water...9: Expanding the cube Christopher J the hydrogen-bonding topologies of three isomers of benzene­ water 9. Isomers I and II, with R2PI transitions shifted, respectively, by 77 and 63 cm 1 from the benzene monomer, have similar intensities in the R2PI

  10. Noncovalent interaction or chemical bonding between alkaline earth cations and benzene? A quantum chemistry study using

    E-Print Network [OSTI]

    Sussman, Joel L.

    Noncovalent interaction or chemical bonding between alkaline earth cations and benzene? A quantum earth metal ion±benzene complexes were performed using the density-functional theory (DFT) B3LYP and ab of the al- kaline earth metal ions to benzene may be attributed to s±p and p±p interactions, which are signi

  11. Two-dimensional 1,3,5-Tris(4-carboxyphenyl)benzene self-assembly at

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Two-dimensional 1,3,5-Tris(4-carboxyphenyl)benzene self-assembly at the 1-phenyloctane-assembly of star-shaped 1,3,5-Tris(4-carboxyphenyl)benzene molecules is investigated. Scanning tunneling microscopy.22 showed that 1,3,5-Tris(4-carboxyphenyl)benzene star-shaped molecules can form two distinc self

  12. UPTAKE, DISTRIBUTION, AND DEPURATION OF 14C-BENZENE IN NORTHERN ANCHOVY, ENGRAULIS MORDAX, AND

    E-Print Network [OSTI]

    UPTAKE, DISTRIBUTION, AND DEPURATION OF 14C-BENZENE IN NORTHERN ANCHOVY, ENGRAULIS MORDAX striped bass, Morone saxatilis, were exposed to sublethal concentra- tions of HC-benzene for 48 h exhibited a rapid uptake over a wide range of benzene concentrations in the water column. Accumulation

  13. Modeling and Optimal Regulation of Erythropoiesis Subject to Benzene Intoxication

    E-Print Network [OSTI]

    humans and laboratory animals [11, 16]. Increased incidence of acute myelogenous leukemia in humans obtained in vitro [5, 6]. Since in vitro metabolic parameters are also available for humans, the model could then be extrapolated to humans for risk assessment. Since benzene is a known human leukemogen

  14. Lithium-Mediated Benzene Adsorption on Graphene and Graphene Nanoribbons

    E-Print Network [OSTI]

    Hod, Oded

    Lithium-Mediated Benzene Adsorption on Graphene and Graphene Nanoribbons Dana Krepel and Oded Hod on lithium adsorption sites at the surface of graphene and nanoribbons thereof are investigated. The effects, bare lithium adsorption turns armchair graphene nanoribbons metallic and their zigzag counterparts half

  15. The Need for Language Repair The Reformation Algorithm Discussion Reformation: A Domain-Independent Algorithm

    E-Print Network [OSTI]

    St Andrews, University of

    The Need for Language Repair The Reformation Algorithm Discussion Reformation: A Domain of Edinburgh University of St Andrews, 27th November 2013 #12;The Need for Language Repair The Reformation Algorithm Discussion Outline 1 The Need for Language Repair 2 The Reformation Algorithm 3 Discussion #12;The

  16. Method of steam reforming methanol to hydrogen

    DOE Patents [OSTI]

    Beshty, Bahjat S. (Lower Makefield, PA)

    1990-01-01T23:59:59.000Z

    The production of hydrogen by the catalyzed steam reforming of methanol is accomplished using a reformer of greatly reduced size and cost wherein a mixture of water and methanol is superheated to the gaseous state at temperatures of about 800.degree. to about 1,100.degree. F. and then fed to a reformer in direct contact with the catalyst bed contained therein, whereby the heat for the endothermic steam reforming reaction is derived directly from the superheated steam/methanol mixture.

  17. Attrition resistant fluidizable reforming catalyst

    DOE Patents [OSTI]

    Parent, Yves O. (Golden, CO); Magrini, Kim (Golden, CO); Landin, Steven M. (Conifer, CO); Ritland, Marcus A. (Palm Beach Shores, FL)

    2011-03-29T23:59:59.000Z

    A method of preparing a steam reforming catalyst characterized by improved resistance to attrition loss when used for cracking, reforming, water gas shift and gasification reactions on feedstock in a fluidized bed reactor, comprising: fabricating the ceramic support particle, coating a ceramic support by adding an aqueous solution of a precursor salt of a metal selected from the group consisting of Ni, Pt, Pd, Ru, Rh, Cr, Co, Mn, Mg, K, La and Fe and mixtures thereof to the ceramic support and calcining the coated ceramic in air to convert the metal salts to metal oxides.

  18. Social scientists prompt educational reforms 2

    E-Print Network [OSTI]

    Shahriar, Selim

    Social scientists prompt educational reforms 2 Museum exhibit project 3 On the BookShelf 3 of the 1998 national curricula reforms. For Takehiko Kariya, a professor at the University of Tokyo's Graduate School of Education and one of the reforms' most vocal critics, this shift confirmed what his and other

  19. Patent Reform: Aligning Reward and Contribution

    E-Print Network [OSTI]

    Sadoulet, Elisabeth

    4 Patent Reform: Aligning Reward and Contribution Carl Shapiro, University of California major reforms to the patent system designed to spur innovation by better aligning the rewards, and strengthening the procedures by which patents are reexamined after they are issued. Three ad- ditional reforms

  20. Distributional Effects of WTO Agricultural Reforms

    E-Print Network [OSTI]

    Distributional Effects of WTO Agricultural Reforms in Rich and Poor Countries Roman Keeney Purdue Poverty Decrease (000s) Doha Poverty Decrease (000s) Full Reform #12;Farm Income changes for each scenario of Full Reforms -30 -25 -20 -15 -10 -5 0 Top 10% Median Bottom 10% Land Wealth Change Farm Net Worth

  1. Reformation May 30-June 15, 2013

    E-Print Network [OSTI]

    Peak, Derek

    Women of the Reformation Study Tour May 30-June 15, 2013 For more information, please contact Rev registrar.lts@usask.ca by January 29, 2013 We invite you to come and explore the Reformations with us! We hear a lot about the great reformers of the sixteenth century, people like Martin Luther, Phillip

  2. PER-Based Reform at a Multicultural

    E-Print Network [OSTI]

    Steinberg, Richard N.

    PER-Based Reform at a Multicultural Institution Some Lessons from Physics Education Research that the most suc- cessful reform strategies require significant interactions among students, and between students and instructor. It is therefore reasonable to wonder about the extent to which PER-based reform

  3. INTEGRAL CATALYTIC COMBUSTION/FUEL REFORMING

    E-Print Network [OSTI]

    INTEGRAL CATALYTIC COMBUSTION/FUEL REFORMING FOR GAS TURBINE Prepared For: California Energy REPORT (FAR) INTEGRAL CATALYTIC COMBUSTION/FUEL REFORMING FOR GAS TURBINE CYCLES EISG AWARDEE University://www.energy.ca.gov/research/index.html. #12;Page 1 Integral Catalytic Combustion/Fuel Reforming for Gas Turbine Cycles EISG Grant # 99

  4. Electronic structure of the benzene dimer cation Piotr A. Pieniazek, Anna I. Krylov, and Stephen E. Bradforth

    E-Print Network [OSTI]

    Krylov, Anna I.

    Electronic structure of the benzene dimer cation Piotr A. Pieniazek, Anna I. Krylov, and Stephen E-0482 Received 20 March 2007; accepted 22 May 2007; published online 31 July 2007 The benzene and benzene dimer benzene. Both sandwich and t-shaped structures feature intense charge resonance bands, whose location

  5. Synthesis, Structure, and Reactivity of O-Donor Ir(III) Complexes: C-H Activation Studies with Benzene

    E-Print Network [OSTI]

    Goddard III, William A.

    with Benzene Gaurav Bhalla, Xiang Yang Liu, Jonas Oxgaard, William A. Goddard, III, and Roy A. Periana. All the R-Ir-Py complexes undergo quantitative, intermolecular CH activation reactions with benzene to benzene to generate a discrete benzene complex, cis-R-Ir-PhH; and (D) rapid C-H cleavage. Kinetic isotope

  6. PHYSICAL REVIEW B 86, 245405 (2012) Benzene adsorbed on metals: Concerted effect of covalency and van der Waals bonding

    E-Print Network [OSTI]

    Alavi, Ali

    2012-01-01T23:59:59.000Z

    PHYSICAL REVIEW B 86, 245405 (2012) Benzene adsorbed on metals: Concerted effect of covalency, but the role of the vdW energy in chemisorbed systems remains unclear. Here we study the interaction of benzene of covalently bonded benzene than they do when benzene is physisorbed. Comparison to experimental data

  7. Molecular Dynamics Study of a Surfactant-Mediated Decane-Water Interface: Effect of Molecular Architecture of Alkyl Benzene Sulfonate

    E-Print Network [OSTI]

    Goddard III, William A.

    Architecture of Alkyl Benzene Sulfonate Seung Soon Jang, Shiang-Tai Lin, Prabal K. Maiti, Mario Blanco the attachment position of benzene sulfonate on the hexadecane backbone, at the decane-water interface benzene sulfonates, denoted by m-C16, indicating a benzene sulfonate group attached to the mth carbon

  8. Integrated reformer and shift reactor

    DOE Patents [OSTI]

    Bentley, Jeffrey M.; Clawson, Lawrence G.; Mitchell, William L.; Dorson, Matthew H.

    2006-06-27T23:59:59.000Z

    A hydrocarbon fuel reformer for producing diatomic hydrogen gas is disclosed. The reformer includes a first reaction vessel, a shift reactor vessel annularly disposed about the first reaction vessel, including a first shift reactor zone, and a first helical tube disposed within the first shift reactor zone having an inlet end communicating with a water supply source. The water supply source is preferably adapted to supply liquid-phase water to the first helical tube at flow conditions sufficient to ensure discharge of liquid-phase and steam-phase water from an outlet end of the first helical tube. The reformer may further include a first catalyst bed disposed in the first shift reactor zone, having a low-temperature shift catalyst in contact with the first helical tube. The catalyst bed includes a plurality of coil sections disposed in coaxial relation to other coil sections and to the central longitudinal axis of the reformer, each coil section extending between the first and second ends, and each coil section being in direct fluid communication with at least one other coil section.

  9. Computer simulations of benzene in faujasite-type zeolites

    SciTech Connect (OSTI)

    Henson, N.J.; Cheetham, A.K. [California Univ., Santa Barbara, CA (United States). Dept. of Materials; Redondo, A. [Los Alamos National Lab., NM (United States); Levine, S.M.; Newsam, J.M. [Biosym Technologies Inc., San Diego, CA (United States)

    1994-03-01T23:59:59.000Z

    The exact nature of the cation-benzene ring interaction is not yet known. In order to remedy this, energy minimization and Monte Carlo methods were used to probe the location and energetics of benzene in sodium zeolite-X and -Y. Sorption energies for the six-ring binding site in each of the zeolite models with the two forcefields (cff91 and cvff) are tabulated as function of Si/Al ratio. Both forcefields predict similar binding sites for each system; however, the final energies are sensitive to form and parameterization of the forcefield. Further work is needed to refine the forcefield for zeolite-sorbate interactions. 5 figs, 21 refs, 2 tabs.

  10. The Effect of Reformate on PEM Fuel Cell Performance Mahesh Murthy

    E-Print Network [OSTI]

    Van Zee, John W.

    ). For the reforming process, a steam reforming of methanol and autothermal reforming of natural gas or gasoline

  11. Binding Energies in Benzene Dimers: Nonlocal Density Functional Calculations

    E-Print Network [OSTI]

    Aaron Puzder; Maxime Dion; David C. Langreth

    2005-09-15T23:59:59.000Z

    The interaction energy and minimum energy structure for different geometries of the benzene dimer has been calculated using the recently developed nonlocal correlation energy functional for calculating dispersion interactions. The comparison of this straightforward and relatively quick density functional based method with recent calculations can elucidate how the former, quicker method might be exploited in larger more complicated biological, organic, aromatic, and even infinite systems such as molecules physisorbed on surfaces, and van der Waals crystals.

  12. Conversion of hydrocarbons for fuel-cell applications. Part I. Autothermal reforming of sulfur-free and sulfur-containing hydrocarbon liquids. Part II. Steam reforming of n-hexane on pellet and monolithic catalyst beds. Final report

    SciTech Connect (OSTI)

    Flytzani-Stephanopoulos, M.; Voecks, G.E.

    1981-10-01T23:59:59.000Z

    Experimental autothermal reforming (ATR) results obtained in the previous phase of this work with sulfur-free pure hydrocarbon liquids are summarized. Catalyst types and configuration used were the same as in earlier tests with No. 2 fuel oil to facilitate comparisons. Fuel oil has been found to form carbon in ATR at conditions much milder than those predicted by equilibrium. Reactive differences between paraffins and aromatics in ATR, and thus the formation of different carbon precursors, have been shown to be responsible for the observed carbon formation characteristics (fuel-specific). From tests with both light and heavy paraffins and aromatics, it is concluded that high boiling point hydrocarbons and polynuclear aromatics enhance the propensity for carbon formation in ATR. Effects of olefin (propylene) addition on the ATR performance of benzene are described. In ATR tests with mixtures of paraffins and aromatics (n-tetradecane and benzene) synergistic effects on conversion characteristics were identified. Comparisons of the No. 2 fuel oil data with the experimental results from this work with pure (and mixed) sulfur-free hydrocarbons indicate that the sulfur content of the fuel may be the limiting factor for efficient ATR operation. Steam reforming of hydrocarbons in conventional reformers is heat transfer limited. Steam reforming tasks performed have included performance comparisons between conventional pellet beds and honeycomb monolith catalysts. Metal-supported monoliths offer higher structural stability than ceramic supports, and have a higher thermal conductivity. Data from two metal monoliths of different catalyst (nickel) loading were compared to pellets under the same operating conditions.

  13. Tip-contact related low-bias negative differential resistance and rectifying effects in benzene–porphyrin–benzene molecular junctions

    SciTech Connect (OSTI)

    Cheng, Jue-Fei [College of Physics, Optoelectronics and Energy and Collaborative Innovation Center of Suzhou Nano Science and Technology, Soochow University, Suzhou 215006 (China); School of Electronics and Information Engineering, Suzhou Vocational University, Suzhou 215104 (China); Zhou, Liping, E-mail: zhoulp@suda.edu.cn, E-mail: leigao@suda.edu.cn; Liu, Man; Yan, Qiang; Han, Qin; Gao, Lei, E-mail: zhoulp@suda.edu.cn, E-mail: leigao@suda.edu.cn [College of Physics, Optoelectronics and Energy and Collaborative Innovation Center of Suzhou Nano Science and Technology, Soochow University, Suzhou 215006 (China)

    2014-11-07T23:59:59.000Z

    The electronic transport properties of benzene–porphyrin–benzene (BPB) molecules coupled to gold (Au) electrodes were investigated. By successively removing the front-end Au atoms, several BPB junctions with different molecule-electrode contact symmetries were constructed. The calculated current–voltage (I–V) curves depended strongly on the contact configurations between the BPB molecules and the Au electrodes. In particular, a significant low-voltage negative differential resistance effect appeared at ?0.3 V in the junctions with pyramidal electrodes on both sides. Along with the breaking of this tip-contact symmetry, the low-bias negative differential resistance effect gradually disappeared. This tip-contact may be ideal for use in the design of future molecular devices because of its similarity with experimental processes.

  14. Assessing the Exposure and Health Risks of Secondhand Smoke in Restaurants and Bars by Workers and Patrons & Evaluating the Efficacy of Different Smoking Policies in Beijing Restaurants and Bars

    E-Print Network [OSTI]

    Liu, Ruiling

    2012-01-01T23:59:59.000Z

    acetaldehyde, formaldehyde and acrolein), hydrocarbons (suchaldehydes, nitrous acid, acrolein, benzene, toluene,3-Ethenylpridine Acetonitrile Acrolein Acrylonitrile Benzene

  15. Chemical Engineering Journal 87 (2002) 101110 Co-treatment of H2S and toluene in a biotrickling filter

    E-Print Network [OSTI]

    2002-01-01T23:59:59.000Z

    Chemical Engineering Journal 87 (2002) 101­110 Co-treatment of H2S and toluene in a biotrickling-gases contain H2S and a wide range of volatile organic compounds (VOCs). Since co-treatment of odors and VOCs in biotrickling filters is a relatively unexplored area, the simultaneous biotreatment of H2S and toluene (as

  16. Plasma-catalyzed fuel reformer

    DOE Patents [OSTI]

    Hartvigsen, Joseph J.; Elangovan, S.; Czernichowski, Piotr; Hollist, Michele

    2013-06-11T23:59:59.000Z

    A reformer is disclosed that includes a plasma zone to receive a pre-heated mixture of reactants and ionize the reactants by applying an electrical potential thereto. A first thermally conductive surface surrounds the plasma zone and is configured to transfer heat from an external heat source into the plasma zone. The reformer further includes a reaction zone to chemically transform the ionized reactants into synthesis gas comprising hydrogen and carbon monoxide. A second thermally conductive surface surrounds the reaction zone and is configured to transfer heat from the external heat source into the reaction zone. The first thermally conductive surface and second thermally conductive surface are both directly exposed to the external heat source. A corresponding method and system are also disclosed and claimed herein.

  17. Quantum/Classical Mechanical Comparison of Cation-Interactions between Tetramethylammonium and Benzene

    E-Print Network [OSTI]

    Sussman, Joel L.

    and Benzene Clifford Felder, Hua-Liang Jiang,,§,|, Wei-Liang Zhu,§,| Kai-Xian Chen,§ Israel Silman, Simone A-methyl groups with a benzene ring, by use of density-functional theory (DFT) methods B3LYP/6-31G* and B3LYP/6 profiles of the complex as benzene was moved away from TMA in 0.2 Å intervals. Hence it is possible to use

  18. Occupational Exposure to Benzene from Painting with Epoxy and Other High Performance Coatings

    SciTech Connect (OSTI)

    JAHN, STEVEN

    2005-04-20T23:59:59.000Z

    Following the discovery of trace benzene in paint products, an assessment was needed to determine potential for benzene exposures to exceed the established ACGIH Threshold Limit Value (TLV) during painting operations. Sample data was collected by area industrial hygienists for benzene during routine maintenance and construction activities at Savannah River Site. A set of available data from the IH database, Sentry, was analyzed to provide guidance to the industrial hygiene staff and draw conclusions on the exposure potential during typical painting operations.

  19. Palladium-Catalyzed Direct Functionalization of Aromatic C-H Bonds: Development of Methods for Direct Amination and Mechanistic Studies of Direct Arylation of Benzene and Pyridine N-Oxide

    E-Print Network [OSTI]

    Tan, Yichen

    2013-01-01T23:59:59.000Z

    barrier of the reactions of benzene with phosphine-ligatedStudy on Direct Arylation of Benzene ………………..95-142proposed, and reaction of benzene and phthalimide in the

  20. Kinetic effects of toluene blending on the extinction limit of n-decane diffusion flames

    E-Print Network [OSTI]

    Ju, Yiguang

    analyses of kinetic path ways and species transport on flame extinction were also conducted. The results and emission properties, such as the ignition delay times, extinction limits, flame speeds, species profilesKinetic effects of toluene blending on the extinction limit of n-decane diffusion flames Sang Hee

  1. Removal of Toluene in Air by Non Thermal Plasma-Catalysis Hybrid , H. T. Pham

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Removal of Toluene in Air by Non Thermal Plasma-Catalysis Hybrid System A. Khacef , H. T. Pham , A Orléans Cedex 02, France * Institute of Applied Material Science, VAST, 1 Mac Dinh Chi, HCMC, Vietnam with heterogeneous catalysts. This combination can be either single-stage (in-plasma catalysis, IPC) or two

  2. Applied Catalysis B: Environmental 29 (2001) 327336 Gas-phase photo-oxidation of toluene using

    E-Print Network [OSTI]

    2001-01-01T23:59:59.000Z

    Applied Catalysis B: Environmental 29 (2001) 327­336 Gas-phase photo-oxidation of toluene using reserved. PII: S0926-3373(00)00211-3 #12;328 A.J. Maira et al. / Applied Catalysis B: Environmental 29.V. All rights reserved. Keywords: Photo-catalysis; Titanium dioxide; Nanoparticles; Volatile organic

  3. Quaternary liquid-liquid equilibrium of n-heptane-toluene-o-xylene-propylene carbonate

    SciTech Connect (OSTI)

    Salem, A.B.S.H.; Hamad, E.Z.; Al-Naafa, M.A. (King Fahd Univ. of Petroleum and Minerals, Dhahran (Saudi Arabia). Chemical Engineering Dept.)

    1994-03-01T23:59:59.000Z

    Liquid-liquid equilibrium data for the system n-heptane/toluene/o-xylene/propylene carbonate were obtained at 25 OC. Experimental tie line data were measured by gas chromatographic analysis. The UNIQUAC and NRTL models were used to predict the quaternary data from the corresponding ternary data. Agreement between the predictions and the experimental data was satisfactory.

  4. Effect of Ethanol, Acetate, and Phenol on Toluene Degradation Activity and todlux

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    Effect of Ethanol, Acetate, and Phenol on Toluene Degradation Activity and tod­lux Expression with increasing influent concentrations of ethanol, acetate, or phenol. Three inhibitory mechanisms were) by acetate and ethanol, which was quantified by a decrease in specific bioluminescence; (2) competitive

  5. Steam reforming utilizing high activity catalyst

    SciTech Connect (OSTI)

    Setzer, H. J.

    1985-03-05T23:59:59.000Z

    High activity, sulfur tolerant steam reforming catalysts are described comprising rhodium or nickel supported on lanthanum stabilized alumina or magnesium promoted lanthanum stabilized alumina. The catalysts have improved activity over conventionally used catalysts in the presence of sulfur containing hydrocarbon fuel (such as No. 2 fuel oil) in a steam reforming environment. The material has particular utility in autothermal, tubular, cyclic and adiabatic steam reforming processes.

  6. Benzene Generation Testing for Tank 48H Waste Disposition

    SciTech Connect (OSTI)

    Peters, T

    2005-05-13T23:59:59.000Z

    In support for the Aggregation option1, researchers performed a series of tests using actual Tank 48H slurries. The tests were designed to examine potential benzene generation issues if the Tank 48H slurry is disposed to Saltstone. Personnel used the archived Tank 48H sample (HTF-E-03-127, collected September 17, 2003) for the experiments. The tests included a series of three experiments (Tests A, B, and F) performed in duplicate, giving a total of six experiments. Test A used Tank 48H slurry mixed with {approx}20:1 with Defense Waste Processing Facility (DWPF) Recycle from Tanks 21H and 22H. Test B used Tank 48H slurry mixed with {approx}2.7:1 with DWPF Recycle from Tanks 21H and 22H, while Test F used Tank 48H slurry as-is. Tests A and B occurred at 45 C, while Test F occurred at 55 C. Over a period of 8 weeks, personnel collected samples for analysis, once per week. Each sample was tested with the in-cell gamma counter. The researchers noted a decline in the cesium activity in solution which is attributed to temperature dependence of the complex slurry equilibrium. Selected samples were sent to ADS for potassium, boron, and cesium analysis. The benzene generation rate was inferred from the TPB destruction which is indirectly measured by the in-growth of cesium, potassium or boron. The results of all the analyses reveal no discernible in-growth of radiocesium, potassium or boron, indicating no significant tetraphenylborate (TPB) decomposition in any of the experiments. From boron measurements, the inferred rate of TPB destruction remained less than 0.332 mg/(L-h) implying a maximum benzene generation rate of <0.325 mg/(L-h).

  7. Atomic Structure of Benzene Which Accounts for Resonance Energy

    E-Print Network [OSTI]

    Raji Heyrovska

    2008-07-09T23:59:59.000Z

    Benzene is a hexagonal molecule of six carbon atoms, each of which is bound to six hydrogen atoms. The equality of all six CC bond lengths, despite the alternating double and single bonds, and the surplus (resonance) energy, led to the suggestion of two resonanting structures. Here, the new atomic structure shows that the bond length equality is due to three carbon atoms with double bond radii bound to three other carbon atoms with resonance bond radii (as in graphene). Consequently, there are two kinds of CH bonds of slightly different lengths. The bond energies account for the resonance energy.

  8. The development of a passive dosimeter for airborne benzene vapors

    E-Print Network [OSTI]

    Hager, David William

    1978-01-01T23:59:59.000Z

    THE DEVELOPMENT OF A PASSIVE DOSIMETER FOR AIRBORNE BENZENE VAPORS A Thesis DAVID NII LIAM HAGER Submitted to the Graduate Colleqe of Texas ASM University in partial fulfillment of the requirement for the d"gree of MASTER OF SC. IENCE May IB...7B Major Subject: Indus t& ial Hyqiene THE DEVELOPMENT OF A PASSIVE DOSIMETER FOR AIRBORNE BFNZENE VAPORS A Thesis by DAVID NILLIAM HAGER Approved as to style and content by: Z Chairman of Commi t e~ ~'g C'S~ Head of Department~ Member...

  9. Ab initio investigation of intermolecular interactions in solid benzene

    E-Print Network [OSTI]

    O. Bludsky; M. Rubes; P. Soldan

    2008-01-04T23:59:59.000Z

    A computational strategy for the evaluation of the crystal lattice constants and cohesive energy of the weakly bound molecular solids is proposed. The strategy is based on the high level ab initio coupled-cluster determination of the pairwise additive contribution to the interaction energy. The zero-point-energy correction and non-additive contributions to the interaction energy are treated using density functional methods. The experimental crystal lattice constants of the solid benzene are reproduced, and the value of 480 meV/molecule is calculated for its cohesive energy.

  10. Plasmatron Fuel Reformer Development and Internal Combustion...

    Broader source: Energy.gov (indexed) [DOE]

    Plasmatron Fuel Reformer Development and Internal Combustion Engine Vehicle Applications* L. Bromberg MIT Plasma Science and Fusion Center Cambridge MA 02139 * Work supported by US...

  11. Hydrogen from Biomass by Autothermal Reforming

    Broader source: Energy.gov [DOE]

    Presentation by Lanny D. Schmidt at the October 24, 2006 Bio-Derived Liquids to Hydrogen Distributed Reforming Working Group Kick-Off Meeting.

  12. Distributed Bio-Oil Reforming (Presentation)

    SciTech Connect (OSTI)

    Evans, R. J.; Czernik, S.; French, R.; Ratcliff, M.; Marda, J.; Dean, A. M.

    2007-05-15T23:59:59.000Z

    This presentation by Bob Evans at the 2007 DOE Hydrogen Program Annual Merit Review Meeting provides information about NREL's distributed bio-oil reforming efforts.

  13. Plasmatron Fuel Reformer Development and Internal Combustion...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    More Documents & Publications Hydrogen generation from plasmatron reformers and use for diesel exhaust aftertreatment Onboard Plasmatron Generation of Hydrogen rich Gas for...

  14. Lessons Learned from Prior Attempts at National Security Reform The Project on National Security Reform

    E-Print Network [OSTI]

    Lewis, Robert Michael

    Lessons Learned from Prior Attempts at National Security Reform The Project on National Security Reform Overarching Issues Working Group Drew Cramer & Grant Mullins Thomas Jefferson Program in Public battles that ensue when attempting to change the national security apparatus can hinder effective reform

  15. Inquiry-Based Learning: An Educational Reform Based

    E-Print Network [OSTI]

    McLoughlin, Padraig

    -Based Learning: An Educational Reform Based Upon Content-Centred Teaching. 1046-Centred Educational Reform 3 III Inquiry-Based Learning Pedagogy is Content 27 #12; ii Abstract Inquiry-Based Learning: An Educational Reform

  16. A Reformed Mathematics Education at Chalmers Stig Larsson

    E-Print Network [OSTI]

    Larsson, Stig

    A Reformed Mathematics Education at Chalmers Stig to reform to effectively use t* *he new tools offered by computers. We present a program for a reformed engineering mathematics * *education. The full program covering the basic mathematics

  17. Comparative case studies of health reform in England

    E-Print Network [OSTI]

    Birmingham, University of

    Comparative case studies of health reform in England Report submitted to the Department of Health........................................................................................14 1.1 Presenting the Health System Reform policy agenda...................................14 1 ..........................................................................................64 Demand Side Reform.........................................

  18. Apparatus for production of synthesis gas using convective reforming

    SciTech Connect (OSTI)

    Karafian, M.; Tsang, I.C.

    1991-04-09T23:59:59.000Z

    This patent describes a system for the steam reforming of hydrocarbons into a hydrogen-rich gas. It comprises a convective reformer device having indirect heat exchange means for partially reforming a feed mixture of hydrocarbons and steam; a steam reforming furnace having a radiant section, reforming tubes in the radiant section, and means for producing radiant heat for the further reforming of the partially reformed effluent; an auto-thermal reformer for fully reforming the effluent; conduit means for passing the partially reformed effluent; conduit means for passing the effluent; and conduit means for passing the fully reformed effluent to supply the heat of reaction for the partial reformation of the hydrocarbon-steam feed mixture.

  19. Solid oxide fuel cell steam reforming power system

    DOE Patents [OSTI]

    Chick, Lawrence A.; Sprenkle, Vincent L.; Powell, Michael R.; Meinhardt, Kerry D.; Whyatt, Greg A.

    2013-03-12T23:59:59.000Z

    The present invention is a Solid Oxide Fuel Cell Reforming Power System that utilizes adiabatic reforming of reformate within this system. By utilizing adiabatic reforming of reformate within the system the system operates at a significantly higher efficiency than other Solid Oxide Reforming Power Systems that exist in the prior art. This is because energy is not lost while materials are cooled and reheated, instead the device operates at a higher temperature. This allows efficiencies higher than 65%.

  20. Internal degrees of freedom and transport of benzene on graphite

    E-Print Network [OSTI]

    Astrid S. de Wijn

    2011-07-13T23:59:59.000Z

    In this paper, the chaotic internal degrees of freedom of a benzene molecule adsorbed on a graphite substrate, their interplay with thermal noise, and their effects on the diffusion and drift are investigated analytically by making use of the presence of two different time scales as well as by molecular-dynamics simulations. The effects of thermal noise are investigated, and it is found that noise does not significantly alter the dynamics of the internal degrees of freedom, yet affects the friction and diffusion of the center of mass. Qualitative and quantitative theoretical predictions for the friction and diffusion of the molecule on the substrate are made and are compared to molecular-dynamics simulations. Contributions to the friction and diffusion from the finite heat bath as well as the slow dynamics of the center of mass are formally identified. It is shown that the torsion in benzene, which dominates the nonlinear coupling, significantly affects the friction of the molecule on the surface. The results compare favorably with recent results from He/neutron spin echo experiments on this system. Based on the analytical and numerical results, some suggestions are made for experimental conditions under which the effects of internal degrees of freedom might be observable.

  1. Fuel Reformer, LNT and SCR Aftertreatment System Meeting Emissions...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Reformer, LNT and SCR Aftertreatment System Meeting Emissions Useful Life Requirements Fuel Reformer, LNT and SCR Aftertreatment System Meeting Emissions Useful Life Requirements...

  2. Research and Development of a PEM Fuel Cell, Hydrogen Reformer...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    of a PEM Fuel Cell, Hydrogen Reformer, and Vehicle Refueling Facility Research and Development of a PEM Fuel Cell, Hydrogen Reformer, and Vehicle Refueling Facility Technical paper...

  3. STEM education reform A public research university imperative!

    E-Print Network [OSTI]

    Sin, Peter

    STEM education reform A public research university imperative! University of Florida A significant education reform initiative for introductory courses. Will these -- and a growing number of other national

  4. Design, Modeling, and Validation of a Flame Reformer for LNT...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Design, Modeling, and Validation of a Flame Reformer for LNT External Bypass Regeneration Design, Modeling, and Validation of a Flame Reformer for LNT External Bypass Regeneration...

  5. Bio-Derived Liquids to Hydrogen Distributed Reforming Working...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Reforming, Darlene Steward, National Renewable Energy Laboratory High-Pressure Steam Ethanol Reforming, Romesh Kumar, Argonne National Laboratory Investigation of Bio-Ethanol...

  6. BILIWG Meeting: High Pressure Steam Reforming of Bio-Derived...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    High Pressure Steam Reforming of Bio-Derived Liquids (Presentation) BILIWG Meeting: High Pressure Steam Reforming of Bio-Derived Liquids (Presentation) Presented at the 2007...

  7. Before the House Committee on Oversight and Government Reform...

    Energy Savers [EERE]

    Oversight and Government Reform Subcommittee on the Interior Before the House Committee on Oversight and Government Reform Subcommittee on the Interior Testimony of John Kotek,...

  8. Regulatory and Financial Reform of Federal Research Policy: Recommenda...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    and Financial Reform of Federal Research Policy: Recommendations to the NRC Committee on Research Universities Regulatory and Financial Reform of Federal Research Policy:...

  9. Secretary Moniz to Present Project Management Reforms to the...

    Energy Savers [EERE]

    Moniz to Present Project Management Reforms to the National Academy of Public Administration Secretary Moniz to Present Project Management Reforms to the National Academy of Public...

  10. Diesel Reforming for Fuel Cell Auxiliary Power Units

    SciTech Connect (OSTI)

    Borup, R.; Parkinson, W. J.; Inbody, M.; Brosha, E.L.; Guidry, D.R.

    2005-01-27T23:59:59.000Z

    This objective of this project was to develop technology suitable for onboard reforming of diesel. The approach was to examine catalytic partial oxidation and steam reforming.

  11. Hydrogen generation from plasmatron reformers and use for diesel...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    generation from plasmatron reformers and use for diesel exhaust aftertreatment Hydrogen generation from plasmatron reformers and use for diesel exhaust aftertreatment 2003 DEER...

  12. Femtosecond Near-Infrared Laser Desorption of Multilayer Benzene on Pt{111}: A Molecular Newton's Cradle?

    E-Print Network [OSTI]

    Levis, Robert J.

    Femtosecond Near-Infrared Laser Desorption of Multilayer Benzene on Pt{111}: A Molecular Newton Recently, the intense near-infrared laser desorption of intact benzene molecules has been reported.1 Three to alter the pure thermal distribution to one having a stream velocity.4 The high heating rates achievable

  13. Hydrologic and geochemical controls on soluble benzene migration in sedimentary basins

    E-Print Network [OSTI]

    Polly, David

    , a coupled ground- water flow and heat transfer model computes the hydraulic head, stream function, and temperature in the basin. A coupled mass transport model simulates water washing of benzene from an oil reservoir and its miscible, advective/dispersive transport by groundwater. Benzene mass transfer at the oil­water

  14. Adsorption of Benzene, Fluorobenzene and Meta-di-Fluorobenzene on Cu(110): A Computational Study

    E-Print Network [OSTI]

    Gao, Hongjun

    Adsorption of Benzene, Fluorobenzene and Meta-di-Fluorobenzene on Cu(110): A Computational Study L.interscience.wiley.com). Abstract: We modelled the adsorption of benzene, fluorobenzene and meta-di-fluorobenzene on Cu(110) by Den- sity Functional Theory. We found that the adsorption configuration depends on the coverage. At high

  15. Impact of Ethanol on Benzene Plume Lengths: Microbial and Modeling Studies

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    Impact of Ethanol on Benzene Plume Lengths: Microbial and Modeling Studies Rula A. Deeb1 ; Jonathan with Federal Clean Air Act requirements for carbon monoxide and ozone attainment, ethanol is being considered as a replacement for MTBE. The objective of this study is to evaluate the potential impact of ethanol on benzene

  16. A Multicompartment LiverBased Pharmacokinetic Model for Benzene and Its Metabolites in Mice

    E-Print Network [OSTI]

    extrapolated to predict in vivo data for benzene metabolism and dosimetry. 1 Introduction and Problem in a variety of blood and bone marrow disorders in both humans and laboratory animals [9, 18]. IncreasedA Multicompartment Liver­Based Pharmacokinetic Model for Benzene and Its Metabolites in Mice Cammey

  17. A Multicompartment Liver-Based Pharmacokinetic Model for Benzene and Its Metabolites in Mice

    E-Print Network [OSTI]

    extrapolated to predict in vivo data for benzene metabolism and dosimetry. 1 Introduction and Problem in a variety of blood and bone marrow disorders in both humans and laboratory animals [9, 18]. IncreasedA Multicompartment Liver-Based Pharmacokinetic Model for Benzene and Its Metabolites in Mice Cammey

  18. Physiologically Based Pharmacokinetic Modeling of Benzene Metabolism in Mice through Extrapolation

    E-Print Network [OSTI]

    metabolic constants for humans can subsequently be extrapolated to predict the dosimetry of benzene and itsPhysiologically Based Pharmacokinetic Modeling of Benzene Metabolism in Mice through Extrapolation parameters are also available for humans. Unknown parameters were estimated by fitting the model to published

  19. Analytical solution of electronic transport through a benzene molecule using lattice Green's functions

    E-Print Network [OSTI]

    E. J. C. Dias; N. M. R. Peres

    2015-02-25T23:59:59.000Z

    Using a Green's function formalism we derive analytical expressions for the electronic transmittance through a benzene ring. To motivate the approach we first solve the resonant level system and then extend the method to the benzene case. These results can be used to validate numerical methods.

  20. Intermolecular C?H bond activation of benzene and pyridines by a vanadium(III) alkylidene including a stepwise conversion of benzene to a vanadium-benzyne complex

    SciTech Connect (OSTI)

    Andino, José G.; Kilgore, Uriah J.; Pink, Maren; Ozarowski, Andrew; Krzystek, J.; Telser, Joshua; Baik, Mu-Hyun; Mindiola, Daniel J. (Roosevelt); (FSU); (Indiana)

    2012-01-20T23:59:59.000Z

    Breaking of the carbon-hydrogen bond of benzene and pyridine is observed with (PNP)V(CH{sub 2}tBu){sub 2} (1), and in the case of benzene, the formation of an intermediate benzyne complex (C) is proposed, and indirect proof of its intermediacy is provided by identification of (PNP)VO({eta}{sup 2}-C{sub 6}H{sub 4}) in combination with DFT calculations.

  1. Tuning the oxide/organic interface: Benzene on SnO2,,101... Matthias Batzill,a)

    E-Print Network [OSTI]

    Diebold, Ulrike

    Tuning the oxide/organic interface: Benzene on SnO2,,101... Matthias Batzill,a) Khabibulakh Katsiev,16 As a model molecule for simulating an organic semiconductor film benzene was chosen as a simple -conjugated

  2. Methanol Steam Reformer on a Silicon Wafer

    SciTech Connect (OSTI)

    Park, H; Malen, J; Piggott, T; Morse, J; Sopchak, D; Greif, R; Grigoropoulos, C; Havstad, M; Upadhye, R

    2004-04-15T23:59:59.000Z

    A study of the reforming rates, heat transfer and flow through a methanol reforming catalytic microreactor fabricated on a silicon wafer are presented. Comparison of computed and measured conversion efficiencies are shown to be favorable. Concepts for insulating the reactor while maintaining small overall size and starting operation from ambient temperature are analyzed.

  3. Enabling Informed Adaptation of Reformed Instructional Materials

    E-Print Network [OSTI]

    Elby, Andy

    Enabling Informed Adaptation of Reformed Instructional Materials Rachel E. Scherr and Andrew Elby 20742 USA Abstract. Instructors inevitably need to adapt even the best reform materials to suit instructors, and video clips of students working on the materials. Our materials thus facilitate their own

  4. Fuel cell integrated with steam reformer

    DOE Patents [OSTI]

    Beshty, Bahjat S. (Lower Makefield, PA); Whelan, James A. (Bricktown, NJ)

    1987-01-01T23:59:59.000Z

    A H.sub.2 -air fuel cell integrated with a steam reformer is disclosed wherein a superheated water/methanol mixture is fed to a catalytic reformer to provide a continuous supply of hydrogen to the fuel cell, the gases exhausted from the anode of the fuel cell providing the thermal energy, via combustion, for superheating the water/methanol mixture.

  5. Catalytic Transformation of C7-C9 Methyl Benzenes over USY-based FCC Zeolite Catalyst

    E-Print Network [OSTI]

    Al-Khattaf, Sulaiman

    in the petrochemical market. Most of the currently working isomerization plants are using zeolite based catalysts. One) and the diphenyl methane mechanism. It was shown that toluene disproportionation does not require Brönsted acid

  6. Clustering Dynamics of the Metal-Benzene Sandwich Complex: The Role of Microscopic Structure of the Solute In the Bis(6-benzene)chromium Arn Clusters (n ) 1-15)

    E-Print Network [OSTI]

    Kim, Sang Kyu

    Clustering Dynamics of the Metal-Benzene Sandwich Complex: The Role of Microscopic Structure of the Solute In the Bis(6-benzene)chromium ·Arn Clusters (n ) 1-15) Kyo-Won Choi, Sunyoung Choi, Doo-Sik AhnVised Manuscript ReceiVed: June 25, 2008 Ar clustering dynamics around the metal-benzene sandwich complex, bis(6

  7. Benzene Exposure and Risk of Non-Hodgkin Lymphoma Martyn T. Smith, Rachael M. Jones, and Allan H. Smith

    E-Print Network [OSTI]

    California at Berkeley, University of

    Benzene Exposure and Risk of Non-Hodgkin Lymphoma Martyn T. Smith, Rachael M. Jones, and Allan H of California, Berkeley, California Abstract Exposure to benzene, an important industrial chemical and component studies that identified probable occupational exposures to benzene and NHL morbidity or mortality. We

  8. Electronic structure of benzene adsorbed on single-domain Si,,001...-,,2 1...: A combined experimental and theoretical study

    E-Print Network [OSTI]

    Birkenheuer, Uwe

    Electronic structure of benzene adsorbed on single-domain Si,,001...-,,2 1...: A combined Received 20 October 1997; accepted 31 December 1997 Benzene adsorption on a single-domain Si 001 -(2 1 for the saturated benzene layer exhibit well-defined polarization and azimuthal dependencies compatible with a flat

  9. (CANCER RESEARCH 50, 393-399. January 15. 1990] Characterization of Micronuclei Induced in Human Lymphocytes by Benzene

    E-Print Network [OSTI]

    California at Berkeley, University of

    Lymphocytes by Benzene Metabolites1 Janice W. Yager, David A. Eastmond,2 Moire L. Robertson, William M Division, Lawrence Livermore National Laboratory, Livermore, California 94550 fD. A. E.] ABSTRACT Benzene is an established human leukemogen. Workers occupational!) exposed to benzene exhibit increased frequencies of both

  10. J. Am. Chem. SOC. The m ( b 2 u ) Mode of Benzene in SOand SI and the

    E-Print Network [OSTI]

    Haas, Yehuda

    J. Am. Chem. SOC. The m ( b 2 u ) Mode of Benzene in SOand SI and the Distortive Nature of the z structure. The symmetry analysis of the vibrational modes of benzene by Wilson4was one of the first and assigned of vibrational spectra of benzene and its derivatives. Early on it was noticed that b2u modes

  11. Electronic Structure and Properties of Transition Metal-Benzene Ravindra Pandey, Bijan K. Rao,*, Purusottam Jena, and Miguel Alvarez Blanco

    E-Print Network [OSTI]

    Pandey, Ravi

    Electronic Structure and Properties of Transition Metal-Benzene Complexes Ravindra Pandey, Bijan Kd transition metal atoms (M) interacting with benzene molecules (Bz) is carried out using density. The variation of the metal-benzene distances, dissociation energies, ionization potentials, electron affinities

  12. Polymorphisms in genes involved in DNA double-strand break repair pathway and susceptibility to benzene-induced hematotoxicity

    E-Print Network [OSTI]

    California at Berkeley, University of

    to benzene-induced hematotoxicity Min Shen1,Ã, Qing Lan1 , Luoping Zhang2 , Stephen Chanock1,3 , Guilan Li4; Email: shenmi@mail.nih.gov Benzene is a recognized hematotoxicant and carcinogen that produces genotoxic and indirectly by benzene metabolites. DSB may lead to chromosome aberrations, apoptosis and hematopoietic

  13. Electronic Transitions of Protonated Benzene and Fulvene, and of C6H7 Isomers in Neon Matrices

    E-Print Network [OSTI]

    Maier, John Paul

    Electronic Transitions of Protonated Benzene and Fulvene, and of C6H7 Isomers in Neon Matrices: Electronic transitions of protonated benzene (A~ 1 B2rX~ 1 A1, origin at 325 nm) and R-protonated fulvene (A) with simple atomic and molecular species was investigated.3,4 It was found, for example, that benzene cations

  14. Charge localization and JahnTeller distortions in the benzene dimer cation Piotr A. Pieniazek, Stephen E. Bradforth,a

    E-Print Network [OSTI]

    Krylov, Anna I.

    Charge localization and Jahn­Teller distortions in the benzene dimer cation Piotr A. Pieniazek August 2008 Jahn­Teller JT distortions and charge localization in the benzene dimer cation are analyzed.1063/1.2969107 I. INTRODUCTION The benzene dimer cation is an important model system for radiation

  15. Detailed Hydration Maps of Benzene and Cyclohexane Reveal Distinct Water Structures Tanya M. Raschke* and Michael Levitt

    E-Print Network [OSTI]

    Raschke, Tanya M.

    Detailed Hydration Maps of Benzene and Cyclohexane Reveal Distinct Water Structures Tanya M of the hydrophobic solutes benzene and cyclohexane were investigated using molecular dynamics (MD) simulations O and H atoms surrounding either benzene or cyclohexane were generated from the simulation data. MD

  16. The nature of the exalted Kekule vibration of styrene and other benzene derivatives in the S1 state

    E-Print Network [OSTI]

    Haas, Yehuda

    The nature of the exalted Kekule vibration of styrene and other benzene derivatives in the S1 state vibrational frequency of several benzene derivatives in the ®rst excited state S1. It is found of benzene are treated as `twin states'. The physical nature of this vibration is discussed in view

  17. Fully ab initio atomization energy of benzene via Weizmann-2 theory Srinivasan Parthiban and Jan M. L. Martina)

    E-Print Network [OSTI]

    Martin, Jan M.L.

    Fully ab initio atomization energy of benzene via Weizmann-2 theory Srinivasan Parthiban and Jan M at absolute zero, (TAE0) of benzene, C6H6, was computed fully ab initio by means of W2h theory as 1306.6 kcal for systems the size of benzene, chemically accurate molecular atomization energies can be obtained from fully

  18. 2590 J. Am. Chem. SOC.1995,117, 2590-2599 The C-H Bond Energy of Benzene

    E-Print Network [OSTI]

    Ellison, Barney

    2590 J. Am. Chem. SOC.1995,117, 2590-2599 The C-H Bond Energy of Benzene Gustavo E. Davico ion with benzene and phenide ion with ammonia: c&6 +NH2- C6H5- +NH3. The ratio of these rate constants for derived. The enthalpy of deprotonationof benzene, the C-H bond dissociationenergy, and the electron

  19. Vacuum ultraviolet mass-analyzed threshold ionization spectroscopy of benzene: Vibrational analysis of C6H6

    E-Print Network [OSTI]

    Kim, Myung Soo

    Vacuum ultraviolet mass-analyzed threshold ionization spectroscopy of benzene: Vibrational analysis-photon spectra agrees with the previous suggestion that the geometry of benzene cation in the ground electronic. INTRODUCTION Benzene cation has been the focus of an intensive re- search effort, both experimental1

  20. Mechanistic Studies of Reactions of Peroxodiiron(III) Intermediates in T201 Variants of Toluene/o-Xylene Monooxygenase Hydroxylase

    E-Print Network [OSTI]

    Lippard, Stephen J.

    Site-directed mutagenesis studies of a strictly conserved T201 residue in the active site of toluene/o-xylene monooxygenase hydroxylase (ToMOH) revealed that a single mutation can facilitate kinetic isolation of two ...

  1. Atmos. Chem. Phys., 13, 87978811, 2013 www.atmos-chem-phys.net/13/8797/2013/

    E-Print Network [OSTI]

    Meskhidze, Nicholas

    , acrolein, benzene, toluene and xylenes are also emitted. Positive matrix factorization (PMF) was applied

  2. Location of MTBE and toluene in the channel system of the zeolite mordenite: Adsorption and host-guest interactions

    SciTech Connect (OSTI)

    Arletti, Rossella, E-mail: rossella.arletti@unito.it [Department of Earth Sciences, University of Torino Via Valperga Caluso 35, I-10125, Torino (Italy)] [Department of Earth Sciences, University of Torino Via Valperga Caluso 35, I-10125, Torino (Italy); Martucci, Annalisa; Alberti, Alberto [Department of Earth Sciences, University of Ferrara, Via G. Saragat 1, I-44100, Ferrara (Italy)] [Department of Earth Sciences, University of Ferrara, Via G. Saragat 1, I-44100, Ferrara (Italy); Pasti, Luisa; Nassi, Marianna [Department of Chemistry, University of Ferrara, Via L. Borsari 26, I-44100 Ferrara (Italy)] [Department of Chemistry, University of Ferrara, Via L. Borsari 26, I-44100 Ferrara (Italy); Bagatin, Roberto [Research Centre for Non-Conventional Energy-Istituto ENI Donegani, Environmental Technologies, Via Fauser 4, I-28100 Novara (Italy)] [Research Centre for Non-Conventional Energy-Istituto ENI Donegani, Environmental Technologies, Via Fauser 4, I-28100 Novara (Italy)

    2012-10-15T23:59:59.000Z

    This paper reports a study of the location of Methyl Tertiary Butyl Ether (MTBE) and toluene molecules adsorbed in the pores of the organophylic zeolite mordenite from an aqueous solution. The presence of these organic molecules in the zeolite channels was revealed by structure refinement performed by the Rietveld method. About 3 molecules of MTBE and 3.6 molecules of toluene per unit cell were incorporated into the cavities of mordenite, representing 75% and 80% of the total absorption capacity of this zeolite. In both cases a water molecule was localized inside the side pocket of mordenite. The saturation capacity determined by the adsorption isotherms, obtained by batch experiments, and the weight loss given by thermogravimetric (TG) analyses were in very good agreement with these values. The interatomic distances obtained after the structural refinements suggest MTBE could be connected to the framework through a water molecule, while toluene could be bonded to framework oxygen atoms. The rapid and high adsorption of these hydrocarbons into the organophylic mordenite zeolite makes this cheap and environmental friendly material a suitable candidate for the removal of these pollutants from water. - graphical abstract: Location of MTBE (a) and toluene (b) in mordenite channels (projection along the [001] direction). Highlights: Black-Right-Pointing-Pointer We investigated the MTBE and toluene adsorption process into an organophilic zeolite mordenite. Black-Right-Pointing-Pointer The presence of MTBE and toluene in mordenite was determined by X-ray diffraction studies. Black-Right-Pointing-Pointer About 3 molecules of MTBE and 3.6 molecules of toluene per unit cell were incorporated into the zeolite cavities. Black-Right-Pointing-Pointer MTBE is connected to the framework through a water molecule. Black-Right-Pointing-Pointer Toluene is directly bonded to framework oxygen atoms.

  3. J. Am. Chem. SOC.1987, 109, 6825-6836 6825 `H NMR (22 O C , benzene-d6): 6 3.26 (s, OSCMe), 3.03 (s, 2JwH=

    E-Print Network [OSTI]

    Prentiss, Mara

    J. Am. Chem. SOC.1987, 109, 6825-6836 6825 `H NMR (22 O C , benzene-d6): 6 3.26 (s, OSCMe), 3.03 (s to yield a yellow powder (0.35 g, 92%). `H NMR (22 O C , benzene-d6): 6 2.66 (s, bridge 02CNMe2),2.59 (s of C 0 2was reacted with W,Bz;(NMe,),. `H NMR (22 OC. benzene-dr): 6 3.79 (s, CH,Ph), 2.67, 2.28 S, 02

  4. Integrated hydrocarbon reforming system and controls

    DOE Patents [OSTI]

    Clawson, Lawrence G.; Dorson, Matthew H.; Mitchell, William L.; Nowicki, Brian J.; Thijssen, Johannes; Davis, Robert; Papile, Christopher; Rumsey, Jennifer W.; Longo, Nathan; Cross, III, James C.; Rizzo, Vincent; Kleeburg, Gunther; Rindone, Michael; Block, Stephen G.; Sun, Maria; Morriseau, Brian D.; Hagan, Mark R.; Bowers, Brian

    2003-11-04T23:59:59.000Z

    A hydrocarbon reformer system including a first reactor configured to generate hydrogen-rich reformate by carrying out at least one of a non-catalytic thermal partial oxidation, a catalytic partial oxidation, a steam reforming, and any combinations thereof, a second reactor in fluid communication with the first reactor to receive the hydrogen-rich reformate, and having a catalyst for promoting a water gas shift reaction in the hydrogen-rich reformate, and a heat exchanger having a first mass of two-phase water therein and configured to exchange heat between the two-phase water and the hydrogen-rich reformate in the second reactor, the heat exchanger being in fluid communication with the first reactor so as to supply steam to the first reactor as a reactant is disclosed. The disclosed reformer includes an auxiliary reactor configured to generate heated water/steam and being in fluid communication with the heat exchanger of the second reactor to supply the heated water/steam to the heat exchanger.

  5. AN UPDATE ON REFORM IN EASTERN EUROPE AND RUSSIA

    E-Print Network [OSTI]

    AN UPDATE ON REFORM IN EASTERN EUROPE AND RUSSIA Jeffrey Sachs ABSTRACT: The paper reviews the experience of Poland and Russia with economic reform, with occasional comparison to China's experience. The author argues that macroeconomic chaos in Poland and Russia preceded reform and was allayed by reform

  6. Electricity reform in developing and transition countries: A reappraisal

    E-Print Network [OSTI]

    Kammen, Daniel M.

    Electricity reform in developing and transition countries: A reappraisal J.H. Williams, R. Ghanadan-oriented reforms in their electric power sectors. Despite the widespread adoption of a standard policy model features of non-OECD electricity reform and reappraises reform policies and underlying assumptions

  7. September 25, 2013 AFSCME Continues to Object to Pension Reform;

    E-Print Network [OSTI]

    Leistikow, Bruce N.

    September 25, 2013 AFSCME Continues to Object to Pension Reform; UC Implements Latest Bargaining working conditions and reasonable pension reform. However, AFSCME has rejected UC's proposals. From the start, AFSCME leadership has objected to UC's responsible pension reform -- the kind of reform that

  8. REFORM, LOBBIES AND WELFARE: A COMMON AGENCY APPROACH

    E-Print Network [OSTI]

    Royal Holloway, University of London

    REFORM, LOBBIES AND WELFARE: A COMMON AGENCY APPROACH Cecilia TESTA London School of Economics are a reform and a compensating taxation. The main feature of the reform is that it creates gainers and losers on tax parameters. keywords: reform, lobbying, redistribution, economic welfare. 1 #12;Introduction

  9. Autothermal Cyclic Reforming Based H2 Generating & Dispensing System

    E-Print Network [OSTI]

    Pressure Reforming Comp- ressor 100 psig 100 psig Reformer H2 PSA SyngasNatural Gas Low Pressure Reforming CMP Syngas 5 psig5 psig Reformer CMP 100 psig H2 PSA Natural Gas Syngas CMP HX CMP HX Thermal Reliability (Eliminates Syngas Compressor) Advantages 70-80%70-80%Thermal Efficiency (Excludes Electricity

  10. Internal reforming fuel cell assembly with simplified fuel feed

    DOE Patents [OSTI]

    Farooque, Mohammad (Huntington, CT); Novacco, Lawrence J. (Brookfield, CT); Allen, Jeffrey P. (Naugatuck, CT)

    2001-01-01T23:59:59.000Z

    A fuel cell assembly in which fuel cells adapted to internally reform fuel and fuel reformers for reforming fuel are arranged in a fuel cell stack. The fuel inlet ports of the fuel cells and the fuel inlet ports and reformed fuel outlet ports of the fuel reformers are arranged on one face of the fuel cell stack. A manifold sealing encloses this face of the stack and a reformer fuel delivery system is arranged entirely within the region between the manifold and the one face of the stack. The fuel reformer has a foil wrapping and a cover member forming with the foil wrapping an enclosed structure.

  11. Steam reforming utilizing iron oxide catalyst

    SciTech Connect (OSTI)

    Setzer, H. T.; Bett, J. A. S.

    1985-06-11T23:59:59.000Z

    High activity steam reforming iron oxide catalysts are described. Such catalysts can be unsupported utilizing at least 90% by weight iron oxide and various modifiers (Ai/sub 2/O/sub 3/, K/sub 2/O, CaO, SiO/sub 2/) or unmodified and supported on such things as alumina, CaO impregnated alumina, and lanthanum stabilized alumina. When used in steam reformers such as autothermal and tubular steam reformers, these catalysts demonstrate much improved resistance to carbon plugging.

  12. 082714-416430-Water-Resources-Reform Page 1 of 12 Water Resources Reform and Development Act of 2014

    E-Print Network [OSTI]

    US Army Corps of Engineers

    082714-416430-Water-Resources-Reform Page 1 of 12 Water Resources Reform and Development Act to the Water Resources Reform and Development Act 2014 Listening Session. My name is Jan Rasgus. I'm a senior of you know, President Obama signed the Water Resources Reform and Development Act, WRRDA, of 2014

  13. Isothermal vapor-liquid equilibria for benzene + cyclohexane + 1-propanol and for three constituent binary systems

    SciTech Connect (OSTI)

    Kurihara, Kiyofumi; Uchiyama, Masanori; Kojima, Kazuo [Nihon Univ., Tokyo (Japan). Dept. of Industrial Chemistry] [Nihon Univ., Tokyo (Japan). Dept. of Industrial Chemistry

    1997-01-01T23:59:59.000Z

    Isothermal vapor-liquid equilibria were measured for the ternary system of benzene + cyclohexane + 1-propanol and its constituent binary systems of benzene + cyclohexane, cyclohexane + 1-propanol, and benzene + 1-propanol at 323.15 and 333.15 K, using the apparatus proposed in a previous study. The experimental binary data were correlated using the NRTL equation. The ternary system was predicted using the binary NRTL parameters. The average absolute percent deviations between the predicted and experimental ternary total pressures are 0.5% at 323.15 K and 0.4% at 333.15 K.

  14. Bond Energy Sums in Benzene, Cyclohexatriene and Cyclohexane Prove Resonance Unnecessary

    E-Print Network [OSTI]

    Raji Heyrovska

    2008-07-27T23:59:59.000Z

    The recent new structure of benzene shows that it consists of three C atoms of radii as in graphite alternating with three C atoms with double bond radii. This is different from the hypothetical cyclohexatriene (Kekule structure) involving alternate double and single bonds. It was shown that the difference in the bond energy sum of the atomic structure of benzene from that of the Kekule structure is the energy (erroneously) assumed to be due to resonance. Here it is shown that the present structure of benzene also explains the energy of hydrogenation into cyclohexane and its difference from that of cyclohexatriene.

  15. Resonant ion-dip infrared spectroscopy of benzene(methanol)m clusters R. Nathaniel Pribble, Fredrick C. Hagemeister, and Timothy S. Zwiera)

    E-Print Network [OSTI]

    Zwier, Timothy S.

    Resonant ion-dip infrared spectroscopy of benzene­(methanol)m clusters with m 1­6 R. Nathaniel bonding between benzene and methanol. The m 2 spectrum features two strong transitions at 3506 and 3605 cm in the absence of benzene, is redshifted by 76 cm 1 due to a strengthened hydrogen bond. In benzene­ CH3OH 3

  16. Copyright Law Reform: Some Achievable Goals 

    E-Print Network [OSTI]

    MacQueen, Hector L

    2007-01-01T23:59:59.000Z

    Copyright law reform in the European Union. The chapter discusses possible actions in light of new and amended EU Directives and whether these balances rights' holders and users' interests....

  17. Electricity reform abroad and US investment

    SciTech Connect (OSTI)

    NONE

    1997-10-01T23:59:59.000Z

    This report reviews and analyzes the recent electricity reforms in Argentina, Australia, and the United Kingdom (UK) to illustrate how different models of privatization and reform have worked in practice. This report also analyzes the motivations of the U.S. companies who have invested in the electricity industries in these countries, which have become the largest targets of U.S. foreign investment in electricity. Two calculations of foreign investment are used. One is the foreign direct investment series produced by the U.S. Department of Commerce. The other is based on transactions in electric utilities of the three countries. The electricity reform and privatization experiences reviewed may offer some insight as to how the U.S. electricity industry might develop as a result of recent domestic reform efforts and deregulation at the state and national levels. 126 refs., 23 figs., 27 tabs.

  18. Device for cooling and humidifying reformate

    DOE Patents [OSTI]

    Zhao, Jian Lian (Belmont, MA); Northrop, William F. (Ann Arbor, MI)

    2008-04-08T23:59:59.000Z

    Devices for cooling and humidifying a reformate stream from a reforming reactor as well as related methods, modules and systems includes a heat exchanger and a sprayer. The heat exchanger has an inlet, an outlet, and a conduit between the inlet and the outlet. The heat exchanger is adapted to allow a flow of a first fluid (e.g. water) inside the conduit and to establish a heat exchange relationship between the first fluid and a second fluid (e.g. reformate from a reforming reactor) flowing outside the conduit. The sprayer is coupled to the outlet of the heat exchanger for spraying the first fluid exiting the heat exchanger into the second fluid.

  19. Electrical Generation Tax Reform Act (Montana)

    Broader source: Energy.gov [DOE]

    This Act reforms taxes paid by electricity generators to reduce tax rates and imposes replacement taxes in response to the 1997 restructuring of the Montana electric utility industry that allows...

  20. School Reform for Students of Color and English Learners: Leaving Pedagogy Behind

    E-Print Network [OSTI]

    Trujillo, Tina

    2011-01-01T23:59:59.000Z

    education. Public school reformers have responded to theseto study how California’s reformers can influence not justhow influence California’s reformers can influen ce not just

  1. Recipe for Reform: The Food Economy Movement in Britain During the First World War

    E-Print Network [OSTI]

    Buckley, Michael Dennis

    2009-01-01T23:59:59.000Z

    series. However, one food reformer had not plagiarized fromBefore the war, food reformers addressed endemic hungerback on the prewar reformers' program of "food economy."

  2. Liquid fuel reformer development: Autothermal reforming of Diesel fuel

    SciTech Connect (OSTI)

    Pereira, C.; Bae, J-M.; Ahmed, S.; Krumpelt, M.

    2000-07-24T23:59:59.000Z

    Argonne National Laboratory is developing a process to convert hydrocarbon fuels to clean hydrogen feeds for a polymer electrolyte fuel cell. The process incorporates an autothermal reforming catalyst that can process hydrocarbon feeds at lower temperatures than existing commercial catalysts. The authors have tested the catalyst with three diesel-type fuels: hexadecane, certified low-sulfur grade 1 diesel, and a standard grade 2 diesel. Hexadecane yielded products containing 60% hydrogen on a dry, nitrogen-free basis at 850 C, while maximum hydrogen product yields for the two diesel fuels were near 50%. Residual products in all cases included CO, CO{sub 2}, ethane, and methane. Further studies with grade 1 diesel showed improved conversion as the water:fuel ratio was increased from 1 to 2 at 850 C. Soot formation was reduced when the oxygen:carbon ratio was maintained at 1 at 850 C. There were no significant changes in hydrogen yield as the space velocity and the oxygen:fuel ratio were varied. Tests with a microchannel monolithic catalyst yielded similar or improved hydrogen levels at higher space velocities than with extruded pellets in a packed bed.

  3. Reforming of fuel inside fuel cell generator

    DOE Patents [OSTI]

    Grimble, R.E.

    1988-03-08T23:59:59.000Z

    Disclosed is an improved method of reforming a gaseous reformable fuel within a solid oxide fuel cell generator, wherein the solid oxide fuel cell generator has a plurality of individual fuel cells in a refractory container, the fuel cells generating a partially spent fuel stream and a partially spent oxidant stream. The partially spent fuel stream is divided into two streams, spent fuel stream 1 and spent fuel stream 2. Spent fuel stream 1 is burned with the partially spent oxidant stream inside the refractory container to produce an exhaust stream. The exhaust stream is divided into two streams, exhaust stream 1 and exhaust stream 2, and exhaust stream 1 is vented. Exhaust stream 2 is mixed with spent fuel stream 2 to form a recycle stream. The recycle stream is mixed with the gaseous reformable fuel within the refractory container to form a fuel stream which is supplied to the fuel cells. Also disclosed is an improved apparatus which permits the reforming of a reformable gaseous fuel within such a solid oxide fuel cell generator. The apparatus comprises a mixing chamber within the refractory container, means for diverting a portion of the partially spent fuel stream to the mixing chamber, means for diverting a portion of exhaust gas to the mixing chamber where it is mixed with the portion of the partially spent fuel stream to form a recycle stream, means for injecting the reformable gaseous fuel into the recycle stream, and means for circulating the recycle stream back to the fuel cells. 1 fig.

  4. Reforming of fuel inside fuel cell generator

    DOE Patents [OSTI]

    Grimble, Ralph E. (Finleyville, PA)

    1988-01-01T23:59:59.000Z

    Disclosed is an improved method of reforming a gaseous reformable fuel within a solid oxide fuel cell generator, wherein the solid oxide fuel cell generator has a plurality of individual fuel cells in a refractory container, the fuel cells generating a partially spent fuel stream and a partially spent oxidant stream. The partially spent fuel stream is divided into two streams, spent fuel stream I and spent fuel stream II. Spent fuel stream I is burned with the partially spent oxidant stream inside the refractory container to produce an exhaust stream. The exhaust stream is divided into two streams, exhaust stream I and exhaust stream II, and exhaust stream I is vented. Exhaust stream II is mixed with spent fuel stream II to form a recycle stream. The recycle stream is mixed with the gaseous reformable fuel within the refractory container to form a fuel stream which is supplied to the fuel cells. Also disclosed is an improved apparatus which permits the reforming of a reformable gaseous fuel within such a solid oxide fuel cell generator. The apparatus comprises a mixing chamber within the refractory container, means for diverting a portion of the partially spent fuel stream to the mixing chamber, means for diverting a portion of exhaust gas to the mixing chamber where it is mixed with the portion of the partially spent fuel stream to form a recycle stream, means for injecting the reformable gaseous fuel into the recycle stream, and means for circulating the recycle stream back to the fuel cells.

  5. COSMIC-RAY-MEDIATED FORMATION OF BENZENE ON THE SURFACE OF SATURN'S MOON TITAN

    SciTech Connect (OSTI)

    Zhou Li; Zheng Weijun; Kaiser, Ralf I. [Department of Chemistry, University of Hawaii at Manoa, Honolulu, HI (United States); Landera, Alexander; Mebel, Alexander M. [Department of Chemistry and Biochemistry, Florida International University, Miami, FL (United States); Liang, Mao-Chang [Research Center for Environmental Changes, Academia Sinica, Taipei, Taiwan (China); Yung, Yuk L. [Division of Geological and Planetary Sciences, Caltech, Pasadena, CA (United States)

    2010-08-01T23:59:59.000Z

    The aromatic benzene molecule (C{sub 6}H{sub 6})-a central building block of polycyclic aromatic hydrocarbon molecules-is of crucial importance for the understanding of the organic chemistry of Saturn's largest moon, Titan. Here, we show via laboratory experiments and electronic structure calculations that the benzene molecule can be formed on Titan's surface in situ via non-equilibrium chemistry by cosmic-ray processing of low-temperature acetylene (C{sub 2}H{sub 2}) ices. The actual yield of benzene depends strongly on the surface coverage. We suggest that the cosmic-ray-mediated chemistry on Titan's surface could be the dominant source of benzene, i.e., a factor of at least two orders of magnitude higher compared to previously modeled precipitation rates, in those regions of the surface which have a high surface coverage of acetylene.

  6. DYNAMIC MODELING AND CONTROL OF REACTIVE DISTILLATION FOR HYDROGENATION OF BENZENE 

    E-Print Network [OSTI]

    Aluko, Obanifemi

    2010-01-16T23:59:59.000Z

    This work presents a modeling and control study of a reactive distillation column used for hydrogenation of benzene. A steady state and a dynamic model have been developed to investigate control structures for the column. The most important aspects...

  7. Numerical analysis of the effect of acetylene and benzene addition to low-pressure benzene-rich flat flames on polycyclic aromatic hydrocarbon formation

    SciTech Connect (OSTI)

    Kunioshi, Nilson [Graduate School of Engineering, Osaka University, 2-1 Yamadaoka, Suita, Osaka 565-0871 (Japan); Komori, Seisaku [6th Group, Central Research Laboratory, Hamamatsu Photonics K. K. 500 Hirakuchi, Hamakita City, Shizuoka 434-8601 (Japan); Fukutani, Seishiro [Department of System Engineering, Okayama Prefectural University, 111 Kuboki, Soja, Okayama 719-1197 (Japan)

    2006-10-15T23:59:59.000Z

    A modification of the CHEMKIN II package has been proposed for modeling addition of an arbitrary species at an arbitrary temperature to an arbitrary distance from the burner along a flat flame. The modified program was applied to the problem of addition of acetylene or benzene to different positions of a 40-Torr, {phi}=2.4 benzene/O{sub 2}/40%-N{sub 2} premixed flame to reach final equivalence ratios of {phi}=2.5 and 2.681. The results obtained showed that acetylene addition to early positions of the flame led to significant increase in pyrene production rates, but pyrene concentrations were lower in the flames with acetylene addition in both the {phi}=2.5 and 2.681 cases. Addition of benzene to the flame did not alter pyrene production rates in either the {phi}=2.5 or 2.681 cases; however, for {phi}=2.5, pyrene concentrations increased with benzene addition, while for {phi}=2.681, pyrene contents decreased in comparison to the correspondent flames with no addition. Acetylene addition led to a significant increase in pyrene production rates, but the pyrene levels dropped due to increase in the flow velocity. Pyrene production rates were not sensitive to benzene addition, but pyrene contents increased with benzene addition when the flow velocity decreased. These results show that PAH concentration changes accompanying species addition to flames should be interpreted carefully, because an increase or decrease in the content of a PAH species does not necessarily reflect an effect on its formation rate or mechanism. (author)

  8. Diffusion of benzene confined in the oriented nanochannels of chrysotile asbestos fibers

    SciTech Connect (OSTI)

    Mamontov, E. [NIST Center for Neutron Research, National Institute of Standards and Technology, 100 Bureau Dr., MS 8562, Gaithersburg, Maryland 20899-8562 (United States); Department of Materials Science and Engineering, University of Maryland, College Park, Maryland 20742-2115 (United States); Kumzerov, Yu.A.; Vakhrushev, S.B. [Ioffe Physico-Technical Institute, 194021 St. Petersburg (Russian Federation)

    2005-11-01T23:59:59.000Z

    We used quasielastic neutron scattering to study the dynamics of benzene that completely fills the nanochannels of chrysotile asbestos fibers with a characteristic diameter of about 5 nm. The macroscopical alignment of the nanochannels in fibers provided an interesting opportunity to study anisotropy of the dynamics of confined benzene by means of collecting the data with the scattering vector either parallel or perpendicular to the fibers axes. The translational diffusive motion of benzene molecules was found to be isotropic. While bulk benzene freezes at 278.5 K, we observed the translational dynamics of the supercooled confined benzene on the time scale of hundreds of picoseconds even below 200 K, until at about 160 K its dynamics becomes too slow for the {mu}eV resolution of the neutron backscattering spectrometer. The residence time between jumps for the benzene molecules measured in the temperature range of 260 K to 320 K demonstrated low activation energy of 2.8 kJ/mol.

  9. Multiple solutions of CCD equations for PPP model of benzene

    E-Print Network [OSTI]

    Podeszwa, R; Jankowski, K; Rubiniec, K; Podeszwa, Rafa{\\l}; Stolarczyk, Leszek Z.; Jankowski, Karol; Rubiniec, Krzysztof

    2002-01-01T23:59:59.000Z

    To gain some insight into the structure and physical significance of the multiple solutions to the coupled-cluster doubles (CCD) equations corresponding to the Pariser-Parr-Pople (PPP) model of cyclic polyenes, complete solutions to the CCD equations for the A^{-}_{1g} states of benzene are obtained by means of the homotopy method. By varying the value of the resonance integral beta from -5.0 eV to -0.5 eV, we cover the so-called weakly, moderately, and strongly correlated regimes of the model. For each value of beta 230 CCD solutions are obtained. It turned out, however, that only for a few solutions a correspondence with some physical states can be established. It has also been demonstrated that, unlike for the standard methods of solving CCD equations, some of the multiple solutions to the CCD equations can be attained by means of the iterative process based on Pulay's direct inversion in the iterative subspace (DIIS) approach.

  10. Perspective: The road to reform

    SciTech Connect (OSTI)

    Howe, J.B. (J. Makowski Associates Inc., Boston, MA (United States))

    1994-04-01T23:59:59.000Z

    The rapid transformation underway in the utility industry provides ample evidence that the reality of the Energy Policy Act of 1992 is sinking in. This law reflected Congress's conclusion that competition in wholesale power generation-at the plant busbar-is a demonstrable reality. It expressed the vision of a fully competitive wholesale generation market, with suppliers linked to markets through a grid that would provide service on a nondiscriminatory basis. But will consumers reap the full benefits of effective competition at the wholesale generation level Or will more disorderly forms of competition emerge, reflecting a hybrid of deregulation and old-fashioned monopoly tactics Along the latter course we run the risk of cost shifts among customer classes, customer defections, diminished utility cooperation, and higher overall costs to society. In short, the vision of a competitive market in wholesale generation will not come about without thoughtful efforts at defining the relevant market, as well as careful attention to the management of a difficult transition away from outmodes mindsets and regulatory models. As a national trade association representing independent power producers (IPPs) and suppliers of goods and services to the competitive wholesale electric generation industry, the Electric Generation Association (EGA) believes that constructive dialogue will yield the best approach to managing this difficult process of transition. In that spirit, the EGA Emerging Operational Issues Committee recently released a while paper, [open quotes]Electrifying Change: Strategies for Structural Reform in the Electric Industry,[close quotes] which forms the basis for this article.

  11. Hydrogen generation utilizing integrated CO2 removal with steam reforming

    DOE Patents [OSTI]

    Duraiswamy, Kandaswamy; Chellappa, Anand S

    2013-07-23T23:59:59.000Z

    A steam reformer may comprise fluid inlet and outlet connections and have a substantially cylindrical geometry divided into reforming segments and reforming compartments extending longitudinally within the reformer, each being in fluid communication. With the fluid inlets and outlets. Further, methods for generating hydrogen may comprise steam reformation and material adsorption in one operation followed by regeneration of adsorbers in another operation. Cathode off-gas from a fuel cell may be used to regenerate and sweep the adsorbers, and the operations may cycle among a plurality of adsorption enhanced reformers to provide a continuous flow of hydrogen.

  12. Test of electron beam technology on Savannah River Laboratory low-activity aqueous waste for destruction of benzene, benzene derivatives, and bacteria

    SciTech Connect (OSTI)

    Dougal, R.A. [Univ. of South Carolina, Columbia, SC (United States). Dept. of Electrical and Computer Engineering

    1993-08-01T23:59:59.000Z

    High energy radiation was studied as a means for destroying hazardous organic chemical wastes. Tests were conducted at bench scale with a {sup 60}Co source, and at full scale (387 l/min) with a 1.5 MV electron beam source. Bench scale tests for both benzene and phenol included 32 permutations of water quality factors. For some water qualities, as much as 99.99% of benzene or 90% of phenol were removed by 775 krads of {sup 60}Co irradiation. Full scale testing for destruction of benzene in a simulated waste-water mix showed loss of 97% of benzene following an 800 krad dose and 88% following a 500 krad dose. At these loss rates, approximately 5 Mrad of electron beam irradiation is required to reduce concentrations from 100 g/l to drinking water quality (5 {mu}g/l). Since many waste streams are also inhabited by bacterial populations which may affect filtering operations, the effect of irradiation on those populations was also studied. {sup 60}Co and electron beam irradiation were both lethal to the bacteria studied at irradiation levels far lower than were necessary to remove organic contaminants.

  13. Low Cost Autothermal Diesel Reforming Catalyst Development

    SciTech Connect (OSTI)

    Shihadeh, J.; Liu, D.

    2004-01-01T23:59:59.000Z

    Catalytic autothermal reforming (ATR) represents an important step of converting fossil fuel to hydrogen rich reformate for use in solid oxide fuel cell (SOFC) stacks. The state-of-the-art reforming catalyst, at present, is a Rh based material which is effective but costly. The objective of our current research is to reduce the catalyst cost by finding an efficient ATR catalyst containing no rhodium. A group of perovskite based catalysts have been synthesized and evaluated under the reforming condition of a diesel surrogate fuel. Hydrogen yield, reforming efficiency, and conversion selectivity to carbon oxides of the catalyst ATR reaction are calculated and compared with the benchmark Rh based material. Several catalyst synthesis improvements were carried out including: 1) selectively doping metals on the A-site and B-site of the perovskite structure, 2) changing the support from perovskite to alumina, 3) altering the method of metal addition, and 4) using transition metals instead of noble metals. It was found that the catalytic activity changed little with modification of the A-site metal, while it displayed considerable dependence on the B-site metal. Perovskite supports performed much better than alumina based supports.

  14. Interaction of toluene with two-color asymmetric laser fields: Controlling the directional emission of molecular hydrogen fragments

    SciTech Connect (OSTI)

    Kaziannis, S.; Kotsina, N.; Kosmidis, C. [Department of Physics, Atomic and Molecular Physics Laboratory, University of Ioannina, University Campus, Ioannina GR-45110 (Greece)

    2014-09-14T23:59:59.000Z

    The interaction of toluene with strong asymmetric two-color laser irradiation of 40 fs duration is studied by means of Time of flight mass spectrometry. Highly energetic H{sub 2}{sup +} and H{sub 3}{sup +} fragment ions are produced through an isomerization process taking place within transient multiply charged parent ions. Comparative study of deuterium labeled toluene isotopes enables the discrimination between molecular hydrogen fragments formed exclusively within the CH{sub 3}- part from those that require hydrogen atom exchange between the former and the phenyl moiety. It is demonstrated that by manipulating the relative phase of the ?/2? field components the selective ionization of oriented toluene molecules can be used as a tool to control the directional emission of the H{sub 2}{sup +}, H{sub 3}{sup +} species.

  15. Low Energy Barrier Proton Transfer in Protonated Benzene-Water Complex Eugene S. Kryachko and Minh Tho Nguyen*

    E-Print Network [OSTI]

    Nguyen, Minh Tho

    Low Energy Barrier Proton Transfer in Protonated Benzene-Water Complex Eugene S. Kryachko and Minh-bonded benzene-water complex is studied at the MP2/6-31+G(d,p) computational level. It is shown that, contrary to the fact that benzene is more basic than water by 13.5 kcal/mol, the excess proton favors to reside

  16. INDIVIDUAL REFORM ELEMENTS .63Average course exam score

    E-Print Network [OSTI]

    Colorado at Boulder, University of

    INDIVIDUAL REFORM ELEMENTS .63Average course exam score .11In class clicker score .02Lecture: · Correlations with effort/curricular elements are positive but not high, indicating no individual course reform

  17. Advanced Fuel Reformer Development: Putting the 'Fuel' in Fuel...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Fuel Reformer Development: Putting the 'Fuel' in Fuel Cells Advanced Fuel Reformer Development: Putting the 'Fuel' in Fuel Cells Presented at the DOE-DOD Shipboard APU Workshop on...

  18. Electricity reform in Chile : lessons for developing countries

    E-Print Network [OSTI]

    Pollitt, Michael G.

    2004-01-01T23:59:59.000Z

    Chile was the first country in the world to implement a comprehensive reform of its electricity sector in the recent period. Among developing countries only Argentina has had a comparably comprehensive and successful reform. ...

  19. MORE HEALTH CARE REFORM By Victor R. Fuchs

    E-Print Network [OSTI]

    Zalta, Edward N.

    MORE HEALTH CARE REFORM By Victor R. Fuchs #12;2 | MORE HEALTH CARE REFORM The Robert Wood Johnson?................................................................................... 8 Government Payment for Health Care -- Causes and Consequences....................................................................................................................................................................................... 16 Health Care Is Different -- That's Why Expenditures Matter

  20. How Did Health Care Reform in Massachusetts Impact Insurance Premiums?

    E-Print Network [OSTI]

    Graves, John A.

    It is widely recognized that the 2006 Massachusetts health reforms served as a blueprint for national reform under the 2010 Affordable Care Act (ACA). As such, there is interest in using the Massachusetts experience to ...

  1. adiabatic reformer processes: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    CELL of consequences, the most important of which are the possibility to partially reform the raw fuel in the fuel cell and energy balance, different types of fuel reforming...

  2. Thermally integrated staged methanol reformer and method

    DOE Patents [OSTI]

    Skala, Glenn William (Churchville, NY); Hart-Predmore, David James (Rochester, NY); Pettit, William Henry (Rochester, NY); Borup, Rodney Lynn (East Rochester, NY)

    2001-01-01T23:59:59.000Z

    A thermally integrated two-stage methanol reformer including a heat exchanger and first and second reactors colocated in a common housing in which a gaseous heat transfer medium circulates to carry heat from the heat exchanger into the reactors. The heat transfer medium comprises principally hydrogen, carbon dioxide, methanol vapor and water vapor formed in a first stage reforming reaction. A small portion of the circulating heat transfer medium is drawn off and reacted in a second stage reforming reaction which substantially completes the reaction of the methanol and water remaining in the drawn-off portion. Preferably, a PrOx reactor will be included in the housing upstream of the heat exchanger to supplement the heat provided by the heat exchanger.

  3. Pyrochlore catalysts for hydrocarbon fuel reforming

    DOE Patents [OSTI]

    Berry, David A.; Shekhawat, Dushyant; Haynes, Daniel; Smith, Mark; Spivey, James J.

    2012-08-14T23:59:59.000Z

    A method of catalytically reforming a reactant gas mixture using a pyrochlore catalyst material comprised of one or more pyrochlores having the composition A2B2-y-zB'yB"zO7-.DELTA., where y>0 and z.gtoreq.0. Distribution of catalytically active metals throughout the structure at the B site creates an active and well dispersed metal locked into place in the crystal structure. This greatly reduces the metal sintering that typically occurs on supported catalysts used in reforming reactions, and reduces deactivation by sulfur and carbon. Further, oxygen mobility may also be enhanced by elemental exchange of promoters at sites in the pyrochlore. The pyrochlore catalyst material may be utilized in catalytic reforming reactions for the conversion of hydrocarbon fuels into synthesis gas (H2+CO) for fuel cells, among other uses.

  4. Auxiliary reactor for a hydrocarbon reforming system

    DOE Patents [OSTI]

    Clawson, Lawrence G.; Dorson, Matthew H.; Mitchell, William L.; Nowicki, Brian J.; Bentley, Jeffrey M.; Davis, Robert; Rumsey, Jennifer W.

    2006-01-17T23:59:59.000Z

    An auxiliary reactor for use with a reformer reactor having at least one reaction zone, and including a burner for burning fuel and creating a heated auxiliary reactor gas stream, and heat exchanger for transferring heat from auxiliary reactor gas stream and heat transfer medium, preferably two-phase water, to reformer reaction zone. Auxiliary reactor may include first cylindrical wall defining a chamber for burning fuel and creating a heated auxiliary reactor gas stream, the chamber having an inlet end, an outlet end, a second cylindrical wall surrounding first wall and a second annular chamber there between. The reactor being configured so heated auxiliary reactor gas flows out the outlet end and into and through second annular chamber and conduit which is disposed in second annular chamber, the conduit adapted to carry heat transfer medium and being connectable to reformer reaction zone for additional heat exchange.

  5. In utero exposure to benzene increases embryonic c-Myb and Pim-1 protein levels in CD-1 mice

    SciTech Connect (OSTI)

    Wan, Joanne [Department of Pharmacology and Toxicology, Queen's University, Kingston, Ontario, K7L 3N6 (Canada); Winn, Louise M. [Department of Pharmacology and Toxicology, Queen's University, Kingston, Ontario, K7L 3N6 (Canada); School of Environmental Studies, Queen's University, Kingston, Ontario, K7L 3N6 (Canada)], E-mail: winnl@queensu.ca

    2008-05-01T23:59:59.000Z

    Benzene is a known human leukemogen, but its role as an in utero leukemogen remains controversial. Epidemiological studies have correlated parental exposure to benzene with an increased incidence of childhood leukemias. We hypothesize that in utero exposure to benzene may cause leukemogenesis by affecting the embryonic c-Myb/Pim-1 signaling pathway and that this is mediated by oxidative stress. To investigate this hypothesis, pregnant CD-1 mice were treated with either 800 mg/kg of benzene or corn oil (i.p.) on days 10 and 11 of gestation and in some cases pretreated with 25 kU/kg of PEG-catalase. Phosphorylated and total embryonic c-Myb and Pim-1 protein levels were assessed using Western blotting and maternal and embryonic oxidative stress were assessed by measuring reduced to oxidized glutathione ratios. Our results show increased oxidative stress at 4 and 24 h after exposure, increased phosphorylated Pim-1 protein levels 4 h after benzene exposure, and increased Pim-1 levels at 24 and 48 h after benzene exposure. Embryonic c-Myb levels were elevated at 24 h after exposure. PEG-catalase pretreatment prevented benzene-mediated increases in embryonic c-Myb and Pim-1 protein levels, and benzene-induced oxidative stress. These results support a role for ROS in c-Myb and Pim-1 alterations after in utero benzene exposure.

  6. Cost Analysis of Bio-Derived Liquids Reforming

    E-Print Network [OSTI]

    Ethanol Reforming Options Gas Phase Liquid Phase Virent Steam Partial Oxidation Reforming GE (SCPO) decomposition C2H5OH Æ CH4 + CO + H2 steam reforming CH4 + 2H2O Æ 4H2 + CO2 3) C2H5OH dehydrogenation to acetaldehyde (C2H4O) dehydrogenation C2H5OH Æ C2H4O + H2 decarbonylation C2H4O Æ CH4 + CO steam reforming CH4

  7. Diesel reforming for SOFC auxiliary power units

    SciTech Connect (OSTI)

    Borup, R. L. (Rodney L.); Parkinson, W. J. (William Jerry),; Inbody, M. A. (Michael A.); Tafoya, J. I. (Jose I.); Guidry, D. R. (Dennis Ray)

    2004-01-01T23:59:59.000Z

    The use of a solid-oxide fuel cell (SOFC) to provide auxiliary power for heavy duty trucks can increase fuel efficiency and reduce emissions by reducing engine idling time. The logical fuel of choice for a truck SOFC APU is diesel fuel, as diesel is the fuel of choice for these vehicles. SOFC's that directly oxidize hydrocarbon fuels have lower power densities than do SOFC's that operate from hydrocarbon reformate, and since the SOFC is a costly component, maximizing the fuel cell power density provides benefits in reducing the overall APU system cost. Thus current SOFC APU systems require the reformation of higher hydrocarbons for the most efficient and cost effect fuel cell system. The objective of this research is to develop the technology to enable diesel reforming for SOFC truck APU applications. Diesel fuel can be reformed into a H{sub 2} and CO-rich fuel feed stream for a SOFC by autothermal reforming (ATR), a combination of catalytic partial oxidation (CPOx), and steam reforming (SR). The typical autothermal reformer is an adiabatic, heterogeneous catalytic reactor and the challenges in its design, operation and durability on diesel fuel are manifold. These challenges begin with the vaporization and mixing of diesel fuel with air and steam where fuel pyrolysis can occur and improper mixing leads to hot and cold spots, which contribute to carbon formation and incomplete fuel conversion. The exotherm of the partial oxidation reaction can generate temperatures in excess of 800 C, a temperature at which catalysts rapidly sinter, thus reducing their lifetime. The temperature rise can be reduced by the steam reforming endotherm, but this requires the addition of water along with proper design to balance the kinetic rates. Carbon formation during operation and startup can lead to catalyst deactivation and fouling of downstream components, thus reducing durability of the fuel processor. Water addition helps to reduce carbon formation, but a key issue is the source of the water onboard a vehicle. Additionally, changes in diesel fuel composition, such as seasonal changes affect the reactor operation and design considerations. Our research addresses these issues through an experimental and modeling examination of the fundamentals of these processes.

  8. APPROACHING THE LIMIT: EARLY NATIONAL LESSONS FROM WELFARE REFORM

    E-Print Network [OSTI]

    Shyy, Wei

    APPROACHING THE LIMIT: EARLY NATIONAL LESSONS FROM WELFARE REFORM Sheldon Danziger University of Welfare Reform. Kalamazoo, MI: Upjohn Institute for Employment Research, 2001. Sheldon Danziger is Henry J, and Bruce Weber, helpful comments on a previous draft. #12;2 Welfare reform has been one of the most

  9. REFORM OF EUROPEAN MERGER POLICY Bruce R Lyons

    E-Print Network [OSTI]

    Feigon, Brooke

    REFORM OF EUROPEAN MERGER POLICY by Bruce R Lyons CCR Working Paper CCR 03-5 Abstract This article highlights the main drivers for merger policy reform in the EU, including the consequences of the recent appeal court reverses. It discusses some of the substantive and procedural issues that the reform package

  10. DFMA Cost Estimates of Fuel-Cell/Reformer Systems

    E-Print Network [OSTI]

    Page 1 DFMA Cost Estimates of Fuel-Cell/Reformer Systems at Low/Medium/High Production Rates Brian estimates of complete fuel cell- reformer systems at low/medium/high manufacturing rates to assess of Boothroyd Dewhurst Inc. #12;Page 4 Scope of Project Reformer System Fuel Cell System Fuel Storage What

  11. Tax Reform in the 21st Alan J. Auerbach*

    E-Print Network [OSTI]

    Sadoulet, Elisabeth

    Tax Reform in the 21st Century Alan J. Auerbach* University of California, Berkeley, and NBER May 6 for a conference, "Is it Time for Fundamental Tax Reform?" held at the James A. Baker III Institute at Rice a major reform to make its tax system simpler, fairer and more efficient? In addressing this question, I

  12. The Future of Democracy in Europe Trends, Analyses and Reforms

    E-Print Network [OSTI]

    Franz, Sven Oliver

    1 The Future of Democracy in Europe Trends, Analyses and Reforms A Green Paper for the Council-level accountability Mechanisms for direct citizen consultation Part III. Recommendations for reform Introduction Guidelines Our "wish list" of recommended reforms 1. Universal citizenship 2. Discretionary voting 3

  13. SANITARY REFORM The Montreal Witness, April 27, 1859

    E-Print Network [OSTI]

    Genest, Christian

    SANITARY REFORM The Montreal Witness, April 27, 1859 A lecture was delivered on this singularly was thoroughly acquainted with his sub- ject, having been for a number of years actively engaged in this reform in England, part of the time as Secretary of an eminent sanitary reformer, and his facts and figures were

  14. ISSN 1745-9648 The Impact of Electricity Market Reform

    E-Print Network [OSTI]

    Feigon, Brooke

    ISSN 1745-9648 The Impact of Electricity Market Reform on Consumers by Catherine Waddams Price ESRC market reform on residential consumers, using a sequence of hypothetical scenarios which are likely to be prompted by reform. These include raising tariffs to cost-reflective levels and introducing a standing

  15. Data reconciliation and optimal operation of a catalytic naphtha reformer

    E-Print Network [OSTI]

    Skogestad, Sigurd

    Data reconciliation and optimal operation of a catalytic naphtha reformer Tore Lid Statoil Mongstad-mail:skoge@chemeng.ntnu.no) #12;Abstract The naphtha reforming process converts low-octane gasoline blending compo- nents to high-octane components for use in high-performance gasoline fuels. The reformer also has a important function

  16. AAPT Philadelphia 1/02 Gender, Educational Reform,

    E-Print Network [OSTI]

    Wu, Mingshen

    AAPT Philadelphia 1/02 Gender, Educational Reform, and Instructional Assessment: Part I Laura Mc/02 Why study this issue? One goal of PER is to improve physics education for all Current reform effort is strong; reforms serving subpopulations? Is this gender gap showing at the college level in physics? #12

  17. A Reformed Mathematics Education at Chalmers Stig Larsson

    E-Print Network [OSTI]

    Larsson, Stig

    A Reformed Mathematics Education at Chalmers Stig Larsson Department of Mathematics Chalmers@math.chalmers.se Kvalitetskonferensen, Norrk¨oping, September 25­27, 2001 Abstract Engineering education faces the challenge to reform to effectively use the new tools offered by computers. We present a program for a reformed engineering

  18. Data reconciliation and optimal operation of a catalytic naphtha reformer

    E-Print Network [OSTI]

    Skogestad, Sigurd

    Data reconciliation and optimal operation of a catalytic naphtha reformer Tore Lid Statoil Mongstad-mail:skoge@chemeng.ntnu.no) #12;Abstract The naphtha reforming process converts low-octane gasoline blending compo- nents to high-octane components for use in high-performance gasoline fuels. The reformer also has an important function

  19. Land Reform and Exclusion of Poor Jagat Basnet

    E-Print Network [OSTI]

    Richner, Heinz

    141 CHAPTER 6 Land Reform and Exclusion of Poor People Jagat Basnet 6.1 Land Questions Firstly, by land reform, it is widely understood to be a process of confiscating someone's land and award Planning Commission (NPC). Land reform is an important factor for improving the economic status

  20. Supported metal catalysts for alcohol/sugar alcohol steam reforming

    SciTech Connect (OSTI)

    Davidson, Stephen; Zhang, He; Sun, Junming; Wang, Yong

    2014-08-21T23:59:59.000Z

    Despite extensive studies on hydrogen production via steam reforming of alcohols and sugar alcohols, catalysts typically suffer a variety of issues from poor hydrogen selectivity to rapid deactivation. Here, we summarize recent advances in fundamental understanding of functionality and structure of catalysts for alcohol/sugar alcohol steam reforming, and provide perspectives on further development required to design highly efficient steam reforming catalysts.

  1. health reform mattersTM alert ATTORNEY ADVERTISINGropesgray.com

    E-Print Network [OSTI]

    Chapman, Michael S.

    health reform mattersTM alert ATTORNEY ADVERTISINGropesgray.com On March 23, President Obama signed is tracking the myriad other developments of the new health reform law. You can find a wide range of related material, including enacting language, implementing documents, and analysis through the Health Reform

  2. Preliminary and incomplete A Modest Proposal for International Monetary Reform

    E-Print Network [OSTI]

    Grishok, Alla

    Preliminary and incomplete A Modest Proposal for International Monetary Reform International Columbia University #12;- 1 - - 1 - #12;- 2 - A Modest Proposal for International Monetary Reform Bruce are fundamental aspects of the present system and that, without reform, they will continue to plague the global

  3. SECTORAL EFFECTS OF TAX REFORMS IN AN OPEN ECONOMY

    E-Print Network [OSTI]

    Boyer, Edmond

    SECTORAL EFFECTS OF TAX REFORMS IN AN OPEN ECONOMY Olivier CARDI Romain RESTOUT December, 2010 REFORMS IN AN OPEN ECONOMY Olivier CARDI Universit´e Panth´eon-Assas ERMES Ecole Polytechnique Romain with traded and non traded goods to in- vestigate the sectoral effects of three tax reforms: i) two revenue

  4. WHEN DOES FINANCIAL SECTOR (IN)STABILITY INDUCE FINANCIAL REFORMS?

    E-Print Network [OSTI]

    Boyer, Edmond

    WHEN DOES FINANCIAL SECTOR (IN)STABILITY INDUCE FINANCIAL REFORMS? Susie LEE Ingmar SCHUMACHER (in)stability induce financial reforms? Susie Lee1 Ingmar Schumacher2 October 26, 2011 Abstract The article studies whether financial sector (in)stability had an effect on reforms in the fi- nancial sector

  5. the triple aim MEETING THE GOAL OF HEALTH REFORM

    E-Print Network [OSTI]

    Chapman, Michael S.

    the triple aim MEETING THE GOAL OF HEALTH REFORM Produced by OHSU Strategic Communications -- emphasizing shared decision-making and coordination between providers -- could influence reform in a big way care. health reform is about getting better health outcomes for our communities, improving access

  6. Wellcome Trust CONSULTATION RESPONSE Ofqual: A level Reform Consultation

    E-Print Network [OSTI]

    Rambaut, Andrew

    Wellcome Trust CONSULTATION RESPONSE Ofqual: A level Reform Consultation September 2012 1 Ofqual: A Level Reform Consultation Response by the Wellcome Trust September 2012 Key Points National Subject to university. We are therefore pleased to respond to this consultation on reforming A levels. Our comments

  7. Dissociation of the benzene molecule by UV and soft X-rays in circumstellar environment

    E-Print Network [OSTI]

    H. M. Boechat-Roberty; R. Neves; S. Pilling; A. F. Lago; G. G. B. de Souza

    2008-11-30T23:59:59.000Z

    Benzene molecules, present in the proto-planetary nebula CRL 618, are ionized and dissociated by UV and X-ray photons originated from the hot central star and by its fast wind. Ionic species and free radicals produced by these processes can lead to the formation of new organic molecules. The aim of this work is to study the photoionization and photodissociation processes of the benzene molecule, using synchrotron radiation and time of flight mass spectrometry. Mass spectra were recorded at different energies corresponding to the vacuum ultraviolet (21.21 eV) and soft X-ray (282-310 eV) spectral regions. The production of ions from the benzene dissociative photoionization is here quantified, indicating that C6H6 is more efficiently fragmented by soft X-ray than UV radiation, where 50% of the ionized benzene molecules survive to UV dissociation while only about 4% resist to X-rays. Partial ion yields of H+ and small hydrocarbons such as C2H2+, C3H3+ and C4H2+ are determined as a function of photon energy. Absolute photoionization and dissociative photoionization cross sections have also been determined. From these values, half-life of benzene molecule due to UV and X-ray photon fluxes in CRL 618 were obtained.

  8. Hydrogen-terminated silicon nanowire photocatalysis: Benzene oxidation and methyl red decomposition

    SciTech Connect (OSTI)

    Lian, Suoyuan [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China) [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China); School of Chemical Engineering and Materials, Dalian Polytechnic University, Dalian 116034 (China); Tsang, Chi Him A. [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China) [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China); Centre of Super Diamond and Advanced Films, City University of Hong Kong, Hong Kong (China); Kang, Zhenhui, E-mail: zhkang@suda.edu.cn [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China)] [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China); Liu, Yang, E-mail: yangl@suda.edu.cn [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China)] [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China); Wong, Ningbew [Centre of Super Diamond and Advanced Films, City University of Hong Kong, Hong Kong (China)] [Centre of Super Diamond and Advanced Films, City University of Hong Kong, Hong Kong (China); Lee, Shuit-Tong [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China) [Institute of Functional Nano and Soft Materials and Jiangsu Key Laboratory for Carbon-Based Functional Materials and Devices, Soochow University, Suzhou 215123 (China); Centre of Super Diamond and Advanced Films, City University of Hong Kong, Hong Kong (China)

    2011-12-15T23:59:59.000Z

    Graphical abstract: H-SiNWs can catalyze hydroxylation of benzene and degradation of methyl red under visible light irradiation. Highlights: Black-Right-Pointing-Pointer Hydrogen-terminated silicon nanowires were active photocatalyst in the hydroxylation of benzene under light. Black-Right-Pointing-Pointer Hydrogen-terminated silicon nanowires were also effective in the decomposition of methyl red dye. Black-Right-Pointing-Pointer The Si/SiO{sub x} core-shell structure is the main reason of the obtained high selectivity during the hydroxylation. -- Abstract: Hydrogen-terminated silicon nanowires (H-SiNWs) were used as heterogeneous photocatalysts for the hydroxylation of benzene and for the decomposition of methyl red under visible light irradiation. The above reactions were monitored by GC-MS and UV-Vis spectrophotometry, respectively, which shows 100% selectivity for the transformation of benzene to phenol. A complete decomposition of a 2 Multiplication-Sign 10{sup -4} M methyl red solution was achieved within 30 min. The high selectivity for the hydroxylation of benzene and the photodecomposition demonstrate the catalytic activity of ultrafine H-SiNWs during nanocatalysis.

  9. Total cross sections for positron scattering from benzene, cyclohexane, and aniline

    SciTech Connect (OSTI)

    Zecca, Antonio; Moser, Norberto; Perazzolli, Chiara; Salemi, Alessandro [Department of Physics, University of Trento, I-38050 Povo (Trento) (Italy); Brunger, Michael J. [ARC Centre for Antimatter-Matter Studies, School of Chemistry, Physics and Earth Sciences, Flinders University, G.P.O. Box 2100, Adelaide, South Australia 5001 (Australia)

    2007-08-15T23:59:59.000Z

    We use a linear transmission technique to measure total cross sections for positron scattering from benzene, cyclohexane, and aniline. In the case of cyclohexane, the energy range of the present study is 0.1-20 eV, while for benzene and aniline it is 0.2-20 eV. With respect to benzene and cyclohexane, comparison is made to the only other existing results we know of [Makochekanwa and co-workers, Phys. Rev. A 68, 032707 (2003); 72, 042705 (2005)]. Agreement with those data is only marginal, being particularly poor at the overlap lower energies. Unlike Kimura et al. [J. Phys. B 37, 1461 (2004)], we find the low-energy dependence of the positron-benzene total cross sections to be qualitatively similar to those found in the electron channel [Gulley et al., J. Phys. B 31, 2735 (1998)]. We believe that the present positron-aniline total cross sections represent the first time such data have been measured. These cross sections are almost identical to those we found for benzene, suggesting that substitution of hydrogen by the amine group on the aromatic ring is largely irrelevant to the scattering process in the energy regimes considered.

  10. THE INFLUENCE OF BENZENE AS A TRACE REACTANT IN TITAN AEROSOL ANALOGS

    SciTech Connect (OSTI)

    Trainer, Melissa G. [Planetary Environments Laboratory, Code 699, NASA Goddard Space Flight Center, Greenbelt, MD 20771 (United States); Sebree, Joshua A. [NASA Postdoctoral Program Fellow, Code 699, Goddard Space Flight Center, Greenbelt, MD 20771 (United States); Heidi Yoon, Y.; Tolbert, Margaret A., E-mail: melissa.trainer@nasa.gov [Cooperative Institute for Research in Environmental Sciences, University of Colorado at Boulder, Box 216 UCB, Boulder, CO 80309 (United States)

    2013-03-20T23:59:59.000Z

    Benzene has been detected in Titan's atmosphere by Cassini instruments, with concentrations ranging from sub-ppb in the stratosphere to ppm in the ionosphere. Sustained levels of benzene in the haze formation region could signify that it is an important reactant in the formation of Titan's organic aerosol. To date, there have not been laboratory investigations to assess the influence of benzene on aerosol properties. We report a laboratory study on the chemical composition of organic aerosol formed from C{sub 6}H{sub 6}/CH{sub 4}/N{sub 2} via far ultraviolet irradiation (120-200 nm). The compositional results are compared to those from aerosol generated by a more ''traditional Titan'' mixture of CH{sub 4}/N{sub 2}. Our results show that even a trace amount of C{sub 6}H{sub 6} (10 ppm) has significant impact on the chemical composition and production rates of organic aerosol. There are several pathways by which photolyzed benzene may react to form larger molecules, both with and without the presence of CH{sub 4}, but many of these reaction mechanisms are only beginning to be explored for the conditions at Titan. Continued work investigating the influence of benzene in aerosol growth will advance understanding of this previously unstudied reaction system.

  11. Economic analysis: impact of CS/R process on benzene market

    SciTech Connect (OSTI)

    Spielberger, L.; Klein, J.

    1981-05-01T23:59:59.000Z

    Contract No. DE-AC01-78ET10159 (formerly ET-78-C-01-3117) between UOP/SDC and the United States Department of Energy (DOE) requires UOP/SDC to provide specific engineering and technical services to the DOE Office of Coal Processing in support of the Coal Gasification Program. This report covers an economic study on the projected price of benzene through the next decade based on the market factors and production costs. The impact of the CS/R process on the benzene market was evaluated. In addition, the cost of gas from the CS/R process was determined as a function of the byproduct credit for benzene.

  12. Vapor-liquid equilibria for the system benzene-thiophene-methanol

    SciTech Connect (OSTI)

    Triday, J.O.; Rodriguez, P.

    1985-01-01T23:59:59.000Z

    Isothermal vapor pressure data over the whole range of composition were obtained for the system benzene-thiophene-methanol. Data were taken at temperatures of 35, 40, and 45 /sup 0/C by using a static equilibrium cell. The systems benzene-methanol and thiophene-methanol are highly nonideal, while the system benzene-thiophene shows a very small deviation from ideality. The models suggested by Wilson and by Renon and Prausnitz (NRTL) and the modified equation of Abrams and Prausnitz (UNIQUAC) were used in the reduction of data. Physical parameters of these equations obtained from the binary data were used to predict the ternary system. The Wilson equation gives the best fit for the binary as well as the ternary data. Also, this equation gives the best prediction for the ternary system.

  13. Benzene Adsorbed on Metals: Concerted Effect of Covalency and van der Waals Bonding

    E-Print Network [OSTI]

    Liu, Wei; Santra, Biswajit; Michaelides, Angelos; Scheffler, Matthias; Tkatchenko, Alexandre

    2012-01-01T23:59:59.000Z

    The adsorption of aromatic molecules on metal surfaces plays a key role in condensed matter physics and functional materials. Depending on the strength of the interaction between the molecule and the surface, the binding is typically classified as either physisorption or chemisorption. Van der Waals (vdW) interactions contribute significantly to the binding in physisorbed systems, but the role of the vdW energy in chemisorbed systems remains unclear. Here we study the interaction of benzene with the (111) surface of transition metals, ranging from weak adsorption (Ag and Au) to strong adsorption (Pt, Pd, Ir, and Rh). When vdW interactions are accurately accounted for, the barrier to adsorption predicted by standard density functional calculations essentially vanishes, producing a metastable precursor state on Pt and Ir surfaces. Notably, vdW forces contribute more to the binding of covalently bonded benzene than they do when benzene is physisorbed.

  14. Theoretical study of reactions of HO{sub 2} in low-temperature oxidation of benzene

    SciTech Connect (OSTI)

    Altarawneh, Mohammednoor [Chemical Engineering Department, Al-Hussein Bin Talal University, Ma'an (Jordan); Dlugogorski, Bogdan Z.; Kennedy, Eric M.; Mackie, John C. [Process Safety and Environment Protection Research Group, School of Engineering, The University of Newcastle, Callaghan, NSW 2308 (Australia)

    2010-07-15T23:59:59.000Z

    We have generated a set of thermodynamic and kinetic parameters for the reactions involving HO{sub 2} in the very early stages of benzene oxidation at low temperatures using density functional theory (DFT). In particular, we report the rate constants for the reactions of HO{sub 2} with benzene and phenyl. The calculated reaction rate constant for the abstraction of H-C{sub 6}H{sub 5} by HO{sub 2} is found to be in good agreement with the limited experimental values. HO{sub 2} addition to benzene is found to be more important than direct abstraction. We show that the reactions of HO{sub 2} with the phenyl radical generate the propagating radical OH in a highly exoergic reaction. The results presented herein should be useful in modeling the oxidation of aromatic compounds at low temperatures. (author)

  15. In utero and in vitro effects of benzene and its metabolites on erythroid differentiation and the role of reactive oxygen species

    SciTech Connect (OSTI)

    Badham, Helen J. [Department of Pharmacology and Toxicology. Queen's University, Kingston, Ontario, K7L 3N6 (Canada); Winn, Louise M., E-mail: winnl@queensu.c [Department of Pharmacology and Toxicology. Queen's University, Kingston, Ontario, K7L 3N6 (Canada); School of Environmental Studies, Queen's University, Kingston, Ontario, K7L 3N6 (Canada)

    2010-05-01T23:59:59.000Z

    Benzene is a ubiquitous occupational and environmental toxicant. Exposures to benzene both prenatally and during adulthood are associated with the development of disorders such as aplastic anemia and leukemia. Mechanisms of benzene toxicity are unknown; however, generation of reactive oxygen species (ROS) by benzene metabolites may play a role. Little is known regarding the effects of benzene metabolites on erythropoiesis. Therefore, to determine the effects of in utero exposure to benzene on the growth and differentiation of fetal erythroid progenitor cells (CFU-E), pregnant CD-1 mice were exposed to benzene and CFU-E numbers were assessed in fetal liver (hematopoietic) tissue. In addition, to determine the effect of benzene metabolite-induced ROS generation on erythropoiesis, HD3 chicken erythroblast cells were exposed to benzene, phenol, or hydroquinone followed by stimulation of erythrocyte differentiation. Our results show that in utero exposure to benzene caused significant alterations in female offspring CFU-E numbers. In addition, exposure to hydroquinone, but not benzene or phenol, significantly reduced the percentage of differentiated HD3 cells, which was associated with an increase in ROS. Pretreatment of HD3 cells with polyethylene glycol-conjugated superoxide dismutase (PEG-SOD) prevented hydroquinone-induced inhibition of erythropoiesis, supporting the hypothesis that ROS generation is involved in the development of benzene erythrotoxicity. In conclusion, this study provided evidence that ROS generated as a result of benzene metabolism may significantly alter erythroid differentiation, potentially leading to the development of Blood Disorders.

  16. In Njeri Wamukonya, ed., Electricity Reform

    E-Print Network [OSTI]

    Delaware, University of

    electricity consumption in industrial countries has caused major air pollution problems. In fact, power plants maintain that governing the electricity industry according to market dynamics, rather than socioIn Njeri Wamukonya, ed., Electricity Reform: Social and Environmental Challenges Roskilde, Denmark

  17. Alternative technologies to steam-methane reforming

    SciTech Connect (OSTI)

    Tindall, B.M.; Crews, M.A. [Howe-Baker Engineers, Inc., Tyler, TX (United States)

    1995-11-01T23:59:59.000Z

    Steam-methane reforming (SMR) has been the conventional route for hydrogen and carbon monoxide production from natural gas feedstocks. However, several alternative technologies are currently finding favor for an increasing number of applications. The competing technologies include: steam-methane reforming combined with oxygen secondary reforming (SMR/O2R); autothermal reforming (ATR); thermal partial oxidation (POX). Each of these alternative technologies uses oxygen as a feedstock. Accordingly, if low-cost oxygen is available, they can be an attractive alternate to SMR with natural gas feedstocks. These technologies are composed technically and economically. The following conclusions can be drawn: (1) the SMR/O2R, ATR and POX technologies can be attractive if low-cost oxygen is available; (2) for competing technologies, the H{sub 2}/CO product ratio is typically the most important process parameter; (3) for low methane slip, the SMR/O2R, ATR and POX technologies are favored; (4) for full CO{sub 2} recycle, POX is usually better than ATR; (5) relative to POX, the ATR is a nonlicensed technology that avoids third-party involvement; (6) economics of each technology are dependent on the conditions and requirements for each project and must be evaluated on a case-by-case basis.

  18. 1,2,4-Trimethylbenzene Transformation Reaction Compared with its Transalkylation Reaction with Toluene over USY Zeolite Catalyst

    E-Print Network [OSTI]

    Al-Khattaf, Sulaiman

    1,2,4-Trimethylbenzene Transformation Reaction Compared with its Transalkylation Reaction. This shows that toluene would rather accept a methyl group to transform to xylene than lose a methyl group for transformation of TMB. Cejka et al.3 studied the effect of the structure of large-pore zeolites of beta, Y, L

  19. 2003 NaturePublishing Group GC/MSD after extraction of the 3-ml cultures with toluene, gentle concentration and

    E-Print Network [OSTI]

    Pilastro, Andrea

    © 2003 NaturePublishing Group GC/MSD after extraction of the 3-ml cultures with toluene, gentle. Dehalococcoides sp. strain CBDB1 was cultivated under anaerobic conditions with a gas phase of 20% CO2/80% N2% and 76% with the coats. The cultures were supplied with 5 mM acetate and hydrogen (2.5 ml injected

  20. Mechanism reduction for multicomponent surrogates: a case study using toluene reference fuels

    E-Print Network [OSTI]

    Niemeyer, Kyle E

    2014-01-01T23:59:59.000Z

    Strategies and recommendations for performing skeletal reductions of multicomponent surrogate fuels are presented, through the generation and validation of skeletal mechanisms for a three-component toluene reference fuel. Using the directed relation graph with error propagation and sensitivity analysis method followed by a further unimportant reaction elimination stage, skeletal mechanisms valid over comprehensive and high-temperature ranges of conditions were developed at varying levels of detail. These skeletal mechanisms were generated based on autoignition simulations, and validation using ignition delay predictions showed good agreement with the detailed mechanism in the target range of conditions. When validated using phenomena other than autoignition, such as perfectly stirred reactor and laminar flame propagation, tight error control or more restrictions on the reduction during the sensitivity analysis stage were needed to ensure good agreement. In addition, tight error limits were needed for close pr...

  1. The conductivity and dielectric behavior of solutions of bitumen in toluene

    SciTech Connect (OSTI)

    Chow, R.S.; Tse, D.L.; Takamura, K.

    1988-06-01T23:59:59.000Z

    Previous work on the conductivity and dielectric behavior of residual oil (the fraction remaining in the distillation tower) has suggested that the asphaltene fraction (pentane insolubles) was responsible for the conductivity behavior of solutions of this oil in organic solvents. In this work it is shown that the asphaltenes in heavy crude oils determine the conductivity behavior of solutions of the bulk oil in toluene, while the dielectric behavior is influenced by each component of the oil. The strong dependence of the conductivity on the asphaltene fraction makes it possible to determine the asphaltene content of a heavy crude oil by a conductimetric technique. The conductivity and dielectric behavior of crude oils and fractions of the crude oils, as well as the technique for determining the asphaltene content by conductivity will be presented.

  2. Hydrocarbon reforming catalyst material and configuration of the same

    DOE Patents [OSTI]

    Singh, P.; Shockling, L.A.; George, R.A.; Basel, R.A.

    1996-06-18T23:59:59.000Z

    A hydrocarbon reforming catalyst material comprising a catalyst support impregnated with catalyst is provided for reforming hydrocarbon fuel gases in an electrochemical generator. Elongated electrochemical cells convert the fuel to electrical power in the presence of an oxidant, after which the spent fuel is recirculated and combined with a fresh hydrocarbon feed fuel forming the reformable gas mixture which is fed to a reforming chamber containing a reforming catalyst material, where the reforming catalyst material includes discrete passageways integrally formed along the length of the catalyst support in the direction of reformable gas flow. The spent fuel and/or combusted exhaust gases discharged from the generator chamber transfer heat to the catalyst support, which in turn transfers heat to the reformable gas and to the catalyst, preferably via a number of discrete passageways disposed adjacent one another in the reforming catalyst support. The passageways can be slots extending inwardly from an outer surface of the support body, which slots are partly defined by an exterior confining wall. According to a preferred embodiment, the catalyst support is non-rigid, porous, fibrous alumina, wherein the fibers are substantially unsintered and compressible, and the reforming catalyst support is impregnated, at least in the discrete passageways with Ni and MgO, and has a number of internal slot passageways for reformable gas, the slot passageways being partly closed by a containing outer wall. 5 figs.

  3. Determination of a peak benzene exposure to consumers at typical self-service gasoline stations

    E-Print Network [OSTI]

    Carapezza, Ted

    1977-01-01T23:59:59.000Z

    the public exposure to benzene at the self-serv1ce gas pump seems of paramount importance dur1ng this time of the highly publicized benzene hazard and increased gasoline consumption. These factors produced the amtivating effect for th1s research effort wh... Table ~Pa e I. HUMAN INHALATION EXPOSURE TO GASOLINE VAPOR. I I. SELF-SERVICE GASOLINE STATIONS . III. SAMPLING RESULTS IV. FIELD DATA: STATION I V. FIELD DATA: STATION II VI. FIEI D DATA: STATION III. VI I. FIELD DATA: STATION IV . VIII...

  4. Modeling the natural attenuation of benzene in groundwater impacted by ethanol-blended fuels: Effect of ethanol content

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    Modeling the natural attenuation of benzene in groundwater impacted by ethanol-blended fuels: Effect of ethanol content on the lifespan and maximum length of benzene plumes Diego E. Gomez1 and Pedro 10 March 2009. [1] A numerical model was used to evaluate how the concentration of ethanol

  5. 40 CFR Ch. I (7105 Edition)Pt. 194 1,2,4-Trichlorobenzene (Benzene, 1,2,4-

    E-Print Network [OSTI]

    36 40 CFR Ch. I (7­1­05 Edition)Pt. 194 Toxaphene 1,2,4-Trichlorobenzene (Benzene, 1,2,4- trichloro (Benzene, 1,3,5-trinitro-) Tris(1-aziridinyl)phosphine sulfide (Aziridine, 1,1,1phosphinothioylidyne

  6. Anhydrous aluminum chloride as an alkylation catalyst: identification of mono- and dialkyl-benzenes from the condensation of tertiary butyl alcohol with benzene.

    E-Print Network [OSTI]

    Scoggins, Lacey E

    1959-01-01T23:59:59.000Z

    LIBRARY a a w c"I. I. SI - O~ TI:YAf ANHYDROUS ALUMINUM CHLORIDE AS AN ALKYLATION CATALYST: IDENTIFICATION OF MONO- AND DIALKYIZENZENES FROM THE CONDENSATION QF TERTIARY BUTYL ALCOHOL WITH BENKENE IACEY EUGENE SCOGGINS 4 A Thesis Submitted...: IDENTIFICATION OF MONO- AND DI~NZZNES FROM THE CONDENSATION OF TERTIARY BUTYL ALCOHOL WITH BENZENE A Thesis By LACEY EUGENE SCOGGINS Approved as to style and content hy: Chairman of Committee Head of Chemistry Department 1959 ACKNOWLEDGME1VTS The author...

  7. Kinetics and modeling of mixture effects during complete catalytic oxidation of benzene and methyl tert-butyl ether

    SciTech Connect (OSTI)

    Dangi, S.; Abraham, M.A. [Univ. of Tulsa, OK (United States). Dept. of Chemical Engineering] [Univ. of Tulsa, OK (United States). Dept. of Chemical Engineering

    1997-06-01T23:59:59.000Z

    The performance of a catalytic incinerator depends on the nature of the compounds being oxidized and cannot be predicted simply by knowing the performance of the incinerator with pure-component model compounds. Considering the importance of mixture effects, an attempt was made to develop a combined model to predict the conversion when benzene and methyl tert-butyl ether (MTBE) are simultaneously oxidized. Complete catalytic oxidation of benzene and MTBE, singly and in mixtures, was investigated over a platinum catalyst. No inhibition effects were seen with benzene, but MTBE conversion was distinctly inhibited by benzene. A Mars-van Krevelen rate model was used to explain the results. Model parameters were obtained from pure-component experiments and then incorporated into a multicomponent model without any adjustment or additional rate parameters. The multicomponent model was able to predict the conversion of benzene and MTBE oxidation in the binary mixture using the pure-component data without adjustable parameters.

  8. (CANCER RESEARCH 53. I02.VI026. March I. 1993] Benzene and Its Phenolic Metabolites Produce Oxidative DNA Damage in HL60

    E-Print Network [OSTI]

    California at Berkeley, University of

    (CANCER RESEARCH 53. I02.VI026. March I. 1993] Benzene and Its Phenolic Metabolites Produce ABSTRACT Benzene, an important industrial chemical, is myelotoxic and leuke- mogenic in humans effects. Here we report the induction of oxida- tive DNA damage by benzene and its phenolic metabolites

  9. Theoretical Investigation of Benzene Alkylation with Ethene over H-ZSM-5 Niels Hansen,*, Till Bruggemann, Alexis T. Bell,*, and Frerich J. Keil

    E-Print Network [OSTI]

    Bell, Alexis T.

    Theoretical Investigation of Benzene Alkylation with Ethene over H-ZSM-5 Niels Hansen,*, Till Bru Benzene alkylation with ethene over zeolite H-ZSM-5 has been investigated using density functional theory with the formation of a stable ethoxide intermediate which subsequently reacts with benzene to form the reaction

  10. Water on BN doped benzene: A hard test for exchange-correlation functionals and the impact of exact exchange on weak binding

    E-Print Network [OSTI]

    Alavi, Ali

    Water on BN doped benzene: A hard test for exchange-correlation functionals and the impact of exact on benzene, coronene, and graphene from quantum Monte Carlo calculations J. Chem. Phys. 134, 134701 (2011); 10.1063/1.3569134 The water-benzene interaction: Insight from electronic structure theories J. Chem

  11. Identification of Adsorbed Phenyl (C6H5) Groups on Metal Surfaces: Electron-Induced Dissociation of Benzene on Au(111)

    E-Print Network [OSTI]

    Ellison, Barney

    of Benzene on Au(111) Denis Syomin, Jooho Kim, and Bruce E. Koel* Department of Chemistry, Uni thermal and electron-induced chemistry of benzene (C6H6) adsorbed on a Au(111) surface. Thermal desorption of benzene occurs in three desorption peaks: monolayer at 239 K, bilayer at 155 K, and multilayer films

  12. Modeling the -lectrons of Benzene as Particles on a Ring Calculate the wavelength of the photon required for the first allowed (HOMO-LUMO) electronic

    E-Print Network [OSTI]

    Rioux, Frank

    Modeling the -lectrons of Benzene as Particles on a Ring Calculate the wavelength of the photon required for the first allowed (HOMO-LUMO) electronic transition involving the -electrons of benzene. Energy Level Diagram for Benzene's Electrons _______ _______4 h 2 2 m C 2 n = +/- 2 LUMO h 2 2 m C 2

  13. Charge transfer from TiO2 into adsorbed benzene diazonium compounds Tel-Aviv University, School of Electrical Engineering, Ramat-Aviv 69978, Israel

    E-Print Network [OSTI]

    Shapira, Yoram

    Charge transfer from TiO2 into adsorbed benzene diazonium compounds A. Merson Tel-Aviv University benzene diazonium compounds has been investigated using cyclic voltammetry, x-ray photoelectron that the potential of maximum electron transfer depends strongly on the dipole moment of the benzene compound. Two

  14. Spatial variation in ambient benzene concentrations over a city park1 Samantha Fridh, MSPH, and Amy L. Stuart, MS, PhD2

    E-Print Network [OSTI]

    Stuart, Amy L.

    1 Spatial variation in ambient benzene concentrations over a city park1 Samantha Fridh of South Florida3 4 Abstract5 Passive diffusive samplers were used to collect ambient benzene, passive sampling18 19 Introduction20 Benzene is a known human carcinogen (e.g. it is classified

  15. Supplement for "AMS and LC/MS analyses of SOA from the photooxidation of benzene and 1,3,5-trimethylbenzene in

    E-Print Network [OSTI]

    Meskhidze, Nicholas

    1 Supplement for "AMS and LC/MS analyses of SOA from the photooxidation of benzene and 1@nies.go.jp) #12;2 Fig. S1: Time profiles (a) benzene concentration and HROrg and HRNO3 particulate product during the photooxidation of benzene (run 3). #12;3 Fig. S2. Yield curves for SOA formed from

  16. Hematotoxicity in Workers Exposed to Low Levels of Benzene Qing Lan1,*, Luoping Zhang2,*, Guilan Li3, Roel Vermeulen1, Rona S. Weinberg4, Mustafa

    E-Print Network [OSTI]

    California at Berkeley, University of

    Hematotoxicity in Workers Exposed to Low Levels of Benzene Qing Lan1,*, Luoping Zhang2,*, Guilan Li for Cancer Research, NCI, NIH, DHHS, Bethesda, MD 20892, USA. Abstract Benzene is known to have toxic effects million (ppm) remains uncertain. In a study of 250 workers exposed to benzene, white blood cell

  17. The Nature of the Intramolecular Charge Transfer Excited State in p-Pyrrolocyanobenzene (PBN) and Other Derivatives of Benzene Substituted by Electron Donor and Acceptor

    E-Print Network [OSTI]

    Haas, Yehuda

    -Pyrrolocyanobenzene (PBN) and Other Derivatives of Benzene Substituted by Electron Donor and Acceptor Groups Shmuel Zilberg analysis of these compounds, in which benzene is substituted by an electron withdrawing group of benzene and is of a covalent nature. Light emission from this state is due to local excitation

  18. Mesomorphic properties and molecular structure. II. Structure of the smectic A phase in the 4-propionyl-4' -n-alkanoyloxy-azo-benzene series

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    -propionyl-4' -n-alkanoyloxy-azo-benzene series G. Albertini (*), E. Fanelli (**), D. Guillon (***), S dilatométrie et par diffraction des rayons X. La comparaison avec les données de la série 4-acetyl-4'-n-alkanoyloxy-azo-benzene-alka- noyloxy-azo-benzene series have been obtained by using dilatometry and X-ray diffraction techniques

  19. Study of the Thermal Diffusion Behavior of Alkane/Benzene Mixtures by Thermal Diffusion Forced Rayleigh Scattering Experiments and Lattice Model Calculations

    E-Print Network [OSTI]

    Luettmer-Strathmann, Jutta

    Study of the Thermal Diffusion Behavior of Alkane/Benzene Mixtures by Thermal Diffusion Forced mixtures of linear alkanes (heptane, nonane, undecane, tridecane, pentadecane, heptadecane) in benzene has and temperatures. The Soret coefficient ST of the alkane was found to be negative for these n-alkane/benzene

  20. Structure of hydrophobic hydration of benzene and hexafluorobenzene from first principles

    SciTech Connect (OSTI)

    Allesch, M; Schwegler, E; Galli, G

    2006-10-23T23:59:59.000Z

    We report on the aqueous hydration of benzene and hexafluorobenzene, as obtained by carrying out extensive (>100 ps) first principles molecular dynamics simulations. Our results show that benzene and hexafluorobenzene do not behave as ordinary hydrophobic solutes, but rather present two distinct regions, one equatorial and the other axial, that exhibit different solvation properties. While in both cases the equatorial regions behave as typical hydrophobic solutes, the solvation properties of the axial regions depend strongly on the nature of the {pi}-water interaction. In particular, {pi}-hydrogen and {pi}-lone pair interactions are found to dominate in benzene and hexafluorobenzene, respectively, which leads to substantially different orientations of water near the two solutes. We present atomic and electronic structure results (in terms of Maximally Localized Wannier Functions) providing a microscopic description of benzene- and hexafluorobenzene-water interfaces, as well as a comparative study of the two solutes. Our results point at the importance of an accurate description of interfacial water in order to characterize hydration properties of apolar molecules, as these are strongly influenced by subtle charge rearrangements and dipole moment redistributions in interfacial regions.

  1. Process Biochemistry 36 (2001) 765772 Benzene degradation in a two-phase partitioning bioreactor by

    E-Print Network [OSTI]

    Daugulis, Andrew J.

    2001-01-01T23:59:59.000Z

    Process Biochemistry 36 (2001) 765­772 Benzene degradation in a two-phase partitioning bioreactor November 2000; accepted 22 November 2000 Abstract An aqueous-organic, two-phase bioreactor system was used into the aqueous phase of the two-phase partitioning bioreactor, which consisted of a 1 l aqueous phase and 500 ml

  2. Physiologically Based Pharmacokinetic (PBPK) Modeling of Benzene in Humans: A Bayesian Approach

    E-Print Network [OSTI]

    that are now often used in risk assessment to better extrapolate from experimental animals to humans and from hPhysiologically Based Pharmacokinetic (PBPK) Modeling of Benzene in Humans: A Bayesian Approach for variability among humans, the mathematical model must be integrated into a statistical framework

  3. Antiferromagnetic Exchange Interaction between Electrons on Degenerate LUMOs in Benzene Dianion

    E-Print Network [OSTI]

    Matsuura, Hiroyasu; Fukuyama, Hidetoshi

    2012-01-01T23:59:59.000Z

    We discuss the ground state of Benzene dianion (Bz$^{2-}$) on the basis of the numerical diagonalization method of an effective model of $\\pi$ orbitals. It is found that the ground state can be the spin singlet state, and the exchange coupling between LUMOs can be antiferromagnetic.

  4. Formation of the diphenyl molecule in the crossed beam reaction of phenyl radicals with benzene

    SciTech Connect (OSTI)

    Zhang Fangtong; Gu Xibin; Kaiser, Ralf I. [Department of Chemistry, University of Hawai'i at Manoa, Honolulu, Hawaii 96822 (United States)

    2008-02-28T23:59:59.000Z

    The chemical dynamics to form the D5-diphenyl molecule, C{sub 6}H{sub 5}C{sub 6}D{sub 5}, via the neutral-neutral reaction of phenyl radicals (C{sub 6}H{sub 5}) with D6-benzene (C{sub 6}D{sub 6}), was investigated in a crossed molecular beams experiment at a collision energy of 185 kJ mol{sup -1}. The laboratory angular distribution and time-of-flight spectra of the C{sub 6}H{sub 5}C{sub 6}D{sub 5} product were recorded at mass to charge m/z of 159. Forward-convolution fitting of our data reveals that the reaction dynamics are governed by an initial addition of the phenyl radical to the {pi} electron density of the D6-benzene molecule yielding a short-lived C{sub 6}H{sub 5}C{sub 6}D{sub 6} collision complex. The latter undergoes atomic deuterium elimination via a tight exit transition state located about 30 kJ mol{sup -1} above the separated reactants; the overall reaction to form D5-diphenyl from phenyl and D6-benzene was found to be weakly exoergic. The explicit identification of the D5-biphenyl molecules suggests that in high temperature combustion flames, a diphenyl molecule can be formed via a single collision event between a phenyl radical and a benzene molecule.

  5. Reactor simulation of benzene ethylation and ethane dehydrogenation catalyzed by ZSM-5: A multiscale approach

    E-Print Network [OSTI]

    Bell, Alexis

    Reactor simulation of benzene ethylation and ethane dehydrogenation catalyzed by ZSM-5 Dehydrogenation a b s t r a c t Rate expressions are vital for analysis, design and operation of chemical reactors used the extended continuum model in the design equation of a fixed bed reactor and simulated

  6. Straddler-based Gender Reform in Saudi Arabia: The Case of Jeddah Chamber of Commerce and Industry

    E-Print Network [OSTI]

    Hamilton, Katherine

    2010-01-01T23:59:59.000Z

    of pioneering feminist reformers in the country and theof the JCCI illustrates how reformers were able to utilize aconservatives and liberal reformers. These competing social

  7. From the Frontlines to the Bottom Line: Medical Marijuana, the War on Drugs, and the Drug Policy Reform Movement

    E-Print Network [OSTI]

    Heddleston, Thomas Reed

    2012-01-01T23:59:59.000Z

    how drug policy reformers used the ballot initiative processand future directions for reformers. Bock’s (2000) work isto analyze how drug policy reformers frame their actions and

  8. Autothermal reforming catalyst having perovskite structure

    DOE Patents [OSTI]

    Krumpel, Michael (Naperville, IL); Liu, Di-Jia (Naperville, IL)

    2009-03-24T23:59:59.000Z

    The invention addressed two critical issues in fuel processing for fuel cell application, i.e. catalyst cost and operating stability. The existing state-of-the-art fuel reforming catalyst uses Rh and platinum supported over refractory oxide which add significant cost to the fuel cell system. Supported metals agglomerate under elevated temperature during reforming and decrease the catalyst activity. The catalyst is a perovskite oxide or a Ruddlesden-Popper type oxide containing rare-earth elements, catalytically active firs row transition metal elements, and stabilizing elements, such that the catalyst is a single phase in high temperature oxidizing conditions and maintains a primarily perovskite or Ruddlesden-Popper structure under high temperature reducing conditions. The catalyst can also contain alkaline earth dopants, which enhance the catalytic activity of the catalyst, but do not compromise the stability of the perovskite structure.

  9. The mathematics education reform: What is it and why should you care?

    E-Print Network [OSTI]

    Wu, Hung-Hsi

    The mathematics education reform: What is it and why should you care? H. Wu Department. Introduction §2. Special features of the reform §3. A little background §4. The manifesto of the reform the current math- ematics education reform movement. As used here, "reform" refers to both the K-12

  10. Autothermal hydrodesulfurizing reforming method and catalyst

    SciTech Connect (OSTI)

    Krumpelt, Michael; Kopasz, John P.; Ahmed, Shabbir; Kao, Richard Li-chih; Randhava, Sarabjit Singh

    2005-11-22T23:59:59.000Z

    A method for reforming a sulfur-containing carbonaceous fuel in which the sulfur-containing carbonaceous fuel is mixed with H.sub.2 O and an oxidant, forming a fuel/H.sub.2 O/oxidant mixture. The fuel H.sub.2 O/oxidant mixture is brought into contact with a catalyst composition comprising a dehydrogenation portion, an oxidation portion and a hydrodesulfurization portion, resulting in formation of a hydrogen-containing gas stream.

  11. Partial oxidation fuel reforming for automotive power systems.

    SciTech Connect (OSTI)

    Ahmed, S.; Chalk, S.; Krumpelt, M.; Kumar, R.; Milliken, J.

    1999-09-07T23:59:59.000Z

    For widespread use of fuel cells to power automobiles in the near future, it is necessary to convert gasoline or other transportation fuels to hydrogen on-board the vehicle. Partial oxidation reforming is particularly suited to this application as it eliminates the need for heat exchange at high temperatures. Such reformers offer rapid start and good dynamic performance. Lowering the temperature of the partial oxidation process, which requires the development of a suitable catalyst, can increase the reforming efficiency. Catalytic partial oxidation (or autothermal) reformers and non-catalytic partial oxidation reformers developed by various organizations are presently undergoing testing and demonstration. This paper summarizes the process chemistries as well as recent test data from several different reformers operating on gasoline, methanol, and other fuels.

  12. Multiple Roles of Component Proteins in Bacterial Multicomponent Monooxygenases: Phenol Hydroxylase and Toluene/o-Xylene Monooxygenase from Pseudomonas sp. OX1

    E-Print Network [OSTI]

    Tinberg, Christine E.

    Phenol hydroxylase (PH) and toluene/o-xylene monooxygenase (ToMO) from Pseudomonas sp. OX1 require three or four protein components to activate dioxygen for the oxidation of aromatic substrates at a carboxylate-bridged ...

  13. Improved System Performance and Reduced Cost of a Fuel Reformer...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    System Performance and Reduced Cost of a Fuel Reformer, LNT, and SCR Aftertreatment System Meeting Emissions Useful Life Requirement Improved System Performance and Reduced Cost of...

  14. Compatibility of selected ceramics with steam-methane reformer environments

    SciTech Connect (OSTI)

    Keiser, J.R.; Howell, M. [Oak Ridge National Lab., TN (United States); Williams, J.J.; Rosenberg, R.A. [Stone and Webster Engineering Corp., Boston, MA (United States)

    1996-04-01T23:59:59.000Z

    Conventional steam reforming of methane to synthesis gas (CO and H{sub 2}) hasa conversion efficiency of about 85%. Replacement of metal tubes in the reformer with ceramic tubes offers the potential for operation at temperatures high enough to increase the efficiency to 98-99%. However, the two candidate ceramic materials being given strongest consideration, sintered alpha Si carbide and Si carbide particulate-strengthened alumina, have been shown to react with components of the reformer environment. Extent of degradation as a function of steam partial pressure and exposure time has been studied, and results suggest limits under which these structural ceramics can be used in advanced steam-methane reformers.

  15. On-Board Ammonia Generation Using Delphi Diesel Fuel Reformer

    Broader source: Energy.gov (indexed) [DOE]

    On-Board Ammonia Generation Using Delphi Diesel Fuel Reformer Mark Hemingway, Dr. Joachim Kupe, Joseph Bonadies, Mike Seino, Dr. John Kirwan, - Delphi Powertrain DEER, August...

  16. Bio-Derived Liquids to Hydrogen Distributed Reforming Working...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Working Group (BILIWG), Hydrogen Separation and Purification Working Group (PURIWG) & Hydrogen Production Technical Team Bio-Derived Liquids to Hydrogen Distributed Reforming...

  17. Agenda for the Derived Liquids to Hydrogen Distributed Reforming...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Derived Liquids to Hydrogen Distributed Reforming Working Group (BILIWG) Hydrogen Production Technical Team Research Review Agenda for the Derived Liquids to Hydrogen Distributed...

  18. Bio-Derived Liquids to Hydrogen Distributed Reforming Working...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Energy Laboratory Investigation of Reaction Networks and Active Sites in Bio-Ethanol Steam Reforming over Cobalt Based Catalysts, Umit Ozkan, Ohio State University Hydrogen...

  19. Distributed Reforming of Renewable Liquids via Water Splitting...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Renewable Liquids via Water Splitting using Oxygen Transport Membrane (OTM) (Presentation) Distributed Reforming of Renewable Liquids via Water Splitting using Oxygen Transport...

  20. Bio-Derived Liquids to Hydrogen Distributed Reforming Targets

    Broader source: Energy.gov [DOE]

    Presentation by Arlene Anderson at the October 24, 2006 Bio-Derived Liquids to Hydrogen Distributed Reforming Working Group Kick-Off Meeting.

  1. actinide reformer concept: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Private Insurance Market Renewable Energy Websites Summary: SUMMARY s national health care reform efforts go forward, it is instructive to review states' experience INTRODUCTION...

  2. advance hatchery reform: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Private Insurance Market Renewable Energy Websites Summary: SUMMARY s national health care reform efforts go forward, it is instructive to review states' experience INTRODUCTION...

  3. agricultural price reforms: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    co-payments as well as to sizable decreases in overall producer revenues and health care expenditures. The reform induced consumers to substitute away from branded drugs for...

  4. autothermal steam reforming: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Private Insurance Market Renewable Energy Websites Summary: SUMMARY s national health care reform efforts go forward, it is instructive to review states' experience INTRODUCTION...

  5. abortion law reform: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    to reform Massachusetts law Materials Science Websites Summary: , and access to health care. The course benefitted from the continued dedication of an exceptional teachingAdvocacy...

  6. Diesel Reformers for On-board Hydrogen Applications

    Broader source: Energy.gov (indexed) [DOE]

    After-treatment Catalyst Clean Exhaust Effective Catalyst Regeneration Emission Reduction Electricity for On-road and Idling Loads SOFC APU Efficiency Boost Reformers for...

  7. On the role of delocalization in benzene: Theoretical and experimental investigation of the effects of strained ring fusion

    SciTech Connect (OSTI)

    Faust, R. [Lawrence Berkeley Lab., CA (United States). Chemical Sciences Div.; [California Univ., Berkeley, CA (United States). Dept. of Chemistry

    1993-04-01T23:59:59.000Z

    When an important compound`s discovery dates back as far as 1825, one would imagine that every facet of its chemical and physical properties has been illuminated in the meantime. Benzene, however, has not ceased to challenge the chemist`s notion of structure and bonding since its first isolation by Michael Faraday. This report is divided into the following six chapters: 1. Aromaticity -- Criteria, manifestations, structural limitations; 2. The role of delocalization in benzene; 3. The thermochemical properties of benzocyclobutadienologs; 4. Ab initio study of benzenes fused to four-membered rings; 5. Non-planar polycyclic aromatic hydrocarbons; and 6. Experimental details and input decks. 210 Refs.

  8. Correlation of the phase equilibrium data for the heptane-toluene-sulfolane and heptane-xylene-sulfolane systems

    SciTech Connect (OSTI)

    Cassell, G.W.; Hassan, M.M.; Hines, A.L. (Univ. of Missouri, Dept. of Chemical Engineering, Columbia, MO (US))

    1989-10-01T23:59:59.000Z

    Liquid-liquid equilibrium data were measured for the heptane-toluene-sulfolane system at 25{sup 0}C and for the heptane-xylene-sulfolane system at 17, 25, and 50{sup 0}C. The NRTL and UNIQUAC equations are used to correlate the experimental data and to predict the phase compositions of the ternary systems. The agreement between the predicted and the experimental results was equally good with both equations.

  9. Moving Toward a Vision of Family Independence: Local Managers' Views of Michigan's Welfare Reforms

    E-Print Network [OSTI]

    Shyy, Wei

    Reforms Kristin S. Seefeldt Jodi Sandfort Sandra K. Danziger February, 1998 This project is supported? .................................................................................39 SECTION IV: MANAGERS' VIEW OF WELFARE REFORM AND IMPLEMENTATION ISSUES......................................................................44 Support for Reform Initiatives

  10. Globalization, Economic Reform, and Structural Price Transmission: SAM Decomposition Techniques with an empirical application to Vietnam

    E-Print Network [OSTI]

    Kammen, Daniel M.

    1 Globalization, Economic Reform, and Structural Price Transmission: SAM Decomposition Techniques those which have been slow to reform systems of administered prices. Such allocation mechanisms now undermine reform and structural adjustments efforts in this important emerging Asian economy. Key words

  11. Reforming the EU: The Future of European Law and Policy IV CONFERENCE PROGRAMME

    E-Print Network [OSTI]

    Birmingham, University of

    Reforming the EU: The Future of European Law and Policy IV CONFERENCE session "Reforming the EU" Chair: Dr Luca Rubini, Deputy Director Institute Rubini Reforming European competition law: should the European Commission have

  12. Negotiating Education Reform: Teacher Evaluations and Incentives in Chile (1990-2010)

    E-Print Network [OSTI]

    Mizala, Alejandra

    Reforms designed to improve the quality of teaching by reforming personnel practices, such as pay for performance arrangements, usually run into opposition from well-organized teacher unions that can either block reform ...

  13. Electricity Sector Reform in Developing Countries: A Survey of Empirical Evidence on Determinants and Performance

    E-Print Network [OSTI]

    Jamasb, Tooraj; Mota, Raffaella L; Newbery, David; Pollitt, Michael G.

    2004-07-09T23:59:59.000Z

    This paper reviews the empirical evidence on electricity reform in developing countries. We find that country institutions and sector governance play an important role in success and failure of reform; reforms appear to have increased operating...

  14. Edinburgh Research Explorer Reforming State Pension provision in `Liberal' Anglo Saxon

    E-Print Network [OSTI]

    Millar, Andrew J.

    Edinburgh Research Explorer Reforming State Pension provision in `Liberal' Anglo Saxon Countries, Vickerstaff, S & Loretto, W 2012, 'Reforming State Pension provision in `Liberal' Anglo Saxon Countries: Re University Press. Lain, D., Vickerstaff, S. & Loretto, W. 2012, "Reforming State Pension provision

  15. Assuring Equity Through Health and Health Care Reform Conference Registration Information (Type or Print)

    E-Print Network [OSTI]

    Brown, Lucy L.

    Assuring Equity Through Health and Health Care Reform Conference Registration Information (Type Care Structural Reform: What's Happening in Albany and Washington? Changing the Social Determinants of Health Reform in the Pharmaceutical Industry Sustaining Community Health Workers Comparative

  16. Aligning modes of organization with technology: Critical transactions in the reform of infrastructures

    E-Print Network [OSTI]

    Boyer, Edmond

    1 Aligning modes of organization with technology: Critical transactions in the reform of their reform. Since infrastructures are characterized by strong technical complementarities, we explore the alignment between organization and technology and should be taken explicitly into account when reforming

  17. Sustaining School Reform: Lessons from Georgia Education Policy and Evaluation Center, College of Education, University of Georgia

    E-Print Network [OSTI]

    Scott, Robert A.

    Sustaining School Reform: Lessons from Georgia Education Policy and Evaluation Center, College addressing lessons learned from two years of evaluation of Comprehensive School Reform (CSR) grant recipients implementing reform initiatives, in general. Background The Comprehensive School Reform (CSR) Program began

  18. Mechanism reduction for multicomponent surrogates: A case study using toluene reference fuels

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Niemeyer, Kyle E.; Sung, Chih-Jen

    2014-11-01T23:59:59.000Z

    Strategies and recommendations for performing skeletal reductions of multicomponent surrogate fuels are presented, through the generation and validation of skeletal mechanisms for a three-component toluene reference fuel. Using the directed relation graph with error propagation and sensitivity analysis method followed by a further unimportant reaction elimination stage, skeletal mechanisms valid over comprehensive and high-temperature ranges of conditions were developed at varying levels of detail. These skeletal mechanisms were generated based on autoignition simulations, and validation using ignition delay predictions showed good agreement with the detailed mechanism in the target range of conditions. When validated using phenomena other than autoignition, such as perfectly stirred reactor and laminar flame propagation, tight error control or more restrictions on the reduction during the sensitivity analysis stage were needed to ensure good agreement. In addition, tight error limits were needed for close prediction of ignition delay when varying the mixture composition away from that used for the reduction. In homogeneous compression-ignition engine simulations, the skeletal mechanisms closely matched the point of ignition and accurately predicted species profiles for lean to stoichiometric conditions. Furthermore, the efficacy of generating a multicomponent skeletal mechanism was compared to combining skeletal mechanisms produced separately for neat fuel components; using the same error limits, the latter resulted in a larger skeletal mechanism size that also lacked important cross reactions between fuel components. Based on the present results, general guidelines for reducing detailed mechanisms for multicomponent fuels are discussed.

  19. Mechanism reduction for multicomponent surrogates: A case study using toluene reference fuels

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Niemeyer, Kyle E.; Sung, Chih-Jen

    2014-11-01T23:59:59.000Z

    Strategies and recommendations for performing skeletal reductions of multicomponent surrogate fuels are presented, through the generation and validation of skeletal mechanisms for a three-component toluene reference fuel. Using the directed relation graph with error propagation and sensitivity analysis method followed by a further unimportant reaction elimination stage, skeletal mechanisms valid over comprehensive and high-temperature ranges of conditions were developed at varying levels of detail. These skeletal mechanisms were generated based on autoignition simulations, and validation using ignition delay predictions showed good agreement with the detailed mechanism in the target range of conditions. When validated using phenomena other than autoignition, suchmore »as perfectly stirred reactor and laminar flame propagation, tight error control or more restrictions on the reduction during the sensitivity analysis stage were needed to ensure good agreement. In addition, tight error limits were needed for close prediction of ignition delay when varying the mixture composition away from that used for the reduction. In homogeneous compression-ignition engine simulations, the skeletal mechanisms closely matched the point of ignition and accurately predicted species profiles for lean to stoichiometric conditions. Furthermore, the efficacy of generating a multicomponent skeletal mechanism was compared to combining skeletal mechanisms produced separately for neat fuel components; using the same error limits, the latter resulted in a larger skeletal mechanism size that also lacked important cross reactions between fuel components. Based on the present results, general guidelines for reducing detailed mechanisms for multicomponent fuels are discussed.« less

  20. Modeling Studies on the Transport of Benzene and H2S in CO2-Water Systems

    SciTech Connect (OSTI)

    Zheng, L.; Spycher, N.; Xu, T.; Apps, J.; Kharaka, Y.; Birkholzer, J.T.

    2010-11-05T23:59:59.000Z

    In this study, reactive transport simulations were used to assess the mobilization and transport of organics with supercritical CO{sub 2} (SCC), and the co-injection and transport of H{sub 2}S with SCC. These processes were evaluated at conditions of typical storage reservoirs, and for cases of hypothetical leakage from a reservoir to an overlying shallower fresh water aquifer. Modeling capabilities were developed to allow the simulation of multiphase flow and transport of H{sub 2}O, CO{sub 2}, H{sub 2}S, as well as specific organic compounds (benzene), coupled with multicomponent geochemical reaction and transport. This included the development of a new simulator, TMVOC-REACT, starting from existing modules of the TOUGH2 family of codes. This work also included an extensive literature review, calculation, and testing of phase-partitioning properties for mixtures of the phases considered. The reactive transport simulations presented in this report are primarily intended to illustrate the capabilities of the new simulator. They are also intended to help evaluate and understand various processes at play, in a more qualitative than quantitative manner, and only for hypothetical scenarios. Therefore, model results are not intended as realistic assessments of groundwater quality changes for specific locations, and they certainly do not provide an exhaustive evaluation of all possible site conditions, especially given the large variability and uncertainty in hydrogeologic and geochemical parameter input into simulations. The first step in evaluating the potential mobilization and transport of organics was the identification of compounds likely to be present in deep storage formations, and likely to negatively impact freshwater aquifers if mobilized by SCC. On the basis of a literature review related to the occurrence of these organic compounds, their solubility in water and SCC, and their toxicity (as reflected by their maximum contaminant levels MCL), benzene was selected as a key compound for inclusion into numerical simulations. Note that considering additional organic compounds and/or mixtures of such compounds in the simulations was beyond the scope of this study, because of the effort required to research, calculate, and validate the phase-partitioning data necessary for simulations. The injection of CO{sub 2} into a deep saline aquifer was simulated, followed by modeling the leaching of benzene by SCC and transport of benzene to an overlying aquifer along a hypothetical leakage pathway. One- and two-dimensional models were set up for this purpose. The target storage formation was assumed to initially contain about 10{sup -4} ppm benzene. Model results indicate that: (1) SCC efficiently extracts benzene from the storage formation. (2) Assuming equilibrium, the content of benzene in SCC is roportional to the concentration of benzene in the aqueous and solid phases. (3) Benzene may co-migrate with CO{sub 2} into overlying aquifers if a leakage pathway is present. Because the aqueous solubility of benzene in contact with CO{sub 2} is lower than the aqueous solubility of CO{sub 2}, benzene is actually enriched in the CO{sub 2} phase as the plume advances. (4) For the case studied here, the resulting aqueous benzene concentration in the overlying aquifer is on the same order of magnitude as the initial concentration in the storage formation. This generic modeling study illustrates, in a semi-quantitative manner, the possible mobilization of benzene by SCC. The extent to which the mobilization of this organic compound evolves temporally and spatially depends on a large number of controlling parameters and is largely site specific. Therefore, for more 'truly' predictive work, further sensitivity studies should be conducted, and further modeling should be integrated with site-specific laboratory and/or field experimental data. The co-injection of H{sub 2}S with CO{sub 2} into a deep saline aquifer was also simulated. In addition, the model considered leakage of the supercritical CO{sub 2}+H{sub 2}S mixture along a preferential p

  1. Beyond National Uniformity: Diverging Local Economic Governance Under Japan's Decentralization Reforms

    E-Print Network [OSTI]

    Lee, Jung Hwan

    2010-01-01T23:59:59.000Z

    Public Demand for Deregulation, Decentralization, and De-in market reform for deregulation that makes large privatein market reform for deregulation that makes large private

  2. China's post-reform policy implementation gaps and governmental vs. non-governmental fire alarm solutions

    E-Print Network [OSTI]

    Hart, Melanie M.

    2010-01-01T23:59:59.000Z

    and Reform Committee EIA Environmental Impact Assessmentand Reforms,” Singapore East Asian Institute (EIA),EIA Background Brief No. 418, December 11, 2008, available

  3. Investigation of Bio-Ethanol Steam Reforming over Cobalt-based...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Bio-Ethanol Steam Reforming over Cobalt-based Catalysts (Presentation) Investigation of Bio-Ethanol Steam Reforming over Cobalt-based Catalysts (Presentation) Presented at the 2007...

  4. Interaction energies of monosubstituted benzene dimers via nonlocal density functional theory

    E-Print Network [OSTI]

    T. Thonhauser; Aaron Puzder; David C. Langreth

    2005-09-15T23:59:59.000Z

    We present density-functional calculations for the interaction energy of monosubstituted benzene dimers. Our approach utilizes a recently developed fully nonlocal correlation energy functional, which has been applied to the pure benzene dimer and several other systems with promising results. The interaction energy as a function of monomer distance was calculated for four different substituents in a sandwich and two T-shaped configurations. In addition, we considered two methods for dealing with exchange, namely using the revPBE generalized gradient functional as well as full Hartree-Fock. Our results are compared with other methods, such as Moller-Plesset and coupled-cluster calculations, thereby establishing the usefulness of our approach. Since our density-functional based method is considerably faster than other standard methods, it provides a computational inexpensive alternative, which is of particular interest for larger systems where standard calculations are too expensive or infeasible.

  5. Correlating benzene, total hydrocarbon and carbon monoxide emissions from wood-fired boilers

    SciTech Connect (OSTI)

    Hubbard, A.J.; Grande, D.E.; Berens, J.R. [Wisconsin Dept. of Natural Resources, Madison, WI (United States); Piotrowski, J. [Tenneco Packaging, Inc., Tomahawk, WI (United States)

    1997-12-31T23:59:59.000Z

    Hazardous air pollutants, including benzene, are generated by the incomplete combustion of fuels. Organic compound emissions, which are generally products of incomplete combustion, are reduced by promoting high quality combustion, for example by controlling furnace exit temperatures and establishing minimum residence times. Monitoring carbon monoxide (CO) emissions is important since the amount of carbon monoxide emitted represents the quality of combustion which in turn represents the amount of hazardous air pollutants being generated. Total hydrocarbon (THC) emissions are also related to the quality of combustion. Recently the Wisconsin Department of Natural Resources (DNR) measured the benzene and total hydrocarbon emissions from two large industrial wood fired boilers. These boilers are located at Tenneco Packaging, a container board manufacturing facility in northern Wisconsin. Temperature, oxygen and carbon monoxide concentrations were sampled continuously by Tenneco Packaging`s emission monitoring system. The Department`s team used an organic vapor analyzer to continuously measure concentrations of total hydrocarbons (THC). The Department`s team also used a modified USEPA Method 18 sampling train to capture organic vapors for subsequent analysis by gas chromatography. The data show correlations between benzene and carbon monoxide, and between benzene and THC concentrations. The emissions sampling occurred both upstream of the particulate emissions control system as well as at the stack. The CO variations during actual boiler operation appeared to be well correlated with changes in boiler steam load. That is, increases in CO generally accompanied a change, either up or down, in boiler load. Lower concentrations of CO were associated with stable combustion, as indicated by periods of constant or nearly constant boiler load.

  6. Steam reforming of fuel to hydrogen in fuel cell

    DOE Patents [OSTI]

    Young, J.E.; Fraioli, A.V.

    1983-07-13T23:59:59.000Z

    A fuel cell is described capable of utilizing a hydrocarbon such as methane as fuel and having an internal dual catalyst system within the anode zone, the dual catalyst system including an anode catalyst supporting and in heat conducting relationship with a reforming catalyst with heat for the reforming reaction being supplied by the reaction at the anode catalyst.

  7. Steam reforming of fuel to hydrogen in fuel cells

    DOE Patents [OSTI]

    Fraioli, Anthony V. (Hawthorne Woods, IL); Young, John E. (Woodridge, IL)

    1984-01-01T23:59:59.000Z

    A fuel cell capable of utilizing a hydrocarbon such as methane as fuel and having an internal dual catalyst system within the anode zone, the dual catalyst system including an anode catalyst supporting and in heat conducting relationship with a reforming catalyst with heat for the reforming reaction being supplied by the reaction at the anode catalyst.

  8. Advanced Fuel Reformer Development Putting the `Fuel' in Fuel Cells

    E-Print Network [OSTI]

    in North Haven, CT · Two major platform technologies under development ­ RCL® catalytic combustors for gas with Microlith® Catalytic Reactors very high surface area Ultra compact Short contact time Rapid thermal response controller, AGB) Reformate Flow Control Thermal balance é Fuel, Air, Water #12;Reformer Controls · Automated

  9. ISSN 1745-9648 Electricity Sector Reform in Greece

    E-Print Network [OSTI]

    Feigon, Brooke

    ISSN 1745-9648 Electricity Sector Reform in Greece by Ekaterini Iliadou Lawyer - Legal Department of the electricity market reform in Greece which started in 2001 and is still developing slowly. This is related to the persisting dominance of the incumbent company and the specificities of the electricity sector of Greece

  10. Health Care Reform Challenge: Creating a High Performance Healthcare System

    E-Print Network [OSTI]

    Finley Jr., Russell L.

    Health Care Reform Challenge: Creating a High Performance Healthcare System Tom Simmer, MD Chief;The Challenge of Reform: Accountable Care Organizations (ACO) · ACO's are provider organizations health care delivery Organized Systems of Care Population focus for primary care physicians, hospitals

  11. BREAKING WITH OR BUILDING ON THE PAST? REFORMING IRISH PUBLIC

    E-Print Network [OSTI]

    of the application of new public management styles to Ireland. Particular attention is paid to the public serviceBREAKING WITH OR BUILDING ON THE PAST? REFORMING IRISH PUBLIC ADMINISTRATION: 1958-2008 Niamh? REFORMING IRISH PUBLIC ADMINISTRATION: 1958-2008 Niamh Hardiman and Muiris MacCarthaigh Working Papers

  12. Ab initio study of the kinetics of hydrogen abstraction reactions on toluene and tetralin

    SciTech Connect (OSTI)

    Beste, Ariana [ORNL; Britt, Phillip F [ORNL; Buchanan III, A C [ORNL; Harrison, Robert J [ORNL; Hathorn, Bryan C [ORNL

    2008-01-01T23:59:59.000Z

    Hydrogen abstraction reactions play a key role in many thermal and catalytic processes involved in the production of fuels and chemicals. In this paper, the reaction barriers and rate constants for the hydrogen abstraction reactions on toluene and tetralin by the benzyl radical are calculated by ab initio methods. These reactions are representatives of similar reactions occurring in the thermolysis of lignin model compounds containing the phenethyl phenyl ether (PPE) structural moiety. Thermolysis of PPE occurs by a free radical chain mechanism in which the product selectivity arises from competitive hydrogen abstraction at the benzylic and nonbenzylic methylen sites by chain carrying benzyl and phenoxyl radicals. The title reactions serve to calibrate the theoretical methods to be used in the study of PPE through comparison of the rate constants and the reaction enthalpies with reliable experimental values. In this study, we used two different hybrid density functionals (BHandHLYP, B3LYP) and second-order perturbation theory to obtain equilibrium and transition state geometries. Multiple transition states were found for both reactions. BHandHLYP underestimates and second-order perturbation theory overestimates the reaction barriers; B3LYP energy barriers agree well with experiment. Absolute and relative rate constants were calculated using transition state theory. We found that the relative rate constant using the B3LYP functional agrees within a factor of 2.0 with experiment at the experimental temperature of 333 K, indicating that the B3LYP functional will be successful in predicting relative rate constants for hydrogen abstraction reactions participating in the pyrolysis of PPE.

  13. Determination of phase equilibria for the binary systems polystyrene/cyclohexane and polystyrene/toluene and for the ternary system polystyrene/cyclohexane/toluene at 423 K, 433 K, and 448 K using perturbation gas chromatography / cby Kathryn Rion Hanneman

    E-Print Network [OSTI]

    Hanneman, Kathryn Rion

    1984-01-01T23:59:59.000Z

    -of-state model, and the lattice-fluid model of Sanchez and Lacombe. The vapor-liquid equilibrium data were found to be insensitive to the cyclohexane/toluene fit parameter in the Flory's equation-of-state model, the Flory-Huggins (volume and segment fraction...) model and the Sanchez and Lacombe model. However, the vapor-liquid equilibrium data's sensitivity to the CH/T parameter in Bonner and Brockmeier's simplified Flory's model was not determined. At the temperatures and solvent partial pressures studied...

  14. Economic Reforms and Gender-based Wage Inequality in the Presence of Factor Market Distortions

    E-Print Network [OSTI]

    Bandyopadhyay, Antar

    1 Economic Reforms and Gender-based Wage Inequality in the Presence of Factor Market Distortions-based wage inequality. The analysis finds that credit market reform and tariff reform produce favourable reforms, general equilibrium. JEL classifications: D50, J16, F21. The authors are thankful to Prof

  15. Page 1 of 16 The reform of passenger rail in Switzerland: more performance

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Page 1 of 16 The reform of passenger rail in Switzerland: more performance without competition: christian.desmaris@sciencespo-lyon.fr Keywords: Swiss railway reform Regulation Regionalization Railway of ongoing institutional reform. This article strives to shed light on passenger traffic reform, and more

  16. Bio-Derived Liquids to Hydrogen Distributed Reforming Working Group & Hydrogen Production Technical Team Research Review

    E-Print Network [OSTI]

    -Oil Reforming, NREL, Darlene Steward o High Pressure Steam Ethanol Reforming, ANL, Romesh Kumar 12:00 - 12:30 Lunch 12:30 Research Review Continued o Investigation of Bio-ethanol Steam Reforming over Cobalt basedBio-Derived Liquids to Hydrogen Distributed Reforming Working Group (BILIWG) & Hydrogen Production

  17. MOVIE "CHICAGO CITY COUNCIL: READY FOR REFORM?" (27 minutes/color)

    E-Print Network [OSTI]

    Illinois at Chicago, University of

    , transportation, and health care. 8. Investigate how many of the reform proposals were in place twenty years afterMOVIE ­ "CHICAGO CITY COUNCIL: READY FOR REFORM?" (27 minutes/color) SYNOPSIS Following the death of Mayor Harold Washington, residents and reformers of Chicago still hoped for continued reform in Chicago

  18. Economic and Political Reform in China and the Former Soviet Union

    E-Print Network [OSTI]

    Bernstein, Thomas

    2009-01-01T23:59:59.000Z

    potential for mobilizing popular pressure on the recalcitrant bureaucracy. Political reform was put on the CCs

  19. Wellcome Trust CONSULTATION RESPONSE Wellcome Trust response to the Department for Education's reformed GCSE subject content

    E-Print Network [OSTI]

    Rambaut, Andrew

    's reformed GCSE subject content consultation - August 2013 Department for Education: Reformed GCSE subject's reformed GCSE subject content consultation. The proposed changes to science qualifications promote reform and have enclosed a copy for information. 1 ` Direct assessment' is based on the direct assessment

  20. Benzene under High Pressure: a Story of Molecular Crystals Transforming to Saturated Networks, with a Possible Intermediate Metallic Phase

    SciTech Connect (OSTI)

    Wen, Xiao-Dong [Cornell Univ., Ithaca, NY (United States). Lab. of Atomic and Solid State Physics (LASSP) and Cornell Center for Materials Research (CCMR); Hoffmann, Roald [Cornell Univ., Ithaca, NY (United States). Lab. of Atomic and Solid State Physics (LASSP) and Cornell Center for Materials Research (CCMR); Ashcroft, N. W. [Cornell Univ., Ithaca, NY (United States). Lab. of Atomic and Solid State Physics (LASSP) and Cornell Center for Materials Research (CCMR)

    2011-06-15T23:59:59.000Z

    In a theoretical study, benzene is compressed up to 300 GPa. The transformations found between molecular phases generally match the experimental findings in the moderate pressure regime (<20 GPa): phase I (Pbca) is found to be stable up to 4 GPa, while phase II (P43212) is preferred in a narrow pressure range of 4–7 GPa. Phase III (P21/c) is at lowest enthalpy at higher pressures. Above 50 GPa, phase V (P21 at 0 GPa; P21/c at high pressure) comes into play, slightly more stable than phase III in the range of 50–80 GP, but unstable to rearrangement to a saturated, four-coordinate (at C), one-dimensional polymer. Actually, throughout the entire pressure range, crystals of graphane possess lower enthalpy than molecular benzene structures; a simple thermochemical argument is given for why this is so. In several of the benzene phases there nevertheless are substantial barriers to rearranging the molecules to a saturated polymer, especially at low temperatures. Even at room temperature these barriers should allow one to study the effect of pressure on the metastable molecular phases. Molecular phase III (P21/c) is one such; it remains metastable to higher pressures up to ?200 GPa, at which point it too rearranges spontaneously to a saturated, tetracoordinate CH polymer. At 300 K the isomerization transition occurs at a lower pressure. Nevertheless, there may be a narrow region of pressure, between P = 180 and 200 GPa, where one could find a metallic, molecular benzene state. We explore several lower dimensional models for such a metallic benzene. We also probe the possible first steps in a localized, nucleated benzene polymerization by studying the dimerization of benzene molecules. Several new (C6H6)2 dimers are predicted.

  1. Adsorption of Benzene on a Mo(112)-c(2 2)-[SiO4] Surface M. S. Chen, A. K. Santra, and D. W. Goodman*

    E-Print Network [OSTI]

    Goodman, Wayne

    Adsorption of Benzene on a Mo(112)-c(2 × 2)-[SiO4] Surface M. S. Chen, A. K. Santra, and D. W-3012 ReceiVed: May 21, 2004; In Final Form: August 13, 2004 The orientation and growth of benzene). Benzene on the c(2 × 2)-[SiO4] surface is bound with its molecular plane parallel to the surface plane

  2. Evaluation of Partial Oxidation Reformer Emissions

    SciTech Connect (OSTI)

    Unnasch, Stefan; Fable, Scott; Waterland, Larry

    2006-01-06T23:59:59.000Z

    In this study, a gasoline fuel processor and an ethanol fuel processor were operated under conditions simulating both startup and normal operation. Emissions were measured before and after the AGB in order to quantify the effectiveness of the burner catalyst in controlling emissions. The emissions sampling system includes CEM for O2, CO2, CO, NOx, and THC. Also, integrated gas samples are collected in evacuated canisters for hydrocarbon speciation analysis via GC. This analysis yields the concentrations of the hydrocarbon species required for the California NMOG calculation. The PM concentration in the anode burner exhaust was measured through the placement of a filter in the exhaust stream. The emissions from vehicles with fully developed on board reformer systems were estimated.

  3. Thermally efficient melting and fuel reforming for glass making

    DOE Patents [OSTI]

    Chen, M.S.; Painter, C.F.; Pastore, S.P.; Roth, G.S.; Winchester, D.C.

    1991-10-15T23:59:59.000Z

    An integrated process is described for utilizing waste heat from a glass making furnace. The hot off-gas from the furnace is initially partially cooled, then fed to a reformer. In the reformer, the partially cooled off-gas is further cooled against a hydrocarbon which is thus reformed into a synthesis gas, which is then fed into the glass making furnace as a fuel. The further cooled off-gas is then recycled back to absorb the heat from the hot off-gas to perform the initial cooling. 2 figures.

  4. Thermally efficient melting and fuel reforming for glass making

    DOE Patents [OSTI]

    Chen, Michael S. (Zionsville, PA); Painter, Corning F. (Allentown, PA); Pastore, Steven P. (Allentown, PA); Roth, Gary S. (Trexlertown, PA); Winchester, David C. (Allentown, PA)

    1991-01-01T23:59:59.000Z

    An integrated process for utilizing waste heat from a glass making furnace. The hot off-gas from the furnace is initially partially cooled, then fed to a reformer. In the reformer, the partially cooled off-gas is further cooled against a hydrocarbon which is thus reformed into a synthesis gas, which is then fed into the glass making furnace as a fuel. The further cooled off-gas is then recycled back to absorb the heat from the hot off-gas to perform the initial cooling.

  5. DownloadedBy:[CanadianResearchKnowledgeNetwork]At:16:1617June2008 Journal of Toxicology and Environmental Health, Part A, 71: 11001108, 2008

    E-Print Network [OSTI]

    Bortolotti, Gary R.

    exposed to the rodent LOAEL for combined benzene and toluene. This study indicates that American kestrels of Benzene and Toluene on Vitamin A Status and Humoral and Cell-Mediated Immunity in Wild and Captive American Kestrels Toxicity of benzene and toluene in kestrels Mandy L. Olsgard1 , Gary R. Bortolotti3

  6. Multi-fuel reformers for fuel cells used in transportation. Multi-fuel reformers: Phase 1 -- Final report

    SciTech Connect (OSTI)

    Not Available

    1994-05-01T23:59:59.000Z

    DOE has established the goal, through the Fuel Cells in Transportation Program, of fostering the rapid development and commercialization of fuel cells as economic competitors for the internal combustion engine. Central to this goal is a safe feasible means of supplying hydrogen of the required purity to the vehicular fuel cell system. Two basic strategies are being considered: (1) on-board fuel processing whereby alternative fuels such as methanol, ethanol or natural gas stored on the vehicle undergo reformation and subsequent processing to produce hydrogen, and (2) on-board storage of pure hydrogen provided by stationary fuel processing plants. This report analyzes fuel processor technologies, types of fuel and fuel cell options for on-board reformation. As the Phase 1 of a multi-phased program to develop a prototype multi-fuel reformer system for a fuel cell powered vehicle, the objective of this program was to evaluate the feasibility of a multi-fuel reformer concept and to select a reforming technology for further development in the Phase 2 program, with the ultimate goal of integration with a DOE-designated fuel cell and vehicle configuration. The basic reformer processes examined in this study included catalytic steam reforming (SR), non-catalytic partial oxidation (POX) and catalytic partial oxidation (also known as Autothermal Reforming, or ATR). Fuels under consideration in this study included methanol, ethanol, and natural gas. A systematic evaluation of reforming technologies, fuels, and transportation fuel cell applications was conducted for the purpose of selecting a suitable multi-fuel processor for further development and demonstration in a transportation application.

  7. The benzene metabolite trans,trans-muconaldehyde blocks gap junction intercellular communication by cross-linking connexin43

    SciTech Connect (OSTI)

    Rivedal, Edgar [Department of Cancer Prevention, Institute for Cancer Research, Norwegian Radium Hospital, Montebello, N-0310 Oslo (Norway)], E-mail: edgarr@rr-research.no; Leithe, Edward [Department of Cancer Prevention, Institute for Cancer Research, Norwegian Radium Hospital, Montebello, N-0310 Oslo (Norway)

    2008-11-01T23:59:59.000Z

    Benzene is used at large volumes in many different human activities. Hematotoxicity and cancer-causation as a result of benzene exposure was recognized many years ago, but the mechanisms involved remain unclear. Aberrant regulation of gap junction intercellular communication (GJIC) has been linked to both cancer induction and interference with normal hematopoietic development. We have previously suggested that inhibition of GJIC may play a role in benzene toxicity since benzene metabolites were found to block GJIC, the ring-opened trans,trans-muconaldehyde (MUC) being the most potent metabolite. In the present work we have studied the molecular mechanisms underlying the MUC-induced inhibition of gap junctional communication. We show that MUC induces cross-linking of the gap junction protein connexin43 and that this is likely to be responsible for the induced inhibition of GJIC, as well as the loss of connexin43 observed in Western blots. We also show that glutaraldehyde possesses similar effects as MUC, and we compare the effects to that of formaldehyde. The fact that glutaraldehyde and formaldehyde have been associated with induction of leukemia as well as disturbance of hematopoiesis, strengthens the possible link between the effect of MUC on gap junctions, and the toxic effects of benzene.

  8. Aggregation of hexylammonium propionate in DMSO-benzene and DMSO-D?O solvent systems

    E-Print Network [OSTI]

    Constein, Vernon George

    1974-01-01T23:59:59.000Z

    Fig. 18. Aggregation number plots for HAP in 75@a DpO/25$ DMSO-de ~ 72 3. 0 CHg (CH p ) 4CH pNH 3 2. 00 1. 00 ~ 0. 00 I A U 0 i 3. 00 + CHp (CHg) 4CHpNH3 0 0 2. 00 1. 00 0. 0 1. 00 1. 20 1. 40 1. 60 1. 80 2. 00 2 + log tS] 73 Fig... The relationships between a micelle forming surfactant, hexylammonium propionate (1), and the overlapping mixed solvent systems of benzene/dimethyl- sulfoxide/water have been investigated using 'H nuclear magnetic resonance techniques. The changes in t' he...

  9. Integrated process and apparatus for the primary and secondary catalytic steam reforming of hydrocarbons

    SciTech Connect (OSTI)

    Fuderer, A.

    1987-03-17T23:59:59.000Z

    An apparatus is described for the essentially autothermal, integrated primary and secondary reforming of hydrocarbons comprising: (a) an internally insulated outer reactor shell adapted for the positioning of primary and secondary reforming zones therein; (b) means defining a primary reforming zone within the outer reactor shell and having catalyst-containing reformer tubes positioned therein, the primary reforming zone not requiring an external fuel fired source of heat for the endothermic primary reforming reaction occurring therein; (c) means for introducing a fluid hydrocarbon feed stream and steam to the outer reactor shell for passage through the reformer tubes in the primary reforming zone; (d) means defining a secondary reforming zone within the outer reactor shell comprising a secondary reforming catalyst bed, a catalyst-free reaction space defining a feed end adjacent to the catalyst bed and a discharge end at the opposite side of the secondary reforming catalyst bed to the feed end; and (e) conduit means positioned entirely within the outer reactor shell and extending through the secondary reforming catalyst bed for passing partly reformed product effluent from the primary reforming zone to the catalyst-free reaction space in the secondary reforming zone.

  10. LAND REFORM IN NAMIBIA: AN ANALYSIS OF MEDIA COVERAGE

    E-Print Network [OSTI]

    Engelbrecht, Petrus J.

    2014-08-31T23:59:59.000Z

    in ensuring that land reform is successfully designed and executed. The media informs the public, sets the public and political agenda, holds the government accountable, and serves as a public sphere. This project analyses Namibia's three primary daily...

  11. ECONOMIC REFORM AND COMMUNIST REGIME SURVIVABILTY: PAST, PRESENT, AND FUTURE

    E-Print Network [OSTI]

    Nelson, John

    2006-08-16T23:59:59.000Z

    of their respective Politburos and may be described as not only ‘surviving’ but thriving, experiencing economic stability and enjoying high rates of growth. This study examines the ramifications of economic and political reform policies implemented by four collapsed...

  12. Faculty perceptions of presidential leadership in urban school reform

    E-Print Network [OSTI]

    McClendon, Rodney Prescott

    2009-06-02T23:59:59.000Z

    The study examined urban university faculty members’ perceptions of their presidents’ leadership role in urban school reform. The population for this study consisted of faculty members from five urban research universities. All of the universities...

  13. High Pressure Ethanol Reforming for Distributed Hydrogen Production

    Broader source: Energy.gov [DOE]

    Presentation by S. Ahmed and S.H.D. Lee at the October 24, 2006 Bio-Derived Liquids to Hydrogen Distributed Reforming Working Group Kick-Off Meeting.

  14. The Dynamics of Reform of India’s Federal System

    E-Print Network [OSTI]

    Singh, Nirvikar

    2007-01-01T23:59:59.000Z

    very different set of policies, India has followed China inIssues in Tax Policy and Reform in India, paper presented atWater Disputes in India: Institutions and Policies,” in

  15. Isle of Eigg : land reform, people, and power 

    E-Print Network [OSTI]

    Morgan, Daniel Rhys

    2000-07-20T23:59:59.000Z

    An historiographical analysis of the present political debates regarding land reform in Scotland provides the point of departure for a case study of the Isle of Eigg and the 1997 purchase of the island by the Isle ofEigg ...

  16. Making sense of doctoral training reforms in the social sciences:

    E-Print Network [OSTI]

    Mills, David

    2009-01-01T23:59:59.000Z

    , 125). These reforms continued throughout the 1990s, with a growing attention to supervisor training, institutional research cultures and skills training. The 1993 Government White Paper ‘Realising our Potential’ called for better links with industry...

  17. Electricity Reform in Argentina: Lessons for Developing Countries

    E-Print Network [OSTI]

    Pollitt, Michael G.

    2006-03-14T23:59:59.000Z

    Argentina was one of the first countries in the world to implement a comprehensivereform of its electricity sector in the recent period. Among developing countries onlyChile has had a comparably comprehensive and successful reform. This paper traces...

  18. Power Sector Reform in Developing Countries: A Return to Basics

    SciTech Connect (OSTI)

    Douglas, James B.

    2006-12-15T23:59:59.000Z

    Instead of following the Restructuring Model most often used in the international community since the 1990s, developing countries should adopt an alternative conceptual model called the Integrated Model in order to develop and implement effective electricity reform programs. (author)

  19. First Generation Indian External Sector Reforms in Context

    E-Print Network [OSTI]

    Bhala, Raj

    2013-01-01T23:59:59.000Z

    , foreign direct investment, and the financial sector. Unfortunately, those reforms lost momentum by the early 2000s. Thus, Part III analyses what happened, namely, backsliding on tariff cuts, persistent tariff escalations, and difficulties in the banking...

  20. Petroleum Refinery Catalytic Reforming -- Cutting High Energy Costs

    E-Print Network [OSTI]

    Viar, W. L.

    1979-01-01T23:59:59.000Z

    . It is essential that the operation and maintenance of these furnaces be optimized to minimize production costs. This paper describes the performance testing and evaluation of a set of ten refinery furnaces used to thermally drive several reforming reactors...

  1. Argonne National Laboratory Chemical Engineering Division Catalysts for autothermal reforming

    E-Print Network [OSTI]

    ,110,861) awarded Oct 2000: CRADA w/H2Fuel to commercialize reformer Aug 2001: Began work on perovskite catalysts Feb 2002: CRADA w/Süd-Chemie to optimize catalyst performance Oct 2002: Demonstrated conversion

  2. Catalytic Membrane Reactor for Extraction of Hydrogen from Bioethanol Reforming

    E-Print Network [OSTI]

    Kuncharam, Bhanu Vardhan

    2013-11-26T23:59:59.000Z

    This research explores a novel application of catalytic membrane reactors for high- purity hydrogen extraction from bioethanol reforming. Conventional membrane systems employ hydrogen permselective materials such as palladium, polymer membranes...

  3. Hanford Low Activity Waste (LAW) Fluidized Bed Steam Reformer...

    Office of Environmental Management (EM)

    Low Activity Waste (LAW) Fluidized Bed Steam Reformer (FBSR) Na-Al-Si (NAS) Waste Form Qualification C.M. Jantzen and E.M. Pierce November 18, 2010 2 Participating Organizations 3...

  4. The stability of coerced economic reform : the case of IPR

    E-Print Network [OSTI]

    Wilcox, Trudy

    2005-01-01T23:59:59.000Z

    Theories in international relations posit, and empirical evidence has verified, that unwilling states can be compelled by another state or by an international institution to enact domestic policy reform. However, these ...

  5. act contracting reform: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    19 20 21 22 23 24 25 Next Page Last Page Topic Index 1 Page 1 of 2 Affordable Care Act Health Care Reform Physics Websites Summary: Page 1 of 2 Affordable Care Act Health Care...

  6. autothermal reformer catalyst: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    The paper also argues that small developing countries Roger G. Noll 2000-01-01 23 Hydrogen Production from Carbonaceous Solid Wastes by Steam Reforming CiteSeer Summary:...

  7. Distributed Reforming of Renewable Liquids via Water Splitting using

    E-Print Network [OSTI]

    circuitry/power supply Non-galvanic Single material (no electrodes) Ethanol/NG Steam O2- 1/2 O2 + 2e- 1/2 O.C2H5OH + 1/2 O2 2CO + 3H2 Predominant products of ethanol reforming: H2, CO, CO2, CH4, H2O #12Distributed Reforming of Renewable Liquids via Water Splitting using Oxygen Transport Membrane (OTM

  8. POINT DE VUE SUR LES REFORMES EN COURS DANS LE SYST`EME EDUCATIF 61 Point de vue sur les reformes en

    E-Print Network [OSTI]

    Demailly, Jean-Pierre

    POINT DE VUE SUR LES R´EFORMES EN COURS DANS LE SYST`EME ´EDUCATIF 61 Point de vue sur les r´eformes'^etre confront´e `a la r´eflexion sur les r´eformes, que ce soit `a l'Acad´emie des Sciences, `a l'Universit´e ou contenus de programmes reculent de r´eforme en r´eforme; jamais me semble-t-il les coll`egues ne s

  9. Catalytic autothermal reforming of hydrocarbon fuels for fuel cells.

    SciTech Connect (OSTI)

    Krumpelt, M.; Krause, T.; Kopasz, J.; Carter, D.; Ahmed, S.

    2002-01-11T23:59:59.000Z

    Fuel cell development has seen remarkable progress in the past decade because of an increasing need to improve energy efficiency as well as to address concerns about the environmental consequences of using fossil fuel for producing electricity and for propulsion of vehicles [1]. The lack of an infrastructure for producing and distributing H{sub 2} has led to a research effort to develop on-board fuel processing technology for reforming hydrocarbon fuels to generate H{sub 2} [2]. The primary focus is on reforming gasoline, because a production and distribution infrastructure for gasoline already exists to supply internal combustion engines [3]. Existing reforming technology for the production of H{sub 2} from hydrocarbon feedstocks used in large-scale manufacturing processes, such as ammonia synthesis, is cost prohibitive when scaled down to the size of the fuel processor required for transportation applications (50-80 kWe) nor is it designed to meet the varying power demands and frequent shutoffs and restarts that will be experienced during normal drive cycles. To meet the performance targets required of a fuel processor for transportation applications will require new reforming reactor technology developed to meet the volume, weight, cost, and operational characteristics for transportation applications and the development of new reforming catalysts that exhibit a higher activity and better thermal and mechanical stability than reforming catalysts currently used in the production of H{sub 2} for large-scale manufacturing processes.

  10. JV Task 86 - Identifying the Source of Benzene in Indoor Air Using Different Compound Classes from TO-15 Data

    SciTech Connect (OSTI)

    Steven B. Hawthorne

    2007-04-15T23:59:59.000Z

    Volatile organic compound (VOC) data that had already been collected using EPA method TO-15 at four different sites under regulatory scrutiny (a school, strip mall, apartment complex, and business/residential neighborhood) were evaluated to determine whether the source of indoor air benzene was outdoor air or vapor intrusion from contaminated soil. Both the use of tracer organics characteristic of different sources and principal component statistical analysis demonstrated that the source of indoor air at virtually all indoor sampling locations was a result of outdoor air, and not contaminated soil in and near the indoor air-sampling locations. These results show that proposed remediation activities to remove benzene-contaminated soil are highly unlikely to reduce indoor air benzene concentrations. A manuscript describing these results is presently being prepared for submission to a peer-reviewed journal.

  11. Exposure to methyl tert-butyl ether, benzene, and total hydrocarbons at the Singapore-Malaysia causeway immigration checkpoint

    SciTech Connect (OSTI)

    Tan, C.; Ong, H.Y.; Kok, P.W. [and others

    1996-12-31T23:59:59.000Z

    The primary aim of this study was to determine the extent and levels of exposure to volatile organic compounds (VOCs) from automobile emissions in a group of immigration officers at a busy cross-border checkpoint. A majority (80%) of the workers monitored were exposed to benzene at levels between 0.01 and 0.5 ppm, with only 1.2% exceeding the current Occupational Safety and Health Administration occupational exposure limit of 1 ppm. The geometric mean (GM) concentrations of 8-hr time-weighted average exposure were 0.03 ppm, 0.9 ppm, and 2.46 ppm for methyl-tert-butyl ether (MTBE), benzene, and total hydrocarbons (THC), respectively. The highest time-weighted average concentrations measured were 1.05 ppm for MTBE, 2.01 ppm for benzene, and 34 ppm for THC. It was found that motorbikes emitted a more significant amount of pollutants compared with motor cars. On average, officers at the motorcycle booths were exposed to four to five times higher levels of VOCs (GMs of 0.07 ppm, 0.23 ppm, and 4.7 ppm for MTBE, benzene, and THC) than their counterparts at the motor car booths (GMs of 0.01 ppm, 0.05 ppm, and 1.5 ppm). The airborne concentrations of all three pollutants correlated with the flow of vehicle traffic. Close correlations were also noted for the concentrations in ambient air for the three pollutants measured. Benzene and MTBE had a correlation coefficient of 0.97. The overall findings showed that the concentrations of various VOCs were closely related to the traffic density, suggesting that they were from a common source, such as exhaust emissions from the vehicles. The results also indicated that although benzene, MTBE, and THC are known to be volatile, a significant amount could still be detected in the ambient environment, thus contributing to our exposure to these compounds. 4 refs., 6 figs.

  12. Evolution of soot size distribution in premixed ethylene/air and ethylene/benzene/air flames: Experimental and modeling study

    SciTech Connect (OSTI)

    Echavarria, Carlos A.; Sarofim, Adel F.; Lighty, JoAnn S. [Department of Chemical Engineering, University of Utah, Salt Lake City, UT (United States); D'Anna, Andrea [Dipartimento di Ingegneria Chimica, Universita ''Federico II'' di Napoli, Naples (Italy)

    2011-01-15T23:59:59.000Z

    The effect of benzene concentration in the initial fuel on the evolution of soot size distribution in ethylene/air and ethylene/benzene/air flat flames was characterized by experimental measurements and model predictions of size and number concentration within the flames. Experimentally, a scanning mobility particle sizer was used to allow spatially resolved and online measurements of particle concentration and sizes in the nanometer-size range. The model couples a detailed kinetic scheme with a discrete-sectional approach to follow the transition from gas-phase to nascent particles and their coagulation to larger soot particles. The evolution of soot size distribution (experimental and modeled) in pure ethylene and ethylene flames doped with benzene showed a typical nucleation-sized (since particles do not actually nucleate in the classical sense particle inception is often used in place of nucleation) mode close to the burner surface, and a bimodal behavior at greater height above burner (HAB). However, major features were distinguished between the data sets. The growth of nucleation and agglomeration-sized particles was faster for ethylene/benzene/air flames, evidenced by the earlier presence of bimodality in these flames. The most significant changes in size distribution were attributed to an increase in benzene concentration in the initial fuel. However, these changes were more evident for high temperature flames. In agreement with the experimental data, the model also predicted the decrease of nucleation-sized particles in the postflame region for ethylene flames doped with benzene. This behavior was associated with the decrease of soot precursors after the main oxidation zone of the flames. (author)

  13. Multiple activation pathways of benzene leading to products with varying genotoxic characteristics

    SciTech Connect (OSTI)

    Glatt, H.; Ludewig, G.; Platt, K.L.; Klein, J.; Oesch, F. (Univ. of Mainz (West Germany)); Padykula, R.; Berchtold, G.A. (Massachusetts Institute of Technology, Cambridge (USA))

    1989-07-01T23:59:59.000Z

    Benzene and 13 potential metabolites were investigated for genotoxicity in Salmonella typhimurium and V79 Chinese hamster cells. In the presence of NADPH-fortified hepatic postmitochondrial fraction (S9 mix), benzene reverted his S. typhimurium strains. The effect was strongest in strain TA1535. Among the potential metabolites, only the trans-1,2-dihydrodiol, in the presence of S9 mix, and the diol epoxides, in the presence and absence of S9 mix, proved mutagenic in this strain. The anti-diol epoxide was more potent than the syndiastereomer. Both enantiomers of the anti-diastereomer showed similar activities. S9 mix did not appreciably affect the mutagenicity of the anti-diol epoxide. However, detoxification was observed when purified rat liver dihydrodiol dehydrogenase was used at concentrations comparable to that present in the liver. Elevated frequencies of micronucleated cells were observed after treatment with hydroquinone, 1,2,4-trihydroxybenzene, catechol, phenol, 1,2,3-trihydroxybenzene, and quinone. By far the most prominent effect in the whole study was the potent induction of gene mutations by quinone and hydroquinone. This unique and narrow spectrum of genotoxic activities differs from the broad spectrum observed with the antidiol epoxide, suggesting qualitative differences in their interaction with genetic material.

  14. CH-{\\pi} interaction-induced deep orbital deformation in a benzene-methane weak binding system

    E-Print Network [OSTI]

    Li, Jianfu

    2015-01-01T23:59:59.000Z

    The nonbonding interaction between benzene and methane, called CH-{\\pi} interaction, plays an important role in physical, chemical, and biological fields. CH-{\\pi} interaction can decrease the system total energy and promote the formation of special geometric configurations. This work investigates systemically the orbital distribution and composition of the benzene-methane complex for the first time using ab initio calculation based on different methods and basis sets. Surprisingly, we find strong deformation in HOMO-4 and LUMO+2 induced by CH-{\\pi} interaction, extending the general view that nonbonding interaction does not cause orbital change of molecules.

  15. Phase Behaviour of Carbon Dioxide + Benzene + Water Ternary Mixtures at High Pressures and Temperatures up to 300 MPa and 600 K

    E-Print Network [OSTI]

    1 Phase Behaviour of Carbon Dioxide + Benzene + Water Ternary Mixtures at High Pressures for the phase coexistence of carbon dioxide + benzene + water ternary mixtures. Phase coexistence was observed exceptions are the systematic studies6-9 of ternary mixtures containing carbon dioxide with large alkanes

  16. Adsorption, Desorption, and Dissociation of Benzene on TiO2(110) and Pd/TiO2(110)

    SciTech Connect (OSTI)

    Zhou, Jing [ORNL; Dag, Sefa [ORNL; Senanayake, Sanjaya D [ORNL; Hathorn, Bryan C [ORNL; Kalinin, Sergei V [ORNL; Meunier, Vincent [ORNL; Mullins, David R [ORNL; Overbury, Steven {Steve} H [ORNL; Baddorf, Arthur P [ORNL

    2006-01-01T23:59:59.000Z

    Adsorption and reaction of benzene molecules on clean TiO{sub 2}(110) and on TiO{sub 2}(110) with deposited Pd nanoparticles are investigated using a combination of scanning tunneling microscopy (STM), temperature-programmed desorption, and first-principles calculations. Above {approx}50 K, the one-dimensional motion of benzene between bridging oxygen rows is shown to be too fast for STM imaging. At 40 K benzene molecules form chains on top of titanium rows, with calculations indicating every other benzene is rotated 30{sup o}. Both experimental and theoretical studies find no dissociative reactivity of benzene on the clean TiO{sub 2}(110) surface, due to little hybridization between TiO{sub 2} and benzene electronic states. After deposition of Pd nanoparticles, molecular benzene is observed with STM both on the substrate and adjacent to metallic particles. Upon heating to 800 K, benzene fully breaks down into its atomic constituents in a multistep decomposition process.

  17. Improve syngas production using autothermal reforming

    SciTech Connect (OSTI)

    Christensen, T.S.; Primdahl, I.I. (Haldor Topsoe, Copenhagen (Denmark))

    1994-03-01T23:59:59.000Z

    Synthesis gas or syngas, i.e., mixtures of CO and H[sub 2], is a major route from hydrocarbons to many important bulk chemicals ranging from acetic acid to ammonia. Syngas conversion uses hydrocarbon feedstocks, steam, O[sub 2] and CO[sub 2], either separately or in combinations. Autothermal reforming (ATR) is a low-investment process using a simple reactor design. The process is soot-free due to burner design and fixed-bed catalyst. Developed in the late '50s, ATR's main application was for ammonia and methanol syntheses. In ammonia plants, hydrogen production was maximized by operating at high H[sub 2]O/C ratios ranging from 2.5 to 3.5 mole/mole. In methanol units, CO[sub 2] recycle adjusted the syngas composition. ATR is also used to co-produce CO and H[sub 2] as separate streams at H[sub 2]O/C ratios of 1.4 to 2.0 mole/mole. recent developments and optimizations allow cost-effective operation at very low H[sub 2]O/C feed ratios to produce CO-rich syngas. The paper describes the process, including feedstocks and reactor design, the chemical reactions, development and improvements to the process, test results, soot formation, burner design, burner testing, applications, thermodynamic calculations, industrial application, noncatalytic and catalytic partial oxidation, and future uses.

  18. Characterization of a Peroxodiiron(III) Intermediate in the T201S Variant of Toluene/o-Xylene Monooxygenase Hydroxylase from Pseudomonas sp. OX1

    E-Print Network [OSTI]

    Song, Woon Ju

    We report the observation of a novel intermediate in the reaction of a reduced toluene/o-xylene monooxygenase hydroxylase (ToMOH[subscript red]) T201S variant, in the presence of a regulatory protein (ToMOD), with dioxygen. ...

  19. New Orleans Education Reform: A Guide for Cities or a Warning for Communities? (Grassroots Lessons Learned, 2005-2012)

    E-Print Network [OSTI]

    Buras, Kristen L.; Urban South Grassroots Research Collective, Members

    2013-01-01T23:59:59.000Z

    organization leaders, education reformers and experts, andlikely possessed by well-heeled reformers (NSNO, 2010a). Anyears, the so-called reformers fail to grasp that there is a

  20. Structural Reforms and Agricultural Export Performance: An Empirical Analysis Dwi Susanto, C. Parr Rosson, and Rafael Costa

    E-Print Network [OSTI]

    Structural Reforms and Agricultural Export Performance: An Empirical Analysis By Dwi Susanto, C Reforms and Agricultural Export Performance: An Empirical Analysis Abstract This study empirically investigates the effects of structural reforms on bilateral trade flows of agricultural products. Specifically

  1. Reaction network and kinetics for the catalytic oxidation of toluene over V sub 2 O sub 5

    SciTech Connect (OSTI)

    Zhu, J.; Andersson, L.T. (Univ. of Lund (Sweden))

    1990-11-01T23:59:59.000Z

    The oxidation of three methyl-diphenylmethane isomers and of bibenzyl, benzyl alcohol, and benzaldehyde, which are intermediates in the catalytic oxidation of toluene over V{sub 2}O{sub 5}, has been studied to elucidate the reaction network and relative importance of various reactions. Selectivity dependences reveal that the network is composed mainly of three parallel reaction routes: (1) side-chain oxidation with consecutive reactions, (2) oxidative coupling with both parallel and consecutive reactions, and (3) carbon oxide formation. Coupling products are not negligible, with an initial selectivity of 29% (400{degree}C). Anthraquinone is produced mainly from o-methyl-diphenylmethane conditions and catalyst used. Selectivity dependences suggested product lumping and a simplified network. Kinetic analysis of this reaction network indicates that higher temperatures favor route 2 over route 1. The same initial intermediates for route 1 of side-chain oxidation and for route 2 of oxidative coupling are suggested.

  2. Theoretical Insight into the Interactions of TMA-Benzene and TMA-Pyrrole with B3LYP Density-Functional Theory (DFT) and ab Initio Second Order Mller-Plesset Perturbation

    E-Print Network [OSTI]

    Sussman, Joel L.

    Theoretical Insight into the Interactions of TMA-Benzene and TMA-Pyrrole with B3LYP Density theoretical investigation of the tetramethylammonium(TMA)-benzene and TMA-pyrrole complexes has been performed density in the 5 6 aromatic system of pyrrole is larger than that in the 6 6 system of benzene

  3. Reformers for the production of hydrogen from methanol and alternative fuels for fuel cell powered vehicles

    SciTech Connect (OSTI)

    Kumar, R.; Ahmed, S.; Krumpelt, M.; Myles, K.M.

    1992-08-01T23:59:59.000Z

    The objective of this study was (i) to assess the present state of technology of reformers that convert methanol (or other alternative fuels) to a hydrogen-rich gas mixture for use in a fuel cell, and (ii) to identify the R&D needs for developing reformers for transportation applications. Steam reforming and partial oxidation are the two basic types of fuel reforming processes. The former is endothermic while the latter is exothermic. Reformers are therefore typically designed as heat exchange systems, and the variety of designs used includes shell-and-tube, packed bed, annular, plate, and cyclic bed types. Catalysts used include noble metals and oxides of Cu, Zn, Cr, Al, Ni, and La. For transportation applications a reformer must be compact, lightweight, and rugged. It must also be capable of rapid start-up and good dynamic performance responsive to fluctuating loads. A partial oxidation reformer is likely to be better than a steam reformer based on these considerations, although its fuel conversion efficiency is expected to be lower than that of a steam reformer. A steam reformer better lends itself to thermal integration with the fuel cell system; however, the thermal independence of the reformer from the fuel cell stack is likely to yield much better dynamic performance of the reformer and the fuel cell propulsion power system. For both steam reforming and partial oxidation reforming, research is needed to develop compact, fast start-up, and dynamically responsive reformers. For transportation applications, steam reformers are likely to prove best for fuel cell/battery hybrid power systems, and partial oxidation reformers are likely to be the choice for stand-alone fuel cell power systems.

  4. Reformers for the production of hydrogen from methanol and alternative fuels for fuel cell powered vehicles

    SciTech Connect (OSTI)

    Kumar, R.; Ahmed, S.; Krumpelt, M.; Myles, K.M.

    1992-08-01T23:59:59.000Z

    The objective of this study was (i) to assess the present state of technology of reformers that convert methanol (or other alternative fuels) to a hydrogen-rich gas mixture for use in a fuel cell, and (ii) to identify the R D needs for developing reformers for transportation applications. Steam reforming and partial oxidation are the two basic types of fuel reforming processes. The former is endothermic while the latter is exothermic. Reformers are therefore typically designed as heat exchange systems, and the variety of designs used includes shell-and-tube, packed bed, annular, plate, and cyclic bed types. Catalysts used include noble metals and oxides of Cu, Zn, Cr, Al, Ni, and La. For transportation applications a reformer must be compact, lightweight, and rugged. It must also be capable of rapid start-up and good dynamic performance responsive to fluctuating loads. A partial oxidation reformer is likely to be better than a steam reformer based on these considerations, although its fuel conversion efficiency is expected to be lower than that of a steam reformer. A steam reformer better lends itself to thermal integration with the fuel cell system; however, the thermal independence of the reformer from the fuel cell stack is likely to yield much better dynamic performance of the reformer and the fuel cell propulsion power system. For both steam reforming and partial oxidation reforming, research is needed to develop compact, fast start-up, and dynamically responsive reformers. For transportation applications, steam reformers are likely to prove best for fuel cell/battery hybrid power systems, and partial oxidation reformers are likely to be the choice for stand-alone fuel cell power systems.

  5. FLUIDIZED BED STEAM REFORMER MONOLITH FORMATION

    SciTech Connect (OSTI)

    Jantzen, C

    2006-12-22T23:59:59.000Z

    Fluidized Bed Steam Reforming (FBSR) is being considered as an alternative technology for the immobilization of a wide variety of aqueous high sodium containing radioactive wastes at various DOE facilities in the United States. The addition of clay, charcoal, and a catalyst as co-reactants converts aqueous Low Activity Wastes (LAW) to a granular or ''mineralized'' waste form while converting organic components to CO{sub 2} and steam, and nitrate/nitrite components, if any, to N{sub 2}. The waste form produced is a multiphase mineral assemblage of Na-Al-Si (NAS) feldspathoid minerals with cage-like structures that atomically bond radionuclides like Tc-99 and anions such as SO{sub 4}, I, F, and Cl. The granular product has been shown to be as durable as LAW glass. Shallow land burial requires that the mineralized waste form be able to sustain the weight of soil overburden and potential intrusion by future generations. The strength requirement necessitates binding the granular product into a monolith. FBSR mineral products were formulated into a variety of monoliths including various cements, Ceramicrete, and hydroceramics. All but one of the nine monoliths tested met the <2g/m{sup 2} durability specification for Na and Re (simulant for Tc-99) when tested using the Product Consistency Test (PCT; ASTM C1285). Of the nine monoliths tested the cements produced with 80-87 wt% FBSR product, the Ceramicrete, and the hydroceramic produced with 83.3 wt% FBSR product, met the compressive strength and durability requirements for an LAW waste form.

  6. Comparing the effects of various fuel alcohols on the natural attenuation of Benzene Plumes using a general substrate interaction model

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    and Environmental Engineering, Rice University, MS-317, 6100 Main St., Houston, TX 77005, USA a r t i c l e i n f o a b s t r a c t Article history: Received 30 October 2009 Received in revised form 26 January 2010 generalizations about the level of impact of specific fuel alcohols on benzene plume dynamics. © 2010 Elsevier B

  7. Diffusion and Catalytic Cracking of 1,3,5 Tri-iso-propyl-benzene in FCC Catalysts

    E-Print Network [OSTI]

    Al-Khattaf, Sulaiman

    1 Diffusion and Catalytic Cracking of 1,3,5 Tri-iso- propyl-benzene in FCC Catalysts S.Al-Khattaf1 describes catalytic cracking experiments developed in a novel CREC Riser Simulator using 1,3,5-Tri-iso

  8. Some new progress on the light absorption properties of linear alkyl benzene solvent

    E-Print Network [OSTI]

    Yu, Guang-You; Huang, Ai-Zhong; Yu, Lei; Loh, Chang-Wei; Wang, Wen-Wen; Qian, Zhi-Qiang; Yang, Hai-Bo; Huang, Huang; Xu, Zong-Qiang; Zhu, Xue-Yuan; Xu, Bin; Qi, Ming

    2015-01-01T23:59:59.000Z

    Linear alkyl benzene (LAB) will be used as the solvent of a liquid scintillator mixture for the JUNO antineutrino experiment in the near future. Its light absorption property should therefore be understood prior to its effective use in the experiment. Attenuation length measurements at a light wavelength of 430 nm have been performed on samples of LAB prepared for the purpose of the JUNO experiment. Inorganic impurities in LAB have also been studied for their possibilities of light absorption in our wavelength of interest. In view of a tentative plan by the JUNO collaboration to utilize neutron capture with hydrogen in the detector, we have also presented in this work, a study on the carbon-hydrogen ratio and the relationship thereof with the attenuation length of the samples.

  9. Some new progress on the light absorption properties of linear alkyl benzene solvent

    E-Print Network [OSTI]

    Guang-You Yu; De-Wen Cao; Ai-Zhong Huang; Lei Yu; Chang-Wei Loh; Wen-Wen Wang; Zhi-Qiang Qian; Hai-Bo Yang; Huang Huang; Zong-Qiang Xu; Xue-Yuan Zhu; Bin Xu; Ming Qi

    2015-04-22T23:59:59.000Z

    Linear alkyl benzene (LAB) will be used as the solvent of a liquid scintillator mixture for the JUNO antineutrino experiment in the near future. Its light absorption property should therefore be understood prior to its effective use in the experiment. Attenuation length measurements at a light wavelength of 430 nm have been performed on samples of LAB prepared for the purpose of the JUNO experiment. Inorganic impurities in LAB have also been studied for their possibilities of light absorption in our wavelength of interest. In view of a tentative plan by the JUNO collaboration to utilize neutron capture with hydrogen in the detector, we have also presented in this work, a study on the carbon-hydrogen ratio and the relationship thereof with the attenuation length of the samples.

  10. Thermodynamic Features of Benzene-1,2-Diphosphonic Acid Complexes with Several Metal Ions

    SciTech Connect (OSTI)

    Syouhei Nishihama; Ryan P. Witty; Leigh R Martin; Kenneth L. Nash

    2013-08-01T23:59:59.000Z

    Among his many contributions to the advancement of f-element chemistry and separation science, Professor Gregory R. Choppin’s research group completed numerous investigations featuring the application of distribution techniques to the determination of metal complexation equilibrium quotients. Most of these studies focused on the chemistry of lanthanide and actinide complexes. In keeping with that tradition, this report discusses the complex formation equilibrium constants for complexes of trivalent europium (Eu3+) with benzene-1,2-diphosphonic acid (H4BzDP) determined using solvent extraction distribution experiments in 0.2 M (Na,H)ClO4 media in the temperature range of 5 – 45 degrees C. Protonation constants for HnBzDP4-n and stoichiometry and stability of BzDP4- complexes with Zn2+, Ni2+, and Cu2+ have also been determined using potentiometric titration (at I = 0.1 M) and 31P NMR spectroscopy. Heats of protonation of HnBzDPn-4 species have been determined by titration calorimetry. From the temperature dependence of the complex Eu3+-HnBzDPn-4 equilibrium constant, a composite enthalpy (?H = -15.1 (+/-1.0) kJ mol-1) of complexation has been computed. Comparing these thermodynamic parameters with literature reports on other diphosphonic acids and structurally similar carboxylic acids indicates that exothermic heats of complexation are unique to the Eu-BzDP system. Comparisons with thermodynamic data from the literature indicate that the fixed geometry imposed by the benzene ring enhances complex stability.

  11. Changes in the peripheral blood transcriptome associated with occupational benzene exposure identified by cross-comparison on two microarray platforms

    SciTech Connect (OSTI)

    McHale, Cliona M.; Zhang, Luoping; Lan, Qing; Li, Guilan; Hubbard, Alan E.; Forrest, Matthew S.; Vermeulen, Roel; Chen, Jinsong; Shen, Min; Rappaport, Stephen M.; Yin, Songnian; Smith, Martyn T.; Rothman, Nathaniel

    2009-03-01T23:59:59.000Z

    Benzene is an established cause of leukemia and a possible cause of lymphoma in humans but the molecular pathways underlying this remain largely undetermined. This study sought to determine if the use of two different microarray platforms could identify robust global gene expression and pathway changes associated with occupational benzene exposure in the peripheral blood mononuclear cell (PBMC) gene expression of a population of shoe-factory workers with well-characterized occupational exposures to benzene. Microarray data was analyzed by a robust t-test using a Quantile Transformation (QT) approach. Differential expression of 2692 genes using the Affymetrix platform and 1828 genes using the Illumina platform was found. While the overall concordance in genes identified as significantly associated with benzene exposure between the two platforms was 26% (475 genes), the most significant genes identified by either array were more likely to be ranked as significant by the other platform (Illumina = 64%, Affymetrix = 58%). Expression ratios were similar among the concordant genes (mean difference in expression ratio = 0.04, standard deviation = 0.17). Four genes (CXCL16, ZNF331, JUN and PF4), which we previously identified by microarray and confirmed by real-time PCR, were identified by both platforms in the current study and were among the top 100 genes. Gene Ontology analysis showed over representation of genes involved in apoptosis among the concordant genes while Ingenuity{reg_sign} Pathway Analysis (IPA) identified pathways related to lipid metabolism. Using a two-platform approach allows for robust changes in the PBMC transcriptome of benzene-exposed individuals to be identified.

  12. Heavy-Duty NOx Emissions Control: Reformer-Assisted vs. Plasma...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    NOx Emissions Control: Reformer-Assisted vs. Plasma-Facilitated Lean NOx Catalysis Heavy-Duty NOx Emissions Control: Reformer-Assisted vs. Plasma-Facilitated Lean NOx Catalysis...

  13. Bachelor of Arts Internship Project Company/Organization: The Howard League for Penal Reform

    E-Print Network [OSTI]

    Hickman, Mark

    Bachelor of Arts Internship Project Company/Organization: The Howard League for Penal Reform Application Due Date: N/A Student Initiated Project The Howard League for Penal Reform is an independent

  14. From negotiation to auction : Land-Conveyance Reform in China and its institutional and social impacts

    E-Print Network [OSTI]

    Chen, Zhiyu (Zhiyu Jerry)

    2007-01-01T23:59:59.000Z

    The land market and the associated land-development-control mechanism in China have been experiencing a series of reforms since the 1990s, of which Land Conveyance Reform (LCR) in 2004 is a very recent and an important ...

  15. Title of Dissertation A Study Of Social Interaction And Teamwork In Reformed Physics Laboratories

    E-Print Network [OSTI]

    Maryland at College Park, University of

    ABSTRACT Title of Dissertation A Study Of Social Interaction And Teamwork In Reformed Physics INTERACTION AND TEAMWORK IN REFORMED PHYSICS LABORATORIES By Paul W. Gresser Thesis or Dissertation submitted

  16. Modeling the Effects of Steam-Fuel Reforming Products on Low...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    the Effects of Steam-Fuel Reforming Products on Low Temperature Combustion of n-Heptane Modeling the Effects of Steam-Fuel Reforming Products on Low Temperature Combustion of...

  17. Voluntary Disclosure and Information Asymmetry: Evidence from the 2005 Securities Offering Reform

    E-Print Network [OSTI]

    SHROFF, NEMIT

    In 2005, the Securities and Exchange Commission enacted the Securities Offering Reform (Reform), which relaxes “gun-jumping” restrictions, thereby allowing firms to more freely disclose information before equity offerings. ...

  18. Reforming pharmaceutical regulation: a case study of generic drugs in Brazil 

    E-Print Network [OSTI]

    Fonseca, Elize Massard da

    2011-12-09T23:59:59.000Z

    Brazil is renowned worldwide for its remarkable reforms in pharmaceutical regulation, which have enhanced access to essential medicines while lowering drug costs. As part of these reforms, the Generic Drug Act was introduced in 1999. This policy...

  19. Reforming pharmaceutical regulation: a case study of generic drugs in Brazil 

    E-Print Network [OSTI]

    Fonseca, Elize Massard

    2012-06-29T23:59:59.000Z

    Brazil is renowned worldwide for its remarkable reforms in pharmaceutical regulation, which have enhanced access to essential medicines while lowering drug costs. As part of these reforms, the Generic Drug Act was ...

  20. A Comparative Study between Co and Rh for Steam Reforming of...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    between Co and Rh for Steam Reforming of Ethanol. A Comparative Study between Co and Rh for Steam Reforming of Ethanol. Abstract: Rh and Co-based catalyst performance was compared...

  1. Catalytic roles of Co0 and Co2+ during steam reforming of ethanol...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    roles of Co0 and Co2+ during steam reforming of ethanol on CoMgO catalysts . Catalytic roles of Co0 and Co2+ during steam reforming of ethanol on CoMgO catalysts . Abstract:...

  2. Application of a Diesel Fuel Reformer for Tier 2 Bin 5 Emissions

    Broader source: Energy.gov (indexed) [DOE]

    of a Diesel Fuel Reformer for Tier 2 Bin 5 Emissions APPROACH On-board diesel fuel reformation is being evaluated as an alternative to urea SCR to meet Tier 2 Bin 5 emissions...

  3. The Lessons of Practice: Domestic Policy Reform as a Way to Address...

    Open Energy Info (EERE)

    Practice: Domestic Policy Reform as a Way to Address Climate Change Jump to: navigation, search Tool Summary LAUNCH TOOL Name: The Lessons of Practice: Domestic Policy Reform as a...

  4. Bargaining in the Chinese Leviathan: An Examination on the Steel Industry after China's SOE Reform

    E-Print Network [OSTI]

    Li, Zichao

    2010-06-28T23:59:59.000Z

    This thesis centers on the competitions between enterprises in the steel industry in China after the SOE (state-owned enterprises) reform, which can be viewed as a case for mass economic reforms within Chinese Leviathan. To examine the effect...

  5. High performance internal reforming unit for high temperature fuel cells

    DOE Patents [OSTI]

    Ma, Zhiwen (Sandy Hook, CT); Venkataraman, Ramakrishnan (New Milford, CT); Novacco, Lawrence J. (Brookfield, CT)

    2008-10-07T23:59:59.000Z

    A fuel reformer having an enclosure with first and second opposing surfaces, a sidewall connecting the first and second opposing surfaces and an inlet port and an outlet port in the sidewall. A plate assembly supporting a catalyst and baffles are also disposed in the enclosure. A main baffle extends into the enclosure from a point of the sidewall between the inlet and outlet ports. The main baffle cooperates with the enclosure and the plate assembly to establish a path for the flow of fuel gas through the reformer from the inlet port to the outlet port. At least a first directing baffle extends in the enclosure from one of the sidewall and the main baffle and cooperates with the plate assembly and the enclosure to alter the gas flow path. Desired graded catalyst loading pattern has been defined for optimized thermal management for the internal reforming high temperature fuel cells so as to achieve high cell performance.

  6. Steam methane reforming in molten carbonate salt. Final report

    SciTech Connect (OSTI)

    Erickson, D.C.

    1996-05-01T23:59:59.000Z

    This report documents the work accomplished on the project {open_quotes}Steam Methane Reforming in Molten Carbonate Salt.{close_quotes}. This effort has established the conceptual basis for molten carbonate-based steam reforming of methane. It has not proceeded to prototype verification, because corrosion concerns have led to reluctance on the part of large hydrogen producers to adopt the technology. Therefore the focus was shifted to a less corrosive embodiment of the same technology. After considerable development effort it was discovered that a European company (Catalysts and Chemicals Europe) was developing a similar process ({open_quotes}Regate{close_quotes}). Accordingly the focus was shifted a second time, to develop an improvement which is generic to both types of reforming. That work is still in progress, and shows substantial promise.

  7. Pyrochlore-type catalysts for the reforming of hydrocarbon fuels

    DOE Patents [OSTI]

    Berry, David A. (Morgantown, WV); Shekhawat, Dushyant (Morgantown, WV); Haynes, Daniel (Morgantown, WV); Smith, Mark (Morgantown, WV); Spivey, James J. (Baton Rouge, LA)

    2012-03-13T23:59:59.000Z

    A method of catalytically reforming a reactant gas mixture using a pyrochlore catalyst material comprised of one or more pyrochlores having the composition A.sub.2-w-xA'.sub.wA''.sub.xB.sub.2-y-zB'.sub.yB''.sub.zO.sub.7-.DELTA.. Distribution of catalytically active metals throughout the structure at the B site creates an active and well dispersed metal locked into place in the crystal structure. This greatly reduces the metal sintering that typically occurs on supported catalysts used in reforming reactions, and reduces deactivation by sulfur and carbon. Further, oxygen mobility may also be enhanced by elemental exchange of promoters at sites in the pyrochlore. The pyrochlore catalyst material may be utilized in catalytic reforming reactions for the conversion of hydrocarbon fuels into synthesis gas (H.sub.2+CO) for fuel cells, among other uses.

  8. Reproduced with permission of the copyright owner. Further reproduction prohibited without permission. Poland's Economic Reform

    E-Print Network [OSTI]

    permission. Poland's Economic Reform Foreign Affairs; Summer 1990; 69, 3; ABI/INFORM Global pg. 47 #12

  9. Heat exchanger for fuel cell power plant reformer

    DOE Patents [OSTI]

    Misage, Robert (Manchester, CT); Scheffler, Glenn W. (Tolland, CT); Setzer, Herbert J. (Ellington, CT); Margiott, Paul R. (Manchester, CT); Parenti, Jr., Edmund K. (Manchester, CT)

    1988-01-01T23:59:59.000Z

    A heat exchanger uses the heat from processed fuel gas from a reformer for a fuel cell to superheat steam, to preheat raw fuel prior to entering the reformer and to heat a water-steam coolant mixture from the fuel cells. The processed fuel gas temperature is thus lowered to a level useful in the fuel cell reaction. The four temperature adjustments are accomplished in a single heat exchanger with only three heat transfer cores. The heat exchanger is preheated by circulating coolant and purge steam from the power section during startup of the latter.

  10. O'Leary unveils ambitious contract reform initiative

    SciTech Connect (OSTI)

    Lobsenz, G.

    1994-02-04T23:59:59.000Z

    This article describes DOE's program to reform contract management of its projects. The department will move away from its traditional cost-reimbursement management toward a performance-based management contract that sets clearer goals, incentives, and expectations for contractors. The key objectives are to better tie compensation to actual performance and make it clear that contractors will be responsible for any cost overruns. Another objective of the reform program is to rebid major contracts more often and to encourage more companies to seek DOE business.

  11. Land Reform in the Time of Neoliberalism: A Many-Splendored

    E-Print Network [OSTI]

    Walter, M.Todd

    Land Reform in the Time of Neoliberalism: A Many-Splendored Thing Wendy Wolford Assistant Professor@email.unc.edu Abstract: Over the past 20 years, land reform ­ defined here as the redistribution of land from large differing ideological perspectives have claimed land reform as central to their political, social

  12. Methanol Reformer System Modeling and Control using an Adaptive Neuro-Fuzzy Inference System approach

    E-Print Network [OSTI]

    Andreasen, Søren Juhl

    Methanol Reformer System Modeling and Control using an Adaptive Neuro-Fuzzy Inference System East, Denmark Introduction This work presents a control strategy for a reformed methanol fuel cell system, which uses a reformer to produce hydrogen for a HTPEM fuel cell. Such systems can advantageously

  13. Reforming a large lecture modern physics course for engineering majors using a PER-based design

    E-Print Network [OSTI]

    Colorado at Boulder, University of

    Reforming a large lecture modern physics course for engineering majors using a PER-based design S Department of Physics, University of Colorado, Boulder, CO 80309, USA Abstract. We have reformed a large of reforms in this course using pre/post surveys on both content and beliefs. We have found significant

  14. WORKING PAPER N 2012 25 Collateral effects of a pension reform in France

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    WORKING PAPER N° 2012 ­ 25 Collateral effects of a pension reform in France Hélène Blake Clémentine Garrouste JEL Codes: Keywords: Retirement ; Health ; Pension Reform PARIS-JOURDAN SCIENCES ECONOMIQUES 48-00703706,version2-2Jul2012 #12;Collateral effects of a pension reform in France Hélène Blake and Clémentine

  15. PROCS-VERBAL DE DPOUILLEMENT ELECTIONS A LA COMMISSION DE REFORME DE L'IRD

    E-Print Network [OSTI]

    PROCÈS-VERBAL DE DÉPOUILLEMENT ELECTIONS A LA COMMISSION DE REFORME DE L'IRD SCRUTIN DU 6 MAI 2009 TALAMOND, Catherine BONTE #12;PROCÈS-VERBAL DE DÉPOUILLEMENT ELECTIONS A LA COMMISSION DE REFORME DE L BONTE #12;PROCÈS-VERBAL DE DÉPOUILLEMENT ELECTIONS A LA COMMISSION DE REFORME DE L'IRD SCRUTIN DU 6 MAI

  16. Control of a methanol reformer system using an Adaptive NeuroFuzzy Inference System approach

    E-Print Network [OSTI]

    Andreasen, Søren Juhl

    Control of a methanol reformer system using an Adaptive NeuroFuzzy Inference System approach, Denmark Introduction This work presents a stoichiometry control strategy for a reformed methanol fuel cell system, which uses a reformer to produce hydrogen for an HTPEM fuel cell. One such system is the Serenus

  17. WHAT HAS WELFARE REFORM ACCOMPLISHED? IMPACTS ON WELFARE PARTICIPATION, EMPLOYMENT, INCOME,

    E-Print Network [OSTI]

    Shyy, Wei

    WHAT HAS WELFARE REFORM ACCOMPLISHED? IMPACTS ON WELFARE PARTICIPATION, EMPLOYMENT, INCOME, POVERTY, and RAND for comments. #12;1 Abstract This paper evaluates the effectiveness of recent welfare reforms, investigating the effects of both state-specific waivers in the early 1990s and the 1996 federal reform

  18. Giannini Foundation of Agricultural Economics New Horizons for Rural Reform in China

    E-Print Network [OSTI]

    Kammen, Daniel M.

    11 Giannini Foundation of Agricultural Economics New Horizons for Rural Reform in China: Resources a reform agenda to alleviate rural poverty and improve environmental sustainability in China. It focuses on labor reform, suggesting reductions in the work week and providing incentives aimed at encouraging exit

  19. The New Reform of the Mathematics Curriculum in the Compulsory Education in China Ma Yunpeng1

    E-Print Network [OSTI]

    Spagnolo, Filippo

    275 The New Reform of the Mathematics Curriculum in the Compulsory Education in China Ma Yunpeng1 and development of international mathematics education reform from 1980's. It is found that there are still many and scholars in different fields have been organized to start a new fundamental education curriculum reform

  20. Immigration Reform and Beyond? Conference on Immigration to the US South

    E-Print Network [OSTI]

    Pilyugin, Sergei S.

    Immigration Reform and Beyond? The 5th Conference on Immigration to the US South October 23/or bring in transnational and global perspectives. Now that comprehensive immigration reform is back-term challenges of immigration reform with an emphasis on finding practical and realistic policy alternatives

  1. Embargoed to 0001 BST Wednesday April 24 Research into the UK government's proposed reforms of

    E-Print Network [OSTI]

    Stevenson, Paul

    Embargoed to 0001 BST Wednesday April 24 Research into the UK government's proposed reforms of the funding of care and support published The cost implications of the UK government's recent plans to reform, Principal Research Fellow at LSE's Personal Social Services Research Unit, said: "The government's reforms

  2. Land Reforms in Latin America: Ten Lessons toward a Contemporary Agenda1

    E-Print Network [OSTI]

    Sadoulet, Elisabeth

    1 Land Reforms in Latin America: Ten Lessons toward a Contemporary Agenda1 by Alain de Janvry years of land reforms in Latin America, we arrive at the following ten lessons that give guidelines for future programs of access to land. Lesson 1: Latin American land reforms have generally been "incomplete

  3. Welfare Reform: How Do We Measure Success? Daniel T. Lichter1

    E-Print Network [OSTI]

    Shyy, Wei

    1 Welfare Reform: How Do We Measure Success? Daniel T. Lichter1 and Rukamalie Jayakody2 Forthcoming;2 Welfare Reform: How Do We Measure Success? Abstract This paper evaluates a burgeoning literature on the effects of the 1996 welfare reform bill. Our goal is to shift the debate from the current preoccupation

  4. WORKING PAPER N 2012 25 Collateral effects of a pension reform in France

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    WORKING PAPER N° 2012 ­ 25 Collateral effects of a pension reform in France Hélène Blake Clémentine Garrouste JEL Codes: Keywords: Retirement ; Health ; Pension Reform PARIS-JOURDAN SCIENCES ECONOMIQUES 48-00703706,version1-4Jun2012 #12;Collateral effects of a pension reform in France Hélène Blake and Clémentine

  5. Til efterret kommer videnskabsminis-ter Helge Sander (V) med en reform af

    E-Print Network [OSTI]

    Til efteråret kommer videnskabsminis- ter Helge Sander (V) med en reform af sektorforskningen Sander. Når Folketinget åbner til oktober, lægger han et forslag frem til en lov, der reforme- rer for det vigtige skridt fra laboratoriet til samlebåndet", siger Helge Sander. Den kommende reform af

  6. WELFARE REFORM, SUBSTANCE USE, AND MENTAL HEALTH1 Rukmalie Jayakody2

    E-Print Network [OSTI]

    Shyy, Wei

    1 WELFARE REFORM, SUBSTANCE USE, AND MENTAL HEALTH1 Rukmalie Jayakody2 Pennsylvania State for useful comments that improved our paper. #12;3 ABSTRACT Welfare reform transformed the traditional-sufficiency that are increasingly important in this era of time-limited benefits. KEYWORDS: welfare reform, substance abuse, mental

  7. Control and experimental characterization of ap methanol reformer for a 350W HTPEM FC system

    E-Print Network [OSTI]

    Kolaei, Alireza Rezania

    Control and experimental characterization of ap methanol reformer for a 350W HTPEM FC system Søren@et.aau.dk 33 #12;From prototype to commercial product dk 4 www.serenergy.dk #12;Integrated methanol reformerC Reformer temperature 200-300oC System parameters Weight 13.7 kg Volume 27 L sja@et.aau.dk 5 #12

  8. PHS 650 Summer 2012 Page 1 State-Level Health System and Coverage Reform

    E-Print Network [OSTI]

    Sheridan, Jennifer

    PHS 650 Summer 2012 Page 1 State-Level Health System and Coverage Reform Course Overview in the public and private sectors, and current issues and debates about reform nationally and in Wisconsin health insurance reform; 5. describe three elements of the federal 2010 Patient Protection and Affordable

  9. Tailored Macroporous SiCN and SiC Structures for High-Temperature Fuel Reforming**

    E-Print Network [OSTI]

    Kenis, Paul J. A.

    Tailored Macroporous SiCN and SiC Structures for High-Temperature Fuel Reforming** By In-Kyung Sung such as the reforming of hydrocarbon fuels (e.g., die- sel or JP-8) into hydrogen for use in portable power sources the reaction rate of endothermic reactions (such as the steam reforming of hydrocarbons), at the macroscale

  10. The World Bank's Approach and the Right Approach to Pension Reform

    E-Print Network [OSTI]

    Spence, Harlan Ernest

    1 The World Bank's Approach and the Right Approach to Pension Reform by Laurence J. Kotlikoff's approach to pension reform. The reason is that exclusive or predominant investment in domestic asset and actual variety, the Bank's pension reforms reflect and emanate from a common and deeply flawed set

  11. United States House of Representatives Committee on Oversight and Government Reform

    E-Print Network [OSTI]

    Kammen, Daniel M.

    United States House of Representatives Committee on Oversight and Government Reform Testimony, and the rest of the Committee on Oversight and Government Reform, I am very pleased to have the opportunity responsible way. #12;Daniel M. Kammen ­ House of Representatives Committee on Oversight and Government Reform

  12. PHS 650 Summer 2011 Page 1 State-Level Health System and Coverage Reform 2011

    E-Print Network [OSTI]

    Sheridan, Jennifer

    PHS 650 Summer 2011 Page 1 State-Level Health System and Coverage Reform 2011 Course Overview in the public and private sectors, and current issues and debates about reform nationally and in Wisconsin the relationship between federal law and state health insurance reform; 5. describe three elements of the federal

  13. The effect of reformate gas enrichment on extinction limits and NOX formation

    E-Print Network [OSTI]

    Gülder, Ömer L.

    The effect of reformate gas enrichment on extinction limits and NOX formation in counterflow CH4 Dufferin Street, Toronto, Ont., Canada M3H 5T6 Abstract The reformate gas enriched counterflow lean premixed CH4/air flames were studied by numerical sim- ulation in this paper. The reformate gas was assumed

  14. Novel Catalytic Fuel Reforming Using Micro-Technology with Advanced Separations Technology

    E-Print Network [OSTI]

    Novel Catalytic Fuel Reforming Using Micro-Technology with Advanced Separations Technology Patricia by the combustion of membrane raffinate for the production of clean hydrogen by steam reforming natural gas. Advanced membrane technology is being used to remove CO and CO2 from the reformate. The fuel processor

  15. Welfare Reform Policy From Nixon to Clinton: What Role for Social Science?

    E-Print Network [OSTI]

    Shyy, Wei

    1 Welfare Reform Policy From Nixon to Clinton: What Role for Social Science? Sheldon Danziger on the conference draft. #12;2 Welfare Reform Policy From Nixon to Clinton: What Role for Social Science? Social implications were virtually ignored, however, in the welfare reform debates leading up to President Clinton

  16. Working Towards Reform in Mathematics Education: Parents', Teachers', and Students' Views of "Different"1

    E-Print Network [OSTI]

    Civil, Marta

    Working Towards Reform in Mathematics Education: Parents', Teachers', and Students' Views presented at the ACCLAIM Research Symposium 3, Mathematics Education: Reform and Resistance;2 This essay is a reflection on several aspects related to my encounters with the concept of reform

  17. Structural Reforms and Agricultural Export Performance D. Susanto, C. P. Rosson, and R. Costa

    E-Print Network [OSTI]

    Structural Reforms and Agricultural Export Performance D. Susanto, C. P. Rosson, and R. Costa;INTRODUCTION Structural reforms: policy measures that reduce or remove impediments to the efficient allocation of resources. Structural reforms would imply reduced government interventions, including such as (1) removal

  18. A Proposal to Reform the Kyoto Protocol: the Role of Escape Clauses and Foresight

    E-Print Network [OSTI]

    Karp, Larry S.

    A Proposal to Reform the Kyoto Protocol: the Role of Escape Clauses and Foresight Larry Karp University of California, Berkeley Jinhua Zhao Iowa Sate University February 23, 2007 Abstract A reform be designed. We propose a reform to the Kyoto Proto- col that allows signatories to avoid achieving the target

  19. Volume 8, Issue 1 2010 Article 8 THE POLITICS OF HEALTH CARE REFORM

    E-Print Network [OSTI]

    Gelman, Andrew

    Volume 8, Issue 1 2010 Article 8 The Forum THE POLITICS OF HEALTH CARE REFORM Public Opinion on Health Care Reform Andrew Gelman, Columbia University Daniel Lee, Columbia University Yair Ghitza Opinion on Health Care Reform," The Forum: Vol. 8: Iss. 1, Article 8. DOI: 10

  20. Bureaucratic Reform and E-Government in the United States: An Institutional Perspective

    E-Print Network [OSTI]

    Schweik, Charles M.

    Bureaucratic Reform and E-Government in the United States: An Institutional Perspective Jane E. #12;Bureaucratic Reform and E-Government in the United States: An Institutional Perspective Jane E perspective on e-government can provide important insights into bureaucratic reform, political development