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Sample records for catalyst identification phase

  1. Dispersed catalysts for transforming extra heavy crude oil into transportable upgraded crude: phase identification

    Energy Technology Data Exchange (ETDEWEB)

    Martinez, S.; Canizales, E.; Machin, I. [Gerencia Depttal de Investigacion Estrategica en Refinacion PDVSA Intevep (Venezuela); Segovia, X.; Rivas, A.; Lopez, E.; Pena, J.P.; Rojas, J.D.; Sardella, R. [Gerencia Depttal de Infraestructura y Mejoramiento en Faja Petrolifera PDVSA Intevep (Venezuela)

    2011-07-01

    A new technology to convert extra heavy crude oil into transportable upgraded crude has been developed. A water/oil emulsion composed of steam and catalyst precursors is introduced in the feed which then generates unsupported dispersed catalyst in situ under thermal decomposition. The aim of this paper is to characterize the particles. The study was conducted in a laboratory and on a pilot scale on three different vacuum residues using high resolution transmission electron microscopy and a transmission electron microscope. Results showed that the particles were formed by oxides and inorganic sulphur based in transition metals and their sizes ranged between 5 and 120 nm; in addition, good dispersion was observed. This study demonstrated that the process involved in the generation of dispersed catalyst is extremely complex and showed that further work with heavy crude oils and its residua is required to understand the mechanisms involved.

  2. Phases in the active liquid phase methanol synthesis catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Sawant, A.V.; Lee, S.; Kulik, C.J.

    1988-01-01

    An attempt has been made to identify the phases present in the active catalyst for liquid phase methanol synthesis. X-ray powder diffraction was used to identify the phases. Only metallic Cu was detected, while no Cu/sup +/ species was found to be present. A significant amount of ZnCO/sub 3/ was found to be present in catalysts which had been subjected to high partial pressures of CO/sub 2/. This fact has hitherto not been reported in literature. Some speculations about the effect of ZnCO/sub 3/ on the life of the catalyst are made. 21 refs., 6 figs.

  3. Efficient Nd Promoted Rh Catalysts for Vapor Phase Methanol Carbonylation

    Institute of Scientific and Technical Information of China (English)

    Shu Feng ZHANG; Qing Li QIAN; Ping Lai PAN; Yi CHEN; Guo Qing YUAN

    2005-01-01

    A Nd promoted-Rh catalysts supported on polymer-derived carbon beads for vapor-phase methanol carbonylation was developed. Rh-Nd bimetallic catalysts obviously have higher activity than that of supported Rh catalyst under similar reaction condition. The difference between the activity of above two catalyst systems is clearly caused by the intrinsic properties generated by the introduction of Nd.

  4. Advanced Aqueous Phase Catalyst Development using Combinatorial Methods Project

    Data.gov (United States)

    National Aeronautics and Space Administration — The use of combinatorial methods is proposed to rapidly screen catalyst formulations for the advanced development of aqueous phase oxidation catalysts with greater...

  5. NOVEL SLURRY PHASE DIESEL CATALYSTS FOR COAL-DERIVED SYNGAS

    Energy Technology Data Exchange (ETDEWEB)

    Dr. Dragomir B. Bukur; Dr. Ketil Hanssen; Alec Klinghoffer; Dr. Lech Nowicki; Patricia O' Dowd; Dr. Hien Pham; Jian Xu

    2001-01-07

    This report describes research conducted to support the DOE program in novel slurry phase catalysts for converting coal-derived synthesis gas to diesel fuels. The primary objective of this research program is to develop attrition resistant catalysts that exhibit high activities for conversion of coal-derived syngas.

  6. A New Reaction-controlled Phase-transfer Catalyst System

    Institute of Scientific and Technical Information of China (English)

    Ming Qiang LI; Xi Gao JIAN; Gui Mei WANG; Yan YU

    2004-01-01

    A new reaction-controlled phase-transfer catalyst system was designed and synthesized. In this system, heteropolytungstate [C7H7N(CH3)3]9PW9O34 was used for catalytic epoxidation of cyclohexene with H2O2 as the oxidant. The conversion of H2O2 was 100% and the yield of cyclohexene oxide was 87.1% based on cyclohexene. Infrared spectra showed that both fresh catalyst and the recovered catalyst do have completely same absorption peak, indicating the structure of catalyst is very stability and can be recycled.

  7. Olefin Epoxidation in Aqueous Phase Using Ionic-Liquid Catalysts.

    Science.gov (United States)

    Cokoja, Mirza; Reich, Robert M; Wilhelm, Michael E; Kaposi, Marlene; Schäffer, Johannes; Morris, Danny S; Münchmeyer, Christian J; Anthofer, Michael H; Markovits, Iulius I E; Kühn, Fritz E; Herrmann, Wolfgang A; Jess, Andreas; Love, Jason B

    2016-07-21

    Hydrophobic imidazolium-based ionic liquids (IL) act as catalysts for the epoxidation of unfunctionalized olefins in water using hydrogen peroxide as oxidant. Although the catalysts are insoluble in both the substrate and in water, surprisingly, they are very well soluble in aqueous H2 O2 solution, owing to perrhenate-H2 O2 interactions. Even more remarkably, the presence of the catalyst also boosts the solubility of substrate in water. This effect is crucially dependent on the cation design. Hence, the imidazolium perrhenates enable both the transfer of hydrophobic substrate into the aqueous phase, and serve as actual catalysts, which is unprecedented. At the end of the reaction and in absence of H2 O2 the IL catalyst forms a third phase next to the lipophilic product and water and can easily be recycled.

  8. SLURRY PHASE IRON CATALYSTS FOR INDIRECT COAL LIQUEFACTION

    Energy Technology Data Exchange (ETDEWEB)

    Abhaya K. Datye

    1998-11-19

    This report describes research conducted to support the DOE program in indirect coal liquefaction. Specifically, they have studied the attrition behavior of iron Fischer-Tropsch catalysts, their interaction with the silica binder and the evolution of iron phases in a synthesis gas conversion process. The results provide significant insight into factors that should be considered in the design of catalysts for converting coal based syngas into liquid fuels.

  9. Activity of Catalyst for Liquid Phase Methanol Synthesis

    Institute of Scientific and Technical Information of China (English)

    WANGYuefa; JanezLevec

    2002-01-01

    The effects of reduction procedure, reaction temperature and composition of feed gas on the activity of a CuO-ZnO-Al2O3 catalyst for liquid phase methanol synthesis were studied. An optimized procedure different from conventional ones was developed to obtain higher activity and better stability of the catalyst. Both CO and CO2 in the feed gas were found to be necessary to maintain the activity of catalyst in the synthesis process. Reaction temperature was limited up to 523K, otherwise the catalyst will be deactivated rapidly. Experimental results show that the catalyst deactivation is caused by sintering and fouling, and the effects of CO and CO2 on the catalyst activity are also investigated. The experimental results indicate that the formation of water in the methanol synthesis is negligible when the feed gas contains both CO and CO2. The mechanism for liquid-phase methanol synthesis was discussed and it differed slightly from that for gas-phase synthesis.

  10. CATALYST ACTIVITY MAINTENANCE FOR THE LIQUID PHASE SYNTHESIS GAS-TO-DIMETHYL ETHER PROCESS PART II: DEVELOPMENT OF ALUMINUM PHOSPHATE AS THE DEHYDRATION CATALYST FOR THE SINGLE-STEP LIQUID PHASE SYNGAS-TO-DME PROCESS

    Energy Technology Data Exchange (ETDEWEB)

    Xiang-Dong Peng

    2002-05-01

    At the heart of the single-step liquid phase syngas-to-DME process (LPDME{trademark}) is a catalyst system that can be active as well as stable. In the Alternative Fuels I program, a dual-catalyst system containing a Cu-based commercial methanol synthesis catalyst (BASF S3-86) and a commercial dehydration material ({gamma}-alumina) was demonstrated. It provided the productivity and selectivity expected from the LPDME process. However, the catalyst system deactivated too rapidly to warrant a viable commercial process [1]. The mechanistic investigation in the early part of the DOE's Alternative Fuels II program revealed that the accelerated catalyst deactivation under LPDME conditions is due to detrimental interaction between the methanol synthesis catalyst and methanol dehydration catalyst [2,3]. The interaction was attributed to migration of Cu- and/or Zn-containing species from the synthesis catalyst to the dehydration catalyst. Identification of a dehydration catalyst that did not lead to this detrimental interaction while retaining adequate dehydration activity was elusive. Twenty-nine different dehydration materials were tested, but none showed the desired performance [2]. The search came to a turning point when aluminum phosphate was tested. This amorphous material is prepared by precipitating a solution containing Al(NO{sub 3}){sub 3} and H{sub 3}PO{sub 4} with NH{sub 4}OH, followed by washing, drying and calcination. The aluminum phosphate catalyst has adequate dehydration activity and good stability. It can co-exist with the Cu-based methanol synthesis catalyst without negatively affecting the latter catalyst's stability. This report documents the details of the development of this catalyst. These include initial leads, efforts in improving activity and stability, investigation and development of the best preparation parameters and procedures, mechanistic understanding and resulting preparation guidelines, and the accomplishments of this work.

  11. Recyclable hydroformylation catalysts of higher alkenes using immobilized catalysts and two-phase systems

    Energy Technology Data Exchange (ETDEWEB)

    Reek, J.N.H.; Sandee, A.J.; Schreuder Goedheijt, M.; Kamer, P.C.J.; Leeuwen, P.W.N.M. van [Amsterdam Univ. (Netherlands). Inst. of Molecular Chemistry, Homogeneous Catalysis

    2001-03-01

    This article reports on the use of recyclable catalysts, using different concepts, in the hydroformylation of 1-octene employing diphosphine ligands based on the xantene backbone. Amphiphilic diphosphines were developed for the aqueous two-phase catalysis, which spontaneously form aggregates that are remarkably thermostable. The observed TOF's in the hydroformylation of 1-octene using ligands that form vesicles are up to 14 times higher compared to analogue ligands that do not form aggregates. A water-soluble ligand based on the xantene backbone was used to form a stable and recyclable supported aqueous phase catalyst (SAPC). A xanthene-based ligand, N-(3-trimethoxysilane-n-propyl)-4,5-bis(diphenyl-phosphino)-phenoxazine (Siloxantphos) was anchored covalently to a silica support by the sol-gel technique. All concepts demonstrated that the rhodium complexes of these ligands form very selective hydroformylation catalysts producing linear aldehydes. Under similar conditions the activity of the silica-immobilized catalysts is higher than that of the aggregates (by a factor 2) of which the activity is higher than the SAP catalyst (factor 12). (orig.)

  12. General Motors Phase II Catalyst System

    Energy Technology Data Exchange (ETDEWEB)

    Canale, R.P.; Winegarden, S.R.; Carlson, C.R.; Miles, D.L.

    1978-01-01

    Three-way catalysts provide a means of catalytically achieving lower NOx emission levels while maintaining good control of HC and CO emissions. However, very accurate control of air-fuel ratio is necessary. The precise air-fuel ratio control required is accomplished by employing a closed loop fuel metering system in conjunction with an exhaust gas sensor and an electronic control unit. To gain production experience with this type of system, General Motors is introducing it on two 1978 engine families sold in California. One is a 2.5 liter L-4 engine and the other is a 3.8 liter V-6 engine. Closed loop controlled carburetors are used on both systems. The components used on both systems are described and emission and fuel economy results are reviewed.

  13. Non-noble metal based catalysts for aqueous phase processing

    NARCIS (Netherlands)

    van Haasterecht, T.

    2015-01-01

    This thesis concerns the evaluation of the potential of supported non-noble metal catalysts in aqueous phase processes for the production hydrogen and oxygenates. The aim of this thesis is to investigate how different factors, especially the nature of the metal, additives and reaction conditions, de

  14. Non-noble metal based catalysts for aqueous phase processing

    NARCIS (Netherlands)

    van Haasterecht, T.

    2015-01-01

    This thesis concerns the evaluation of the potential of supported non-noble metal catalysts in aqueous phase processes for the production hydrogen and oxygenates. The aim of this thesis is to investigate how different factors, especially the nature of the metal, additives and reaction conditions,

  15. Restrictive liquid-phase diffusion and reaction in bidispersed catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Lee, S.Y.; Seader, J.D. (Utah Univ., Salt Lake City, UT (United States). Dept. of Chemical Engineering); Tsai, C.H.; Massoth, F.E. (Utah Univ., Salt Lake City, UT (United States). Dept. of Fuels Engineering)

    1991-08-01

    In this paper, the effect of bidispersed pore-size distribution on liquid-phase diffusion and reaction in NiMo/Al{sub 2}O{sub 3} catalysts is investigated by applying two bidispersed-pore-structure models, the random-pore model and a globular-structure model, to extensive experimental data, which were obtained from sorptive diffusion measurements at ambient conditions and catalytic reaction rate measurements on nitrogen-containing compounds. Transport of the molecules in the catalysts was found to be controlled by micropore diffusion, in accordance with the random-pore model, rather than macropore diffusion as predicted by the globular-structure model. A qualitative criterion for micropore-diffusion control is proposed: relatively small macroporosity and high catalyst pellet density. Since most hydrotreating catalysts have high density, diffusion in these types of catalysts may be controlled by micropore diffusion. Accordingly, it is believed in this case that increasing the size of micropores may be more effective to reduce intraparticle diffusion resistance than incorporating macropores alone.

  16. Amphiphilic phase-transforming catalysts for transesterification of triglycerides

    Science.gov (United States)

    Nawaratna, Gayan Ivantha

    Heterogeneous catalytic reactions that involve immiscible liquid-phase reactants are challenging to conduct due to limitations associated with mass transport. Nevertheless, there are numerous reactions such as esterification, transesterification, etherification, and hydrolysis where two immiscible liquid reactants (such as polar and non-polar liquids) need to be brought into contact with a catalyst. With the intention of alleviating mass transport issues associated with such systems but affording the ability to separate the catalyst once the reaction is complete, the overall goal of this study is geared toward developing a catalyst that has emulsification properties as well as the ability to phase-transfer (from liquid-phase to solid-phase) while the reaction is ongoing and evaluating the effectiveness of such a catalytic process in a practical reaction. To elucidate this concept, the transesterification reaction was selected. Metal-alkoxides that possess acidic and basic properties (to catalyze the reaction), amphiphilic properties (to stabilize the alcohol/oil emulsion) and that can undergo condensation polymerization when heated (to separate as a solid subsequent to the completion of the reaction) were used to test the concept. Studies included elucidating the effect of metal sites and alkoxide sites and their concentration effects on transesterification reaction, effect of various metal alkoxide groups on the phase stability of the reactant system, and kinetic effects of the reaction system. The studies revealed that several transition-metal alkoxides, especially, titanium and yttrium based, responded positively to this reaction system. These alkoxides were able to be added to the reaction medium in liquid phase and were able to stabilize the alcohol/oil system. The alkoxides were selective to the transesterification reaction giving a range of ester yields (depending on the catalyst used). It was also observed that transition-metal alkoxides were able to be

  17. Novel vanadium phosphate phases as catalysts for selective oxidation

    Indian Academy of Sciences (India)

    Arunabha Datta; Monika Agarwal; Soumen Dasgupta

    2002-08-01

    In our effort to induce novel modifications in the structure of some important vanadium phosphate phases used as selective oxidation catalysts, it has been observed that metal ions such as Zn2+, Ni2+, Pd2+ can be incorporated into the vanadyl hydrogen phosphate VOHPO4$\\cdot$0.5H2O phase in very different ways depending upon the medium of preparation. It has been found that the metal ions are either substituted into the lattice with retention of structure of the parent compound or intercalated between the layers of a new mixed-valent phase. These new metalincorporated phases are catalytically active and the palladium incorporated compound in particular displays shape selective catalysis for different oxidation and reduction reactions. In another approach, the preparation of VOHPO4$\\cdot$0.5H2O has been modified to give a novel crystalline phase containing mixed-valent vanadium and having NH3 species bound to the lattice. This phase could be a potential catalyst for ammoxidation reactions. In addition, novel mesostructured vanadium phosphate phases have been prepared using a long-chain amine as the templating agent involving a ligand templating mechanism of formation.

  18. Asymmetric cyclopropanation of chalcones using chiral phase-transfer catalysts

    OpenAIRE

    2013-01-01

    The first phase-transfer catalyzed cyclopropanation reaction of chalcones using bromomalonates as the nucleophiles in a Michael Initiated Ring Closing reaction (MIRC) was developed. Key to success was the use of a free OH-containing cinchona alkaloid ammonium salt catalyst and carefully optimized liquid/liquid reaction conditions. The reaction performed well for electron neutral and electron deficient chalcones giving the products in yields up to 98% and with enantiomeric ratios up to 91:9.

  19. Two-Phase Reactions in Microdroplets without the Use of Phase-Transfer Catalysts.

    Science.gov (United States)

    Yan, Xin; Cheng, Heyong; Zare, Richard N

    2017-02-22

    Many important chemical transformations occur in two-phase reactions, which are widely used in chemical, pharmaceutical, and polymer manufacturing. We present an efficient method for performing two-phase reactions in microdroplets sheared by sheath gas without using a phase-transfer catalyst. This avoids disadvantages such as thermal instability, high cost, and, especially, the need to separate and recycle the catalysts. We show that various alcohols can be oxidized to the corresponding aldehydes and ketones within milliseconds in moderate to good yields (50-75 %). The scale-up of the present method was achieved at an isolated rate of 1.2 mg min(-1) for the synthesis of 4-nitrobenzylaldehyde from 4-nitrobenzyl alcohol in the presence of sodium hypochlorite. The biphasic nature of this process, which avoids use of a phase-transfer catalyst, greatly enhances synthetic effectiveness.

  20. Highly Selective Continuous Gas-Phase Methoxycarbonylation of Ethylene with Supported Ionic Liquid Phase (SILP) Catalysts

    DEFF Research Database (Denmark)

    Khokarale, Santosh Govind; Garcia Suárez, Eduardo José; Fehrmann, Rasmus

    2017-01-01

    Supported ionic liquid phase (SILP) technology was applied for the first time to the Pd-catalyzed continuous, gas-phase methoxycarbonylation of ethylene to selectively produce methyl propanoate (MP) in high yields. The influence of catalyst and reaction parameters such as, for example, ionic liqu...

  1. Gas Phase Polymerization of Ethylene with Supported Titanium-Nickel Catalysts

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    A new ditransition-metal catalyst system TiCl4-NiCl2/MgCl2-SiO2/AlR3 was prepared.Gas phase polymerization of ethylene with the catalysts has been studied.The kinetic curves of gas phase polymerization showed a decline.The catalystic efficiency and polymerization reaction rates have a optimum value when Ni content of the catalysts was 12.5%(mol).The products obtained are branched polyethylene.

  2. Continuous fixed-bed gas-phase hydroformylation using supported ionic liquid-phase (SILP) Rh catalysts

    DEFF Research Database (Denmark)

    Riisager, Anders; Wasserscheid, Peter; Van Hal, R.

    2003-01-01

    Continuous flow gas-phase hydroformylation of propene was performed using novel supported ionic liquid-phase (SILP) catalysts containing immobilized Rh complexes of the biphosphine ligand sulfoxantphos in the ionic liquids 1-n-butyl-3-methylimidazolium hexafluorophosphate and halogen-free 1-n......-butyl-3-methylimidazolium n-octylsulfate on silica support. The Rh-sulfoxantphos SILP catalysts proved to be more regioselective than catalysts without ligand and the analogous ionic liquid-free catalysts, giving up to 96% linear product. Furthermore, the performance of the catalysts was generally...

  3. The precursor phase composition of iron catalyst and discovery of FeO based catalyst for ammonia synthesis

    Institute of Scientific and Technical Information of China (English)

    刘化章; 李小年

    1995-01-01

    The relationship between the activity and the precursor phase composition of the molten iron catalyst for ammonia synthesis has been studied with high pressure testing equipment and XRD. A humped curve between the activity and Fe2+/Fe3+ has been obtained. It is found that the unicity of the iron oxidate phase in precursor is an essential condition of the high activity of the iron catalyst and that the uniform distribution of the adominant phase and the promoters is the key to preparing a catalyst with better performance The humped curve is interpreted using the ratio f of the phase compositions in precursor. A new idea has been obtained that the activity change of the molten iron catalyst depends essentially on the molecule ratio of the different iron oxidates in precursor under the certain promoters, and it is found that the FeO based catalyst for ammonia synthesis with Wustite phase structure (Fe1-xO, 0.04≤x≤0.10) has the highest activity of all the molten iron catalysts for ammonia synthesis.

  4. Identification of nitrogen compounds and amides from spent hydroprocessing catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Choi, J.H.K.; Gray, M.R. (University of Alberta, Edmonton, AB (Canada). Dept. of Chemical Engineering)

    1991-06-01

    A spent commercial naphtha hydrotreating catalyst was analyzed to identify compounds which had accumulated on the catalyst surface during its active life. The catalyst was extracted with methylene chloride, methanol and pyridine to remove adsorbed organic material, which was rich in nitrogen and oxygen. A series of quinolones were identified in the methanol extract after enrichment with HCl-modified silica gel adsorption and subsequent silica gel chromatography. Tetra- and hexahydroquinolones with alkyl substituents up to C{sub 3} were identified. Similar amides have been identified in asphaltenes, and are very resistant to hydrogenation. Tetrahydroquinolines and piperidines were detected in the pyridine extract. 36 refs., 8 figs., 2 tabs.

  5. Metallocene supported core@LDH catalysts for slurry phase ethylene polymerisation.

    Science.gov (United States)

    Buffet, Jean-Charles; Byles, Coral F H; Felton, Ryan; Chen, Chunping; O'Hare, Dermot

    2016-03-14

    We report the synthesis of solid catalysts based on a zirconocene supported on either silica@AMO-LDH or zeolite@AMO-LDH for the slurry phase polymerisation of ethylene. The hybrid catalysts demonstrate synergistic effects in which the polymerisation activity is up to three times higher than the zirconocene supported on analogous single phase silica or zeolite supports.

  6. Preparation of Pt/C Catalyst with Solid Phase Reaction Method

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The Pt/C catalyst was prepared with solid phase reaction method (Pt/C(S)) for the first time. Its performances were compared with that prepared by the traditional liquid phase reaction method. The results demonstrate that the electrocatalytic activity of Pt/C catalyst with solid phase reaction method for methanol oxidation is higher than that with liquid phase reaction method. XRD and TEM measurements indicate that the Pt/C(S) possesses low crystalline extent and small particle size.

  7. Aqueous phase reforming of glycerol over Ni-based catalysts for hydrogen production.

    Science.gov (United States)

    Cho, Su Hyun; Moon, Dong Ju

    2011-08-01

    Aqueous phase reforming of glycerol over Ni-based catalysts for hydrogen production was carried out at 225 degrees C, 23 bar and LHSV = 4 h(-1). The Ni-based catalyst was prepared by an incipient wetness impregnation method. The catalysts before and after the reaction were characterized by N2 physisorption, CO chemisorption, XRD, TPR, SEM and TEM techniques. It was found that Ni(20 wt%)-Co(3 wt%)/gamma-Al2O3 catalyst showed higher glycerol conversion and hydrogen selectivity than Ni(20 wt%)/gamma-Al2O3 catalyst. There are no major changes in Ni particles after the reaction over Ni-Co/gamma-Al2O3 catalyst. The results suggest that the Ni-Co/gamma-Al2O3 catalyst can be applied to the hydrogen production system using APR of glycerol.

  8. Advanced Aqueous Phase Catalyst Development using Combinatorial Methods Project

    Data.gov (United States)

    National Aeronautics and Space Administration — Combinatorial methods are proposed to develop advanced Aqueous Oxidation Catalysts (AOCs) with the capability to mineralize organic contaminants present in effluents...

  9. Mixed phase Pt-Ru catalyst for direct methanol fuel cell anode by flame aerosol synthesis

    DEFF Research Database (Denmark)

    Chakraborty, Debasish; Bischoff, H.; Chorkendorff, Ib

    2005-01-01

    A spray-flame aerosol catalyzation technique was studied for producing Pt-Ru anode electrodes for the direct methanol fuel cell. Catalysts were produced as aerosol nanoparticles in a spray-flame reactor and deposited directly as a thin layer on the gas diffusion layer. The as-prepared catalyst......Ru1/Vulcan carbon. The kinetics of methanol oxidation on the mixed phase catalyst was also explored by electrochemical impedance spectroscopy. (c) 2005 The Electrochemical Society....

  10. Catalyst for the carboxylation of carbonylated compounds in the gas phase

    DEFF Research Database (Denmark)

    2013-01-01

    The invention relates to a catalyst for the carboxylation of carbonylated compounds in the gas phase. Said catalyst consists of a metal complex which is active when the carboxylation is under reaction conditions and an organic salt, which is solid under normal conditions and liquid under reaction...

  11. Studies on Macro—kinetics of Gas Phase Polymerization of Butadiene with Rare—earch Catalyst

    Institute of Scientific and Technical Information of China (English)

    FANGDonyu; SUNJianzhong; 等

    2002-01-01

    The study of the kinetics of gas phase polymerization of butadiene with heterogeneous catalyst based on neodymium(Nd) was carried out.The effects of reaction temperature,reaction pressure,dispersing medium, and types of catalyst on kinetics of polymerization were investigated .A kinetic model with two kinds of active sites was proposed.The results show that the effects of the reaction temperature and the types of dispersing medium and catalyst on the kinetic performance of polymerization are significant,and that the combined model of first and second order decay of active site of catalyst can be used to describe the phenomena.

  12. Crystal size growth in the liquid phase methanol synthesis catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Sawant, A.; Lee, S.; Foos, A.

    1988-01-01

    The phenomenon of crystal growth in the methanol synthesis catalyst has been studied. Crystallite size distributions in the CuO/ZnO/Al/sub 2/O/sub 3/ methanol synthesis catalyst have been determined. The effects of temperature, reaction environment and time under reaction conditions have been studied. It is observed that water in the reaction mixture promotes crystal growth. 26 refs., 10 figs., 1 tab.

  13. Ethoxylation of p-chloronitrobenzene using phase-transfer catalysts by ultrasound irradiation: a kinetic study.

    Science.gov (United States)

    Wang, Maw-Ling; Rajendran, Venugopal

    2007-03-01

    Ethoxy-4-nitrobenzene was synthesized by the reaction of 4-chloronitrobenzene with potassium ethoxide in a homogeneous system using benzyltriethylammonium chloride (QCl) as a phase-transfer catalyst at 50 degrees C under ultrasound irradiation conditions. The use of phase-transfer catalysts and ultrasound has been compared and demonstrated in this nucleophilic substitution reactions. The kinetics of the reaction depends on the effect of amount of catalyst, quaternary ammonium salts, agitation speed, amount of potassium hydroxide, amount of ethanol, temperature and the frequency of the ultrasound waves on the conversion of the reaction.

  14. XAFS characterization of industrial catalysts: in situ study of phase transformation of nickel sulfide

    Science.gov (United States)

    Wang, J.; Jia, Z.; Wang, Q.; Zhao, S.; Xu, Z.; Yang, W.; Frenkel, A. I.

    2016-05-01

    The online sulfiding process for nickel-contained catalyst often ends up with a nickel sulfide mixture in refinery plant. To elucidate the local environment of nickel and its corresponding sulfur species, a model catalyst (nickel sulfide) and model thermal process were employed to explore the possibilities for characterization of real catalysts in industrial conditions. The present investigation shows effectiveness of in situ XANES and EXAFS measurements for studying the phase stability and phase composition in these systems, which could be used to simulate real sulfiding process in industrial reactions, such as hydrodesulfurizations of oil.

  15. Synthesis of Acrolein from Glycerol Using FePO4 Catalyst in Liquid Phase Dehydration

    Directory of Open Access Journals (Sweden)

    Akhmad Zainal Abidin

    2016-02-01

    Full Text Available Acrolein is currently produced using propylene from crude oil while its price and scarcity are increasing. A renewable material such as glycerol is an attractive alternative for acrolein production. It can be obtained from crude palm oil (CPO and is a byproduct of biodiesel production. Besides being able to compete economically, glycerol is an environmentally friendly material. The purpose of this study is to synthesize acrolein from glycerol using FePO4 catalyst in liquid phase dehydration. The catalyst was prepared by three different methods: hydrothermal (catalyst A, deposition at Fe/P = 1.15 (catalyst B, and deposition at Fe/P = 1.20 (catalyst C. The experimental reaction temperature was varied at 220, 240 and 260 °C under constant atmospheric pressure. The results showed that catalyst C provided the best yield (91%, followed by catalyst A (90% and catalyst B (82%. The increasing reaction temperature showed a tendency to increase the yield of acrolein, while the presence of oxygen reduced the yield of acrolein and allowed the reaction to produce more side products such as glycerol propanal, acetaldehyde, and propionate. Catalyst reuse without any regeneration resulted in a yield profile of acrolein that continued to decline.

  16. Recent development of supported monometallic gold as heterogeneous catalyst for selective liquid phase hydrogenation reactions

    Institute of Scientific and Technical Information of China (English)

    Thushara Kandaramath Hari; Zahira Yaakob

    2015-01-01

    The great potential of gold catalysts for chemical conversions in both industrial and environmental concerns has attracted increasing interest in many fields of research. Gold nanoparticles supported by metal oxides with high surface area have been recognized as highly efficient and effective green heterogeneous catalyst even at room temperature under normal reaction conditions, in gas and liquid phase reactions. In the present review, we dis-cuss the recent development of heterogeneous, supported monometal ic gold catalysts for organic transforma-tions emphasizing mainly liquid phase hydrogenation reactions. Discussions on the catalytic synthesis procedures and the promoting effect of other noble metals are omitted since they are already worked out. Appli-cations of heterogeneous, supported monometal ic catalysts for chemoselective hydrogenations in liquid phase are studied including potential articles during the period 2000–2013.

  17. Study on Ni/C catalysts for vapor phase carbonylation of ethanol

    Institute of Scientific and Technical Information of China (English)

    Qing Zhang; Huifang Wang; Guosong Sun; Kelin Huang; Weiping Fang; Yiquan Yang

    2008-01-01

    Activated carbon-supported Ni catalysts for vapor phase carbonylation of ethanol to propionic acid in the presence of ethyl iodide as promoter were investigated. Under optimum reaction conditions, the conversions of carbon monoxide and ethanol were measured to be 81.4% and 98.4%, respectively, while the selectivity for propionic acid was found to be 98.65%. The catalyst was stable within 48 h on stream. XRD and XPS methods were used to characterize the structures and surface properties of the fresh and tested catalysts. The characterization results indicated that aggregation of nickel particles and formation of nickel iodide on the catalyst surface should be responsible for the deactivation of the catalysts.

  18. Aqueous phase reforming of glycerol over the Pd loaded Ni/Al2O3 catalysts.

    Science.gov (United States)

    Karthikeyan, Dhanapalan; Shin, Gwan Su; Moon, Dong Ju; Kim, Jong Ho; Park, Nam Cook; Kim, Young Chul

    2011-02-01

    Bifunctional catalysts containing (0.5-1.5 wt%) palladium and 15 wt% of Nickel supported on gamma-Al2O3 were prepared via an impregnation technique and catalysts were characterzed by XRD BET surface area and SEM, respectively. The aqueous phase reforming of glycerol (APR) was conducted over alumina-supported catalysts at different reaction conditions for catalytic activity. Finally, we concluded that the 1.0 wt% Pd 15 wt% Ni/gamma-Al2O3 catalyst evidences higher conversion, hydrogen selectivity, lower alkane selectivity and CO production. This indicate that Pd loaded Ni/gamma-Al2O3 could be a potential catalyst for the APR of glycerol.

  19. Surface features and catalytic performance of platinum/alumina catalysts in slurry-phase hydrogenation

    Energy Technology Data Exchange (ETDEWEB)

    Gutierrez-Ortiz, M.A.; Gonzalez-Marcos, M.P.; Arnaiz-Aguilar, S.; Gonzalez-Marcos, J.A.; Gonzalez-Velasco, J.R. (Univ. del Pais Vasco/Euskal Hirrika Unibertsitatea, Bilbao (Spain). Dept. de Ingenierlla Quimica)

    1993-11-01

    Several platinum catalysts supported on three commercial [gamma]-aluminas were prepared by impregnation and anionic exchange using aqueous solutions of H[sub 2]PtCl[sub 6]. A number of methods were used to characterize the precursors as well as the final catalysts, including TGA, TPR, and hydrogen chemisorption at 298 K. TPR measurements showed two reduction peaks for the catalysts: the first one corresponding to reduction of the metal precursor to platinum and the second one associated to formation of a surface complex, Pt-Al[sub 2]O[sub 3[minus]x], With partial reduction of the support. The activity of the different catalysts was tested in the slurry-phase hydrogenation of benzene. The results obtained in the activity measurements have been correlated to the characteristics of the catalysts.

  20. Power system identification toolbox: Phase two progress

    Energy Technology Data Exchange (ETDEWEB)

    Trudnowski, D.J.

    1994-08-01

    This report describes current progress on a project funded by the Bonneville Power Administration (BPA) to develop a set of state-of-the-art analysis software (termed the Power System Identification [PSI] Toolbox) for fitting dynamic models to measured data. The project is being conducted as a three-phase effort. The first phase, completed in late 1992, involved investigating the characteristics of the analysis techniques by evaluating existing software and developing guidelines for best use. Phase Two includes extending current software, developing new analysis algorithms and software, and demonstrating and developing applications. The final phase will focus on reorganizing the software into a modular collection of documented computer programs and developing user manuals with instruction and application guidelines. Phase Two is approximately 50% complete; progress to date and a vision for the final product of the PSI Toolbox are described. The needs of the power industry for specialized system identification methods are particularly acute. The industry is currently pushing to operate transmission systems much closer to theoretical limits by using real-time, large-scale control systems to dictate power flows and maintain dynamic stability. Reliably maintaining stability requires extensive system-dynamic modeling and analysis capability, including measurement-based methods. To serve this need, the BPA has developed specialized system-identification computer codes through in-house efforts and university contract research over the last several years. To make full integrated use of the codes, as well as other techniques, the BPA has commissioned Pacific Northwest Laboratory (PNL) to further develop the codes and techniques into the PSI Toolbox.

  1. Vowel identification by amplitude and phase contrast.

    Science.gov (United States)

    Molis, Michelle R; Diedesch, Anna; Gallun, Frederick; Leek, Marjorie R

    2013-02-01

    Vowel identification is largely dependent on listeners' access to the frequency of two or three peaks in the amplitude spectrum. Earlier work has demonstrated that, whereas normal-hearing listeners can identify harmonic complexes with vowel-like spectral shapes even with very little amplitude contrast between "formant" components and remaining harmonic components, listeners with hearing loss require greater amplitude differences. This is likely the result of the poor frequency resolution that often accompanies hearing loss. Here, we describe an additional acoustic dimension for emphasizing formant versus non-formant harmonics that may supplement amplitude contrast information. The purpose of this study was to determine whether listeners were able to identify "vowel-like" sounds using temporal (component phase) contrast, which may be less affected by cochlear loss than spectral cues, and whether overall identification improves when congruent temporal and spectral information are provided together. Five normal-hearing and five hearing-impaired listeners identified three vowels over many presentations. Harmonics representing formant peaks were varied in amplitude, phase, or a combination of both. In addition to requiring less amplitude contrast, normal-hearing listeners could accurately identify the sounds with less phase contrast than required by people with hearing loss. However, both normal-hearing and hearing-impaired groups demonstrated the ability to identify vowel-like sounds based solely on component phase shifts, with no amplitude contrast information, and they also showed improved performance when congruent phase and amplitude cues were combined. For nearly all listeners, the combination of spectral and temporal information improved identification in comparison to either dimension alone.

  2. In-situ reduction of a methanol synthesis catalyst in a three-phase slurry reactor

    Energy Technology Data Exchange (ETDEWEB)

    Sawant, A.; Ko, M.K.; Parameswaran, V.; Lee, S.; Kulik, C.J.

    1987-01-01

    A new method for the reduction of metal oxide catalysts (CuO, ZnO, Al/sub 2/O/sub 3/) has been developed for liquid phase methanol synthesis. The reducing agent is a 5% hydrogen in nitrogen mixture and the operation is carried out at 446.09 KPa. This method makes it possible to reduce finely crushed catalyst (-100 + 120 mesh) in a three phase slurry reactor. This method offers several advantages over methods in which the catalyst is reduced in a gas-solid contact mode and then slurried for use. The catalyst has been shown to be very effectively reduced and reaches its full production capacity after reduction.

  3. Bimetallic Au-decorated Pd catalyst for the liquid phase hydrodechlorination of 2,4-dichlorophenol

    Energy Technology Data Exchange (ETDEWEB)

    Zhou, Juan [School of the Environment, Donghua University, Shanghai 201620 (China); Chen, Huan, E-mail: hchen404@njust.edu.cn [Key Laboratory of Jiangsu Province for Chemical Pollution Control and Resources Reuse, School of Environmental & Biological Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Chen, Quanyuan; Huang, Zhaolu [School of the Environment, Donghua University, Shanghai 201620 (China)

    2016-11-30

    Graphical abstract: 2,4-Dichlorophenol can be converted to phenol via the catalytic HDC method over Pd-Au/CNTs and the catalytic activity first increased and then decreased with Au content. - Highlights: • Bimetallic catalysts had smaller metal particles and larger number of exposed active site than the monometallic catalysts. • The cationization of Pd particles increased with Au content in the bimetallic catalysts. • The bimetallic catalysts exhibited higher catalytic activities for HDC of 2,4-DCP than the monometallic counterparts. • The concerted pathway for HDC of 2,4-DCP was more predominant with increasing Au content in the bimetallic catalyst. - Abstract: Monometallic and bimetallic Pd-Au catalysts supported on multi-walled carbon nanotubes (CNTs) with varied Au cooperation amounts were prepared using the complexing-reduction method in the presence of tetrahydrofuran (THF). The liquid phase catalytic hydrodechlorination (HDC) of 2,4-dichlorophenol (2,4-DCP) was investigated over these bimetallic catalysts. The catalysts were characterized by N{sub 2} adsorption-desorption isotherms, X-ray diffraction, transmission electron microscopy, X-ray photoelectron spectroscopy, and H{sub 2} chemisorption. Characterization results showed that the co-reduction of Pd and Au mainly formed alloy-like structure. The bimetallic catalysts had smaller metal particles and larger numbers of exposed active site than that of monometallic catalysts. In addition, compared with Pd(1.7)/CNTs and Au(0.4)/CNTs, the binding energies of Pd 3d{sub 5/2} shifted to higher positions while that of Au 4f{sub 7/2} had negative shifts in the Pd-Au bimetallic catalysts, which can be ascribed to the electrons transferred from metal Pd to Au and the cationization of Pd particles was enhanced. Accordingly, the bimetallic Pd-Au particles with different Au contents in the catalysts exhibited varied synergistic effects for the catalytic HDC of 2,4-DCP, with Pd(1.8)Au(0.4)/CNTs having the highest

  4. Biopolymer-supported ionic-liquid-phase ruthenium catalysts for olefin metathesis.

    Science.gov (United States)

    Clousier, Nathalie; Filippi, Alexandra; Borré, Etienne; Guibal, Eric; Crévisy, Christophe; Caijo, Fréderic; Mauduit, Marc; Dez, Isabelle; Gaumont, Annie-Claude

    2014-04-01

    Original ruthenium supported ionic liquid phase (SILP) catalysts based on alginates as supports were developed for olefin metathesis reactions. The marine biopolymer, which fulfills most of the requisite properties for a support such as widespread abundance, insolubility in the majority of organic solvents, a high affinity for ionic liquids, high chemical stability, biodegradability, low cost, and easy processing, was impregnated by [bmim][PF6 ] containing an ionically tagged ruthenium catalyst. These biosourced catalysts show promising performances in ring-closing metathesis (RCM) and cross-metathesis (CM) reactions, with a high level of recyclability and reusability combined with a good reactivity.

  5. A Novel Catalyst for Liquid Phase Hydrogenation of m-Dinitrobenzene to m-Phenylenediamine

    Institute of Scientific and Technical Information of China (English)

    Ying Xin LIU; Zuo Jun WEI; Ji Xiang CHEN; Ji Yan ZHANG; Xin Xue LI; Xiong Hui WEI

    2005-01-01

    A novel lanthana-promoted nickel catalyst supported on silica for the liquid phase hydrogenation of m-dinitrobenzene to m-phenylenediamine was prepared by an incipient wetness sequential impregnation method. It was found that Ni-La/SiO2 catalyst exhibited high activity and stability for m-dinitrobenzene hydrogenation. Over this catalyst, the conversion of m-dinitrobenzene and the yield of m-phenylenediamine were up to 97.1% and 93.5%, respectively,at 373 K and 2.6 MPa hydrogen pressure after reaction for 1 h.

  6. Study on the Precursor Phase Composition of Fused Iron Catalyst for Fischer-Tropsch Synthesis

    Institute of Scientific and Technical Information of China (English)

    2005-01-01

    The effect of the precursor composition of fused iron catalyst on the performance of Fischer-Tropsch synthesis was investigated. XRD, BET and CO2 adsorption experiments were carried out to provide better insight into the relationship therein. The results showed that the selectivity of C5+ hydrocarbon products was dependent on the mole ratio of Fe2+/Fe3+, which was represented by a hump-shaped curve. Catalysts with precursors containing Fe3O4 phase favored the magnetite spinal formation during F-T reaction, while Fe1-xO-based catalysts were more likely to favor the formation and growth of the iron carbide crystals.

  7. Bimetallic Au-decorated Pd catalyst for the liquid phase hydrodechlorination of 2,4-dichlorophenol

    Science.gov (United States)

    Zhou, Juan; Chen, Huan; Chen, Quanyuan; Huang, Zhaolu

    2016-11-01

    Monometallic and bimetallic Pd-Au catalysts supported on multi-walled carbon nanotubes (CNTs) with varied Au cooperation amounts were prepared using the complexing-reduction method in the presence of tetrahydrofuran (THF). The liquid phase catalytic hydrodechlorination (HDC) of 2,4-dichlorophenol (2,4-DCP) was investigated over these bimetallic catalysts. The catalysts were characterized by N2 adsorption-desorption isotherms, X-ray diffraction, transmission electron microscopy, X-ray photoelectron spectroscopy, and H2 chemisorption. Characterization results showed that the co-reduction of Pd and Au mainly formed alloy-like structure. The bimetallic catalysts had smaller metal particles and larger numbers of exposed active site than that of monometallic catalysts. In addition, compared with Pd(1.7)/CNTs and Au(0.4)/CNTs, the binding energies of Pd 3d5/2 shifted to higher positions while that of Au 4f7/2 had negative shifts in the Pd-Au bimetallic catalysts, which can be ascribed to the electrons transferred from metal Pd to Au and the cationization of Pd particles was enhanced. Accordingly, the bimetallic Pd-Au particles with different Au contents in the catalysts exhibited varied synergistic effects for the catalytic HDC of 2,4-DCP, with Pd(1.8)Au(0.4)/CNTs having the highest catalytic activity. For the bimetallic catalysts, a disproportional increase of turnover frequency (TOF) was observed with increasing Au content due to the enhanced cationization of Pd particles. Moreover, the dechlorination of 2,4-DCP over the supported monometallic and bimetallic catalysts proceeded via both the stepwise and concerted pathway, and the concerted pathway became predominant with Au decoration amount in the catalyst.

  8. Vapor Phase Dehydration of Glycerol to Acrolein Over SBA-15 Supported Vanadium Substituted Phosphomolybdic Acid Catalyst.

    Science.gov (United States)

    Viswanadham, Balaga; Srikanth, Amirineni; Kumar, Vanama Pavan; Chary, Komandur V R

    2015-07-01

    Vapor phase dehydration of glycerol to acrolein was investigated over heteropolyacid (HPA) catalysts containing vanadium substituted phosphomolybdic acid (H4PMo11VO40) supported on mesoporous SBA-15. A series of HPA catalysts with HPA loadings varying from 10-50 wt% were prepared by impregnation method on SBA-15 support. The catalysts were characterized by X-ray diffraction, Raman spectroscopy, Fourier Transform infrared spectroscopy, temperature-programmed desorption of NH3, pyridine adsorbed FT-IR spectroscopy, scanning electron microscopy, pore size distribution and specific surface area measurements. The nature of acidic sites was examined by pyridine adsorbed FT-IR spectroscopy. XRD results suggest that the active phase containing HPA was highly dispersed at lower loadings on the support. FT-IR and Raman spectra results confirm that the presence of primary Keggin ion structure of HPA on the support and it was not affected during the preparation of catalysts. Pore size distribution results reveal that all the samples show unimodel pore size distribution with well depicted mesoporous structure. NH3-TPD results suggest that the acidity of catalysts increased with increase of HPA loading. The findings of acidity measurements by FT-IR spectra of pyridine adsorption reveals that the catalysts consist both the Brønsted and Lewis acidic sites and the amount of Brønsted acidic sites are increasing with HPA loading. SBA-15 supported vanadium substituted phosphomolybdic acid catalysts are found to be highly active during the dehydration reaction and exhibited 100% conversion of glycerol (10 wt% of glycerol) and the acrolein selectivity was appreciably changed with HPA active phase loading. The catalytic functionalities during glycerol dehydration are well correlated with surface acidity of the catalysts.

  9. Gallium-rich Pd-Ga phases as supported liquid metal catalysts

    Science.gov (United States)

    Taccardi, N.; Grabau, M.; Debuschewitz, J.; Distaso, M.; Brandl, M.; Hock, R.; Maier, F.; Papp, C.; Erhard, J.; Neiss, C.; Peukert, W.; Görling, A.; Steinrück, H.-P.; Wasserscheid, P.

    2017-09-01

    A strategy to develop improved catalysts is to create systems that merge the advantages of heterogeneous and molecular catalysis. One such system involves supported liquid-phase catalysts, which feature a molecularly defined, catalytically active liquid film/droplet layer adsorbed on a porous solid support. In the past decade, this concept has also been extended to supported ionic liquid-phase catalysts. Here we develop this idea further and describe supported catalytically active liquid metal solutions (SCALMS). We report a liquid mixture of gallium and palladium deposited on porous glass that forms an active catalyst for alkane dehydrogenation that is resistant to coke formation and is thus highly stable. X-ray diffraction and X-ray photoelectron spectroscopy, supported by theoretical calculations, confirm the liquid state of the catalytic phase under the reaction conditions. Unlike traditional heterogeneous catalysts, the supported liquid metal reported here is highly dynamic and catalysis does not proceed at the surface of the metal nanoparticles, but presumably at homogeneously distributed metal atoms at the surface of a liquid metallic phase.

  10. Gas-phase dehydration of glycerol over commercial Pt/γ-Al2O3 catalysts

    Institute of Scientific and Technical Information of China (English)

    Sergey Danov; Anton Esipovich; Artem Belousov; Anton Rogozhin

    2015-01-01

    Gas-phase dehydration of glycerol to produce acrolein was investigated over commercial catalysts based onγ-Al2O3, viz. A-64, A-56, I-62, AP-10, AP-56, AP-64 and KR-104. To understand the effect of Cl−anions, HCl-impregnated sup-ports have been investigated in the dehydration reaction of glycerol at 375 °C. For comparison, various H-zeolites were also examined. It was found that the glycerol conversion over the solid acid catalysts was strongly dependent on their acidity and surface area. And the relationship between the catalytic activity and the acidity of the catalysts was discussed. The outstanding properties of Pt/γ-Al2O3 catalyst systems for the dehydration of glycerol were revealed. Pt/γ-Al2O3 catalyst (AP-64) showed the highest catalytic activity after 50 h of reaction with an acrolein selectivity of 65%at a conversion of glycerol of 90%. Based on these results, catalysts based onγ-Al2O3 appear to be most promising for gas phase dehydration of glycerol.

  11. A Durable Catalyst for Vapor Phase Nitration of Benzene with Nitric Acid

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Experimental results in this work demonstrate that PW12-H2SO4/SiO2 catalyst is a good and durable catalyst for vapor phase nitration of benzene to nitrobenzene (NB) using 65% nitric acid at normal pressure. It retains the advantages of using H2SO4 as catalyst and the addition of phosphotungstic acid holds back the effusion of sulfuric acid. This new catalyst keeps high activity (the conversion of HNO3 is more than 92%), high selectivity of NB (more than 97%) and high space time yield (STY 1.5 kg NB/kg cat.h) even after 150 h on stream, under condition of 423 K, SV=3200 ml/g h.

  12. A catalyst for the carbonylation of methanol to acetic acid in gaseous phase

    Institute of Scientific and Technical Information of China (English)

    潘平来; 柳忠阳; 朱长城; 袁国卿

    1996-01-01

    A novel Rh/Ys catalyst for the carbonylation of methanol to acetic acid in gaseous phase is reported. The porous carbon beads (Ys) prepared from the carbonation of poly(vinylidene chloride) were used as the support. This catalyst has a specific surface area of 1 000 m2/g, high mechanical strength and thermal stability. The average diameter of the pore is in the range of 0.8 - 1.2nm. Experimental evidence showed that this catalyst was of high activity and selectivity, which could compare to those of the homogeneous catalyst from Monsanto. The catalytic rate could get to 900 g AcOH/g Rh·h during the carbonylation of methanol to acetic acid. The fine spreading of Ph over the Ys surface is the key factor for the activity.

  13. Homogeneous catalysts supported on soluble polymers: biphasic Suzuki-Miyaura coupling of aryl chlorides using phase-tagged palladium-phosphine catalysts.

    Science.gov (United States)

    an der Heiden, Markus; Plenio, Herbert

    2004-04-02

    The Suzuki-Miyaura coupling of aryl chlorides and PhB(OH)(2) under biphasic conditions (DMSO/heptane) can be performed in almost quantitative yields over several cycles by means of polymeric Pd catalysts with soluble polyethylene glycol phase tags. Three sterically demanding and electron-rich phosphines 1-CH(2)Br,4-CH(2)P(1-Ad)(2)-C(6)H(4), and 2-PCy(2),2'-OH-biphenyl, and 2-PtBu(2),2'-OH-biphenyl were covalently bonded to 2000 Dalton MeOPEG-OH. The catalysts, which were formed in situ from Na(2)[PdCl(4)], the respective polymeric phosphine, KF/K(3)PO(4), and PhB(OH)(2), efficiently couple aryl chlorides at 80 degrees C at 0.5 mol % loading, resulting in a >90 % yield of the respective biphenyl derivatives. The use of polar phase tags allows the efficient recovery of palladium-phosphine catalysts by simple phase separation of the catalyst-containing DMSO solution and the product-containing n-heptane phase. The high activity (TOF) of the catalyst remains almost constant over more than five reaction cycles, which involve the catalytic reaction, separation of the product phase from the catalyst phase, and addition of new reactants to initiate the next cycle. The Buchwald type biphenyl phosphines form the most active Pd catalysts, which are 1.3-2.8 times more active than catalysts derived from diadamantyl-benzylphosphine, but appear to be less robust in the recycling experiments. There is no apparent leaching of the catalyst into the heptane solution (<0.05 %), as evidenced by spectrophotometric measurements, and contamination of the product with Pd is avoided.

  14. Fischer–Tropsch Synthesis: Effect of Reducing Agent for Aqueous-Phase Synthesis Over Ru Nanoparticle and Supported Ru Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Pendyala, Venkat Ramana Rao [Univ. of Kentucky, Lexington, KY (United States); Shafer, Wilson D. [Univ. of Kentucky, Lexington, KY (United States); Jacobs, Gary [Univ. of Kentucky, Lexington, KY (United States); Graham, Uschi M. [Univ. of Kentucky, Lexington, KY (United States); Khalid, Syed [Brookhaven National Lab. (BNL), Upton, NY (United States); Davis, Burtron H. [Univ. of Kentucky, Lexington, KY (United States)

    2014-12-27

    The effect of the reducing agent on the performance of a ruthenium nanoparticle catalyst was investigated during aqueous-phase Fischer–Tropsch synthesis using a 1 L stirred tank reactor in the batch mode of operation. For the purpose of comparison, the activity and selectivity of NaY zeolite supported Ru catalyst were also studied. NaBH4 and hydrogen were used as reducing agents in our study, and hydrogen reduced catalysts exhibited higher activities than the NaBH4 reduced catalysts, because of higher extent of reduction and a relatively lower tendency toward agglomeration of Ru particles. The Ru nanoparticle catalyst displayed higher activities than the NaY zeolite supported Ru catalyst for both reducing agents. NaBH4 reduced catalysts are less active and the carbon dioxide selectivity is higher than the hydrogen reduced catalysts. The activity of the supported Ru catalyst (Ru/NaY) was 75 % of that of the Ru nanoparticle catalyst, and has the benefit of easy wax/catalyst slurry separation by filtration. Finally, the hydrogen reduced supported Ru catalyst exhibited superior selectivity towards hydrocarbons (higher C5+ selectivity and lower selectivity to methane) than all other catalysts tested.

  15. Liquid phase conversion of Glycerol to Propanediol over highly active Copper/Magnesia catalysts

    Indian Academy of Sciences (India)

    Satyanarayana Murty Pudi; Abdul Zoeb; Prakash Biswas; Shashi Kumar

    2015-05-01

    In this work, a series of Cu/MgO catalysts with different copper metal loading were prepared by the precipitation-deposition method. Their catalytic behaviour was investigated for glycerol hydrogenolysis to 1,2-propanediol (1,2-PDO). The physico-chemical properties of the catalysts were characterized by various techniques such as BET surface area, X-ray diffraction (XRD), temperature programmed reduction (TPR), NH3-temperature programmed desorption (NH3-TPD) and scanning electron microscopy (SEM) methods. The characterization results showed that the copper metal was well-dispersed over MgO support and a new phase Cu-MgO was also identified from XRD results after calcination. The 25Cu/MgO (Cu:25 wt%) catalyst exhibited the highest glycerol conversion of 88.7% and 1,2-PDO selectivity of 91.7% at 210°C, 4.5MPa of hydrogen pressure after 12 h. The high glycerol conversion was mainly due to the Cu dispersion on MgO support and high acidic strength. Further, the effects of temperature, hydrogen pressure, catalyst loading and glycerol concentration were studied over 25Cu/MgO catalyst for optimization of reaction parameters. Kinetic study over highly active 25Cu/MgO catalyst showed that the reaction followed the pseudo second order rate with respect to glycerol and the apparent activation energy was found to be 28.7 ± 0.8 kcal/mol.

  16. Aqueous phase reforming of glycerol over nanosize Cu-Ni catalysts.

    Science.gov (United States)

    Kim, Ji Yeon; Kim, Seong Hak; Moon, Dong Ju; Kim, Jong Ho; Park, Nam Cook; Kim, Young Chul

    2013-01-01

    In this work, hydrogen production from glycerol by aqueous phase reforming (APR) is studied by using nanosize Ni-Cu catalysts supported on LaAlO3 perovskite in order to investigate the effects of the copper loading amount and the reaction conditions. Nanosize copper-promoted nickel-based catalysts were prepared by the precipitation method. The structure of the nanosize catalysts is characterized by XRD analysis. The surface area, morphology, dispersion and reducibility of the nanosize catalysts is examined by BET, TEM and TPR, respectively. It was found that 15Ni-5Cu/LaAlO3 catalyst showed the highest glycerol conversion and hydrogen selectivity. The highest activity found in the 15Ni-5Cu/LaAlO3 was attributed to it having the proper copper loading amount. It also has the lowest metal crystal size and the highest surface area, which have an effect on the catalytic activity and hydrogen selectivity. The 15Ni-5Cu/LaAlO3 catalyst showed the best performance for hydrogen production at a reaction temperature of 250 degrees C, a reaction pressure of 20 bar and a feed rate of 5 ml/h.

  17. Catalyst activity maintenance study for the liquid phase dimethyl ether process

    Energy Technology Data Exchange (ETDEWEB)

    Peng, X.D.; Toseland, B.A.; Underwood, R.P. [Air Products and Chemicals, Inc., Allentown, PA (United States)

    1995-12-31

    The co-production of dimethyl ether (DME) and methanol from syngas is a process of considerable commercial attractiveness. DME coproduction can double the productivity of a LPMEOH process when using coal-derived syngas. This in itself may offer chemical producers and power companies increased flexibility and more profitable operation. DME is also known as a clean burning liquid fuel; Amoco and Haldor-Topsoe have recently announced the use of DME as an alternative diesel fuel. Moreover, DME can be an interesting intermediate in the production of chemicals such as olefins and vinyl acetate. The current APCl liquid phase dimethyl ether (LPDME) process utilizes a physical mixture of a commercial methanol synthesis catalyst and a dehydration catalyst (e.g., {gamma}-alumina). While this arrangement provides a synergy that results in much higher syngas conversion per pass compared to the methanol-only process, the stability of the catalyst system suffers. The present project is aimed at reducing catalyst deactivation both by understanding the cause(s) of catalyst deactivation and by developing modified catalyst systems. This paper describes the current understanding of the deactivation mechanism.

  18. Supervised Classification Methods for Seismic Phase Identification

    Science.gov (United States)

    Schneider, Jeff; Given, Jeff; Le Bras, Ronan; Fisseha, Misrak

    2010-05-01

    The Comprehensive Nuclear Test Ban Treaty Organization (CTBTO) is tasked with monitoring compliance with the CTBT. The organization is installing the International Monitoring System (IMS), a global network of seismic, hydroacoustic, infrasound, and radionuclide sensor stations. The International Data Centre (IDC) receives the data from seismic stations either in real time or on request. These data are first processed on a station per station basis. This initial step yields discrete detections which are then assembled on a network basis (with the addition of hydroacoustic and infrasound data) to produce automatic and analyst reviewed bulletins containing seismic, hydroacoustic, and infrasound detections. The initial station processing step includes the identification of seismic and acoustic phases which are given a label. Subsequent network processing relies on this preliminary labeling, and as a consequence, the accuracy and reliability of automatic and reviewed bulletins also depend on this initial step. A very large ground truth database containing massive amounts of detections with analyst-reviewed labels is available to improve on the current operational system using machine learning methods. An initial study using a limited amount of data was conducted during the ISS09 project of the CTBTO. Several classification methods were tested: decision tree with bagging; logistic regression; neural networks trained with back-propagation; Bayesian networks as generative class models; naive Bayse classification; support vector machines. The initial assessment was that the phase identification process could be improved by at least 13% over the current operational system and that the method obtaining the best results was the decision tree with bagging. We present the results of a study using a much larger learning dataset and preliminary implementation results.

  19. Liquid phase catalytic hydrodebromination of tetrabromobisphenol A on supported Pd catalysts

    Science.gov (United States)

    Wu, Ke; Zheng, Mengjia; Han, Yuxiang; Xu, Zhaoyi; Zheng, Shourong

    2016-07-01

    Tetrabromobisphenol A (TBBPA) is a widely used brominated flame retardant and reductive debromination is an effective method for the abatement of TBBPA pollution. In this study, Pd catalysts supported on TiO2, CeO2, Al2O3 and SiO2 were prepared by the impregnation (the resulting catalyst denoted as im-Pd/support), deposition-precipitation (the resulting catalyst denoted as dp-Pd/support), and photo-deposition (the resulting catalyst denoted as pd-Pd/support) methods. The catalysts were characterized by N2 adsorption-desorption isotherm, X-ray diffraction, transmission electron microscopy, measurement of zeta potential, CO chemisorption, and X-ray photoelectron spectroscopy. The results showed that at an identical Pd loading amount (2.0 wt.%) Pd particle size in dp-Pd/TiO2 was much smaller than those in im-Pd/TiO2 and pd-Pd/TiO2. Pd particle size of the dp-Pd/TiO2 catalyst increased with Pd loading amount. Additionally, Pd particles in the dp-Pd/TiO2 catalysts were positively charged due to the strong metal-support interaction, whereas the cationization effect was gradually attenuated with the increase of Pd loading amount. For the liquid phase catalytic hydrodebromination (HDB) of TBBPA, tri-bromobisphenol A (tri-BBPA), di-bromobisphenol A (di-BBPA), and mono-bromobisphenol A (mono-BBPA) were identified as the intermediate products, indicative of a stepwise debromination process. The catalytic HDB of TBBPA followed the Langmuir-Hinshelwood model, reflecting an adsorption enhanced catalysis mechanism. At an identical Pd loading amount, the Pd catalyst supported on TiO2 exhibited a much higher catalytic activity than those on other supports. Furthermore, dp-Pd/TiO2 was found to be more active than im-Pd/TiO2 and pd-Pd/TiO2.

  20. System Identification for Experimental Study for Polymerization Catalyst Reaction in Fluidized Bed

    Directory of Open Access Journals (Sweden)

    Ahmmed Saadi Ibrehem

    2011-11-01

    Full Text Available In this work, system identification method is used to capture the reactor characteristics of production rate of polyethylene (PE based on published experimental data. The identification method is used to measure the percentage effect on the production rate of PE by measuring the effect of input factors of temperature of reaction, hydrogen concentration, and [Al]/[Ti] molar catalyst ratio. Temperature of reaction has big effects equal 52.4 % on the output of the system and 47.6 % on interaction of the system's parameters compare to other two factors. Also, hydrogen concentration has big effect equal 45.66 % on the output of the system and 14.7 % on interaction of the system's parameters. [Al]/[Ti] molar catalyst ratio has big effect on interaction of the system equal 28.6 and 1.94 % on the output of the system but less than the reaction temperature and hydrogen concentration. All these results depend on experiment results and these results are very important in industrial plants. ©2011 BCREC UNDIP. All rights reserved(Received: 13rd May 2011; Revised: 27th July 2011; Accepted: 22th September 2011[How to Cite: Ahmmed S. Ibrehem. (2011. System Identification for Experimental Study for Polymerization Catalyst Reaction in Fluidized Bed. Bulletin of Chemical Reaction Engineering & Catalysis, 6 (2: 137-146. doi:10.9767/bcrec.6.2.874.137-146][How to Link / DOI: http://dx,doi.org/10.9767/bcrec.6.2.874.137-146 || or local:  http://ejournal.undip.ac.id/index.php/bcrec/article/view/874 ] | View in 

  1. Liquid-phase Hydrogenation of Phenol to Cyclohexanone over Supported Palladium Catalysts

    Directory of Open Access Journals (Sweden)

    Lihui Fan

    2016-10-01

    Full Text Available The ZSM-5, g-Al2O3, SiO2 and MgO supported Pd-catalysts were prepared for the phenol hydrogenation to cyclohexanone in liquid-phase. The natures of these catalysts were characterized by XRD, N2 adsorption-desorption analysis, H2-TPR, CO2-TPD and NH3-TPD. The catalytic performance of the supported Pd-catalyst for phenol hydrogenation to cyclohexanone is closely related to nature of the support and the size of Pd nanoparticles. The Pd/MgO catalyst which possesses higher basicity shows higher cyclohexanone selectivity, but lower phenol conversion owing to the lower specific surface area. The Pd/SiO2 catalyst prepared by precipitation gives higher cyclohexanone selectivity and phenol conversion, due to the moderate amount of Lewis acidic sites, and the smaller size and higher dispersion of Pd nanoparticles on the surface. Under the reaction temperature of 135 oC and H2 pressure of 1 MPa, after reacting for 3.5 h, the phenol conversion of 71.62% and the cyclohexanone selectivity of 90.77% can be obtained over 0.5 wt% Pd/SiO2 catalyst. Copyright © 2016 BCREC GROUP. All rights reserved Received: 7th March 2016; Revised: 13rd May 2016; Accepted: 7th June 2016 How to Cite: Fan, L., Zhang, L., Shen, Y., Liu, D., Wahab, N., Hasan, M.M. (2016. Liquid-phase Hydrogenation of Phenol to Cyclohexanone over Supported Palladium Catalysts. Bulletin of Chemical Reaction Engineering & Catalysis, 11 (3: 354-362 (doi: 10.9767/bcrec.11.3.575.354-362 Permalink/DOI: http://doi.org/10.9767/bcrec.11.3.575.354-362

  2. Nanosized cobalt-based catalyst prepared by supercritical phase condition for Fischer-Tropsch synthesis

    Institute of Scientific and Technical Information of China (English)

    Jingmiao Li; Jingchang Zhang; Runduo Zhang; Weiliang Cao

    2009-01-01

    A series of nanosized Co/Zn/Mn/K composite catalysts for Fischer-Tropsch synthesis (FTS) were prepared by supercritical fluid drying (SCFD) method and common drying (CD) method. The nanosized cobalt-based catalysts were characterized by XRD,TEM and BET techniques. Their catalytic performances were tested in a slurry-bed reactor under FTS reaction conditions. The drying and crystallization were carded out simultaneously during SCFD,therefore,the catalysts prepared by SCFD method have ideal structure and show the FTS performance superior to the others prepared by CD method. The FTS activity and selectivity were improved via adding Zn,Mn and K promoters,and less CH_4 and CO_2 as well as higher yield of C~(5+) products were achieved. The optimal performance of a 92% CO conversion and a 65% C~(5+) product yield was obtained over a catalyst with the component of Co/Zn/Mn/K = 100/50/10/7. Furthermore,the catalytic performance was studied under the conditions of liquid-phase and supercriticai phase slurry-bed,and C~(5+) product yield were 57.4% and 65.4%,respectively. In summary,better catalytic performance was obtained using the nanosized catalyst prepared by SCFD method under supercritical reaction conditions,resulting in higher conversion of CO,less CO_2 byproduct,and higher yield of C~(5+) products,

  3. Catalyst screening for the hydrothermal gasification of aqueous phase of bio-oil

    NARCIS (Netherlands)

    Chakinala, A.G.; Chinthaginjala, J.K.; Seshan, K.; Swaaij, van W.P.M.; Kersten, S.R.A.; Brilman, D.W.F.

    2012-01-01

    The catalytic gasification in supercritical water of the water soluble fraction of bio-oil, either obtained directly by phase-separated pyrolysis-oil from ligno-cellulosic biomass or by hydrotreatment of that oil, is reported in this study. Several heterogeneous metal catalysts Pt, Pd, Ru, Rh, and N

  4. Hairy foam : thin layers of carbon nanofibers as catalyst support for liquid phase reactions

    NARCIS (Netherlands)

    Chinthaginjala, Jitendra Kumar

    2010-01-01

    Catalytic multiphase reactors are at the heart of many chemical industries. They allow efficient contact between gas and/or liquid reactant phases with solid catalysts increasing reaction rates. In practice, the higher reaction rates can be taken advantage of only under the condition that the transf

  5. Supported Rh-phosphine complex catalysts for continuous gas-phase decarbonylation of aldehydes

    DEFF Research Database (Denmark)

    Malcho, Phillip; Garcia-Suarez, Eduardo J.; Mentzel, Uffe Vie;

    2014-01-01

    Heterogeneous silica supported rhodium-phosphine complex catalysts are employed for the first time in the catalytic decarbonylation of aldehydes in continuous gas-phase. The reaction protocol is exemplified for the decarbonylation of p-tolualdehyde to toluene and further extended to other aromatic...

  6. Effect of initial nickel particle size on stability of nickel catalysts for aqueous phase reforming

    NARCIS (Netherlands)

    Haasterecht, Van Tomas; Swart, Marten; Jong, De Krijn P.; Bitter, J.H.

    2016-01-01

    The deactivation behavior by crystallite growth of nickel nanoparticles on various supports (carbon nanofibers, zirconia, SiC, α-Al2O3 and γ-Al2O3) was investigated in the aqueous phase reforming of ethylene glycol. Supported Ni catalysts of ∼10 wt% were prepared by impregnation of carbon nanofibers

  7. Syntheses of α-Hydroxyarylacetic Acids in the Presence of Different Phase Transfer Catalysts Under Sonication

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The syntheses of a-hydroxyarylacetic acids with a good yield in the presence of different phase transfer catalysts(PTC) under sonication were studied. The results obtained are superior to those by other similar methods. The data show that β-cyclodextrin(β-CD) is more efficient than other PTC. The preliminary reaction conditions are also discussed.

  8. Hairy foam : thin layers of carbon nanofibers as catalyst support for liquid phase reactions

    NARCIS (Netherlands)

    Chinthaginjala, J.K.

    2010-01-01

    Catalytic multiphase reactors are at the heart of many chemical industries. They allow efficient contact between gas and/or liquid reactant phases with solid catalysts increasing reaction rates. In practice, the higher reaction rates can be taken advantage of only under the condition that the

  9. Gas-Phase Oxidation of Aqueous Ethanol by Nanoparticle Vanadia/Anatase Catalysts

    DEFF Research Database (Denmark)

    Jørgensen, Betina; Kristensen, Steffen Buus; Kunov-Kruse, Andreas Jonas

    2009-01-01

    The gas-phase oxidation of aqueous ethanol with dioxygen has been examined with a new nanoparticle V2O5/TiO2 catalyst. Product selectivity could to a large extent be controlled by small alterations of reaction parameters, allowing production of acetaldehyde at a selectivity higher than 90%, near...

  10. Highly Selective Liquid-Phase Benzylation of Anisole with Solid-Acid Zeolite Catalysts

    DEFF Research Database (Denmark)

    Poreddy, Raju; Shunmugavel, Saravanamurugan; Riisager, Anders

    2015-01-01

    Zeolites were evaluated as solid acid catalysts for the liquid-phase benzylation of anisole with benzyl alcohol, benzyl bromide, and benzyl chloride at 80 °C. Among the examined zeolites, H-mordenite-10 (H-MOR-10) demonstrated particular high activity (>99 %) and excellent selectivity (>96...

  11. Mechanisms and modeling development of water transport/phase change in catalyst layers of portion exchange membrane fuel cells

    Energy Technology Data Exchange (ETDEWEB)

    Xiao, Yexiang [Dept. of Thermal Engineering, Tsinghua University Beijing (China)], email: Yexiang.Xiao@energy.lth.se; Yuan, Jinliang; Sunden, Bengt [Dept. of Energy Sciences, Faculty of Engineering, Lund University (Sweden)], email: Jinliang.yuan@energy.lth.se, email: bengt.sunden@energy.lth.se

    2011-07-01

    Research on proton exchange membrane fuel cells has shown that incorporation of nanosized catalysts can effectively increase active areas and catalyst activity and make a great contribution to development in performance and catalyst utilization. Multiphase transport processes are as significant and complicated as water generation/transfer processes which occur in nano-structured catalyst layers. A review project has been launched aimed at gaining a comprehensive understanding of the mechanisms of water generation or transport phenomena. It covers catalytic reactions and water-phase change within the catalyst layers. The review proceeds in three main stages: Firstly, it characterizes and reconstructs the nano/micro-structured pores and solid-phases; secondly, it emphasises the importance of sensitive and consistent analysis of various water-phase change and transport schemes; and thirdly, it recommends development of microscopic models for multi-phase transport processes in the pores and the solid phases.

  12. Stability and kinetic studies of supported ionic liquid phase catalysts for hydroformylation of propene

    DEFF Research Database (Denmark)

    Riisager, Anders; Fehrmann, Rasmus; Haumann, Marco;

    2005-01-01

    Supported ionic liquid phase (SILP) catalysts have been studied with regard to their long-term stability in the continuous gas-phase hydroformylation of propene. Kinetic data have been acquired by variation of temperature, pressure, syngas composition, substrate concentration, and residence time...... exceeded 200 h time on stream with no loss in selectivity. A small decrease in activity could be compensated by a vacuum procedure regaining the initial activity....

  13. Development of advanced zeolite catalysts for the vapor phase Beckmann rearrangement of cyclohexanone oxime

    Science.gov (United States)

    Dai, Lian-Xin; Iwaki, Yoshihide; Koyama, Katsuyuki; Tatsumi, Takashi

    1997-11-01

    The vapor phase Beckmann rearrangement of cyclohexanone oxime to ɛ-caprolactam catalyzed by various zeolites was studied. The catalytic performance was greatly affected by both the zeolite structure and diluent solvent. When 1-hexanol was used in place of benzene, the catalytic performance of all catalysts except silicalite-1 was greatly improved. In particular, the selectivity and stability of H-LTL and H-OFF-ERI zeolites remarkably increased; both catalysts exhibited ca. 100% oxime conversion and ɛ-caprolactam selectivity of >95% for 6 h.

  14. Thermoregulated Phase-separable Ru3(CO)12/PETPP Complex Catalyst for Hydrogenation of Styrene

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Thermoregulated phase-separable Ru3(CO)12/PETPP (PETPP=P[p-C6H4O (CH2CH2O)n H]3, n=6) complex catalyst was first applied in the hydrogenation of styrene. Under the conditions: P(H2)=2.0MPa, T=90(C, styrene could be completely transferred and the yield of ethylbenzene reached up to 99.5%. After simple decantation, the catalyst could be reused for ten times without decreasing in activity.

  15. Application of New Electrolyte Model to Phase Transfer Catalyst (PTC) Systems

    DEFF Research Database (Denmark)

    2015-01-01

    Abstract Phase transfer catalyst (PTC) is used to transfer the desirable active form of an anion from the aqueous phase to organic phase where the reaction occurs. One of major challenges for process design of the PTC system is to establish a reliable thermodynamic model capable of describing phase...... in PTC systems, thereby, extending the application range of the PTC-system model. The solubility of PTC in organic solvents, which is a key factor for strategy of PTC and solvent selection, has been calculated using the e-NRTL-SAC model....

  16. The Decomposition of Hydrazine in the Gas Phase and over an Iridium Catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Schmidt, Michael W. [Ames Laboratory; Gordon, Mark S. [Ames Laboratory

    2013-09-30

    Hydrazine is an important rocket fuel, used as both a monopropellant and a bipropellant. This paper presents theoretical results to complement the extensive experimental studies of the gas phase and Ir catalyzed decompositions involved in the monopropellant applications of hydrazine. Gas phase electronic structure theory calculations that include electron correlation predict that numerous molecular and free radical reactions occur within the same energy range as the basic free radical pathways: NN bond breaking around 65 kcal/mol and NH bond breaking around 81 kcal/mol. The data suggest that a revision to existing kinetics modeling is desirable, based on the energetics and the new elementary steps reported herein. A supported Ir-6 octahedron model for the Shell 405 Iridium catalyst used in thrusters was developed. Self-Consistent Field and electron correlation calculations (with core potentials and associated basis sets) find a rich chemistry for hydrazine on this catalyst model. The model catalyst provides dramatically lower NN and NH bond cleavage energies and an even smaller barrier to breaking the NH bond by NH2 abstractions. Thus, the low temperature decomposition over the catalyst is interpreted in terms of consecutive NH2 abstractions to produce ammonia and nitrogen. The higher temperature channel, which has hydrogen and nitrogen products, may be due to a mixture of two mechanisms. These two mechanisms are successive NH cleavages with surface H + H recombinations, and the same type of assisted H-2 eliminations found to occur in the gas phase part of this study.

  17. Residue Upgrading in Slurry Phase over Ultra-ifne NiMo/γ-Al2O3 Catalyst

    Institute of Scientific and Technical Information of China (English)

    Tong Fengya; Yang Qinghe; Li Dadong; Dai Lishun; Deng Zhonghuo

    2015-01-01

    In this article, residual oil hydroconversion was studied in slurry phase in the presence of ifne solid NiMo/γ-Al2O3 catalyst and the effects of operating conditions were carefully studied. The results showed that residue conversion was only affected by the reaction temperature and reaction time. The coke yield increased with a higher reaction temperature, a bigger catalyst particle size, a longer reaction time, a lower initial hydrogen pressure and a lower catalyst concentration. Hetero-atoms removal rate increased with a higher reaction temperature, a longer reaction time, a higher initial hydrogen pressure, a higher catalyst concentration, and a smaller catalyst particle size. The role of catalyst in the slurry bed technology was discussed and its function could be stated as follows:the metal was applied to activate the hydrogen atoms for removing heteroatoms and saturating aromatics, while the support of the catalyst was used to prevent the mesophase coalescence for reducing coke formation.

  18. Improving Heterogeneous Catalyst Stability for Liquid-phase Biomass Conversion and Reforming.

    Science.gov (United States)

    Héroguel, Florent; Rozmysłowicz, Bartosz; Luterbacher, Jeremy S

    2015-01-01

    Biomass is a possible renewable alternative to fossil carbon sources. Today, many bio-resources can be converted to direct substitutes or suitable alternatives to fossil-based fuels and chemicals. However, catalyst deactivation under the harsh, often liquid-phase reaction conditions required for biomass treatment is a major obstacle to developing processes that can compete with the petrochemical industry. This review presents recently developed strategies to limit reversible and irreversible catalyst deactivation such as metal sintering and leaching, metal poisoning and support collapse. Methods aiming to increase catalyst lifetime include passivation of low-stability atoms by overcoating, creation of microenvironments hostile to poisons, improvement of metal stability, or reduction of deactivation by process engineering.

  19. Carbon-supported bimetallic Pd–Fe catalysts for vapor-phase hydrodeoxygenation of guaiacol

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Junming; Karim, Ayman M.; Zhang, He; Kovarik, Libor; Li, Xiaohong Shari; Hensley, Alyssa J.; McEwen, Jean-Sabin; Wang, Yong

    2013-10-01

    Abstract Carbon supported metal catalysts (Cu/C, Fe/C, Pd/C, Pt/C, PdFe/C and Ru/C) have been prepared, characterized and tested for vapor-phase hydrodeoxygenation (HDO) of guaiacol (GUA) at atmospheric pressure. Phenol was the major intermediate on all catalysts. Over the noble metal catalysts saturation of the aromatic ring was the major pathway observed at low temperature (250 °C), forming predominantly cyclohexanone and cyclohexanol. Substantial ring opening reaction was observed on Pt/C and Ru/C at higher reaction temperatures (e.g., 350 °C). Base metal catalysts, especially Fe/C, were found to exhibit high HDO activity without ring-saturation or ring-opening with the main products being benzene, phenol along with small amounts of cresol, toluene and trimethylbenzene (TMB). A substantial enhancement in HDO activity was observed on the PdFe/C catalysts. Compared with Fe/C, the yield to oxygen-free aromatic products (i.e., benzene/toluene/TMB) on PdFe/C increased by a factor of four at 350 °C, and by approximately a factor of two (83.2% versus 43.3%) at 450 °C. The enhanced activity of PdFe/C is attributed to the formation of PdFe alloy as evidenced by STEM, EDS and TPR.

  20. Vapour-phase O-methylation of Catechol with Methanol on Ti-containing Phosphate Catalysts

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Ti-containing phosphate(Ti-P-O) catalysts with different molar ratios of P to Ti(0-2.0) were synthesized and characterized by XRD, N2-adsorption/desorption, IR and temperature-programmed desorption(TPD) methods. The catalytic properties of Ti-P-O samples in the vapor-phase O-methylation of catechol with methanol were also studied. The catechol conversion increases with the increase of the molar ratio of P to Ti in a range of 0-0.33, while a further increase in the P content leads to a decrease of the catalytic activity. Meanwhile, the selectivities of the catalysts to the main product(guaiacol) increase gradually with the increase of the molar ratio of P to Ti. The presence of relatively strong Lewis acidic and/or basic sites in the P-free catalyst should be responsible for the formation of C-alkylation products. The weak acid-base characteristics of the catalysts are favourable for the mono-O-methylation of catechol. In comparison with the Lewis acidic sites, the Br(o)nsted acidic sites on the catalysts are more active for the title reaction.

  1. Nickel and cobalt as active phase on supported zirconia catalysts for bio-ethanol reforming: Influence of the reaction mechanism on catalysts performance

    Energy Technology Data Exchange (ETDEWEB)

    Padilla, R.; Rodriguez, L.; Serrano, A.; Munoz, G. [Instituto de Catalisis y Petroleoquimica (CSIC), C/ Marie Curie 2, Campus Cantoblanco, 28049 Madrid (Spain); Benito, M.; Daza, L. [Instituto de Catalisis y Petroleoquimica (CSIC), C/ Marie Curie 2, Campus Cantoblanco, 28049 Madrid (Spain); Centro de Investigaciones Energeticas Medioambientales y Tecnologicas (CIEMAT), Av. Complutense 22, 28040 Madrid (Spain)

    2010-09-15

    Steam reforming of ethanol for hydrogen production was investigated on Co/ZrO{sub 2} and Ni/ZrO{sub 2} catalysts promoted with lanthana. Catalysts were prepared by impregnation method and characterized by XRD and TPR. TPD-R experiments were also carried out to determine the role of active phase on reaction mechanism. The results suggest that adsorbed ethanol is dehydrogenated to acetaldehyde producing hydrogen. Then, the adsorbed acetaldehyde may evolve by different mechanisms, depending on the nature of active phase. On one hand, in cobalt-based catalyst, acetaldehyde could be reformed directly. By acetaldehyde thermal decomposition, methyl and formaldehyde groups are obtained. By coupling of methyl groups, ethane can be obtained. At medium temperature range, WGS reaction contribution is noteworthy. On the other hand, in nickel-based catalyst, acetone was detected in a higher temperature range as the main intermediate reaction product, which indicates that acetaldehyde is transformed into acetone by decarbonylation of acetaldehyde leading to H{sub 2} and CO{sub 2} formation. In addition, acetone can also be reformed to give both H{sub 2} and CO{sub 2}. Contrary to cobalt-based catalyst, ethylene was detected at intermediate range temperature which suggests that it was formed by ethanol dehydration reaction. Ethylene polymerization could easily explain coke formation, which must be avoided. Steam reforming reaction was studied at S/C ratio of 4.84 and 700 C, to verify the activity, selectivity and stability of the catalysts. Ethanol conversion reached 100% and catalysts were very stable for almost 50 h on stream. No significant differences were detected in both catalysts. Nevertheless, TPO experiments performed on used samples demonstrate a higher carbon production on nickel based catalyst that can be correlated to ethanol dehydration contribution on it reaction pathway. (author)

  2. Identification of carbon-encapsulated iron nanoparticles as active species in non-precious metal oxygen reduction catalysts

    Science.gov (United States)

    Varnell, Jason A.; Tse, Edmund C. M.; Schulz, Charles E.; Fister, Tim T.; Haasch, Richard T.; Timoshenko, Janis; Frenkel, Anatoly I.; Gewirth, Andrew A.

    2016-08-01

    The widespread use of fuel cells is currently limited by the lack of efficient and cost-effective catalysts for the oxygen reduction reaction. Iron-based non-precious metal catalysts exhibit promising activity and stability, as an alternative to state-of-the-art platinum catalysts. However, the identity of the active species in non-precious metal catalysts remains elusive, impeding the development of new catalysts. Here we demonstrate the reversible deactivation and reactivation of an iron-based non-precious metal oxygen reduction catalyst achieved using high-temperature gas-phase chlorine and hydrogen treatments. In addition, we observe a decrease in catalyst heterogeneity following treatment with chlorine and hydrogen, using Mössbauer and X-ray absorption spectroscopy. Our study reveals that protected sites adjacent to iron nanoparticles are responsible for the observed activity and stability of the catalyst. These findings may allow for the design and synthesis of enhanced non-precious metal oxygen reduction catalysts with a higher density of active sites.

  3. Identification of carbon-encapsulated iron nanoparticles as active species in non-precious metal oxygen reduction catalysts.

    Science.gov (United States)

    Varnell, Jason A; Tse, Edmund C M; Schulz, Charles E; Fister, Tim T; Haasch, Richard T; Timoshenko, Janis; Frenkel, Anatoly I; Gewirth, Andrew A

    2016-08-19

    The widespread use of fuel cells is currently limited by the lack of efficient and cost-effective catalysts for the oxygen reduction reaction. Iron-based non-precious metal catalysts exhibit promising activity and stability, as an alternative to state-of-the-art platinum catalysts. However, the identity of the active species in non-precious metal catalysts remains elusive, impeding the development of new catalysts. Here we demonstrate the reversible deactivation and reactivation of an iron-based non-precious metal oxygen reduction catalyst achieved using high-temperature gas-phase chlorine and hydrogen treatments. In addition, we observe a decrease in catalyst heterogeneity following treatment with chlorine and hydrogen, using Mössbauer and X-ray absorption spectroscopy. Our study reveals that protected sites adjacent to iron nanoparticles are responsible for the observed activity and stability of the catalyst. These findings may allow for the design and synthesis of enhanced non-precious metal oxygen reduction catalysts with a higher density of active sites.

  4. Selective liquid-phase oxidation of alcohols catalyzed by a silver-based catalyst promoted by the presence of ceria

    DEFF Research Database (Denmark)

    Beier, Matthias Josef; Hansen, Thomas Willum; Grunwaldt, Jan-Dierk

    2009-01-01

    A number of silver catalysts supported on SiO2, Al2O3, Celite, CeO2, kaolin, MgO, and activated carbon were screened for their catalytic activity in the selective liquid-phase oxidation of benzyl alcohol using a special screening approach. For this purpose 5–6 catalyst samples were mixed and tested...

  5. A Systematic Modelling Framework for Phase Transfer Catalyst Systems

    DEFF Research Database (Denmark)

    Anantpinijwatna, Amata; Sales-Cruz, Mauricio; Hyung Kim, Sun

    2016-01-01

    in an aqueous phase. These reacting systems are receiving increased attention as novel organic synthesis options due to their flexible operation, higher product yields, and ability to avoid hazardous or expensive solvents. Major considerations in the design and analysis of PTC systems are physical and chemical...... equilibria, as well as kinetic mechanisms and rates. This paper presents a modelling framework for design and analysis of PTC systems that requires a minimum amount of experimental data to develop and employ the necessary thermodynamic and reaction models and embeds them into a reactor model for simulation....... The application of the framework is made to two cases in order to highlight the performance and issues of activity coefficient models for predicting design and operation and the effects when different organic solvents are employed....

  6. Predictive Modelling of Phase-Transfer Catalyst Systems for Improved and Innovative Design

    DEFF Research Database (Denmark)

    Anantpinijwatna, Amata; Hyung Kim, Sun; Sales-Cruz, Mauricio

    2016-01-01

    increasing attention as a novel organic synthesis option due to its flexible and easier operation, higher production yield, and ability to eliminate expensive solvents, although, not eliminating the use of solvents. New mathematical models of the PTC system, which includes physical and chemical equilibrium......Phase-transfer catalyst (PTC) systems contain two immiscible liquid phases with a heterogeneous PTC transferring active ion from one phase to the other for converting the reactant to the desired product, and in the process generating the inactive ion. This type of reacting systems is receiving......, reaction mechanism and unit operation has been developed. In the developed model, the PTC system is divided into four sub-systems of aqueous-organic solvent partition, inorganic salt in aqueous phase, PTC in aqueous phase, and PTC in aqueous phase. Each subsystem requires an appropriate thermodynamic model...

  7. Studies on the Recycling Efficiency of Thermoregulated Phase-separable Rh/PETPP Complex Catalyst

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    Effects on the recycling effieieney of thermoregulated phase-separable Rh/PETPP (P-[p-C6H4O(CH2CH2O)nH]3, N=3n) complex catalyst involved in hydroformylation of 1-decene are for the first time presented. It was found that the loss of Rh is dependent greatly on the composition of phosphine ligand PETPP and the organic solvent employed in the reaetion.

  8. A facile and convenient method for synthesis of alkyl thiocyanates under homogeneous phase transfer catalyst conditions

    Institute of Scientific and Technical Information of China (English)

    Ali Reza Kiasat; Rashid Badri; Soheil Sayyahi

    2008-01-01

    A simple and environmentally friendly method is described for the efficient conversion of alkyl halide to alkyl thiocyanate using tetrabutylammonium bromide (TBAB) as a phase transfer catalyst.The reactions occur in water and furnish the corresponding alkyl thiocyanate in high yields.No evidence for the formation of isothiocyanates as by-product of the reaction was observed and the products were obtained in pure form without further purification.

  9. Direct Vapor Phase Carbonylation of Methanol over NiCl2/C Catalyst

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    @@ Introduction The carbonylation of alcohols via homogenous catalysis is important in manufacturing acetic acid and higher carboxylic acids and their esters[1,2]. The main route to produce acetic acid is to make methanol carbonylated by means of the Monsanto and BP process in which a homogeneous rhodium catalyst is used. Although the homogeneous carbonylation of methanol is a highly selective process, it is affected by the disadvantages associated with a highly corrosive reaction medium due to the use of methyl iodide as the promoter, and the difficulty of the product separation[3]. The use of a heterogeneous catalyst seems very interesting and attractive to us[4], especially the direct vapor phase carbonylation of methanol without a halide promoter is of considerable importance and is strong incentive economically. There has, however, been very little success in finding either heterogeneous or homogeneous catalysts that can catalyze the reaction effectively without the addition of a promoter[5,6]. According to the known carbonylation mechanism[7,8], the methyl iodide directly carbonylates with CO to from MeCOI which interacts with methanol(MeOH) to produce methyl acetate(MeCOOMe) and HI, and then MeOH reacts with HI to from CH3I. In fact, this carbonylation reaction is the indirect catalytic carbonylation of methanol[9]. In this work, a novel catalyst for the direct vapor phase carbonylation of methanol without the addition of any halide in the feed as a promoter was investigated. Compared to the known liquid phase methanol carbonylation process, some advantages of this vapor phase reaction are as follows:

  10. Vapour phase dehydration of glycerol to acrolein over tungstated zirconia catalysts

    Science.gov (United States)

    Rao Ginjupalli, Srinivasa; Mugawar, Sowmya; Rajan N., Pethan; Kumar Balla, Putra; Chary Komandur, V. R.

    2014-08-01

    Tetragonal (TZ) and monoclinic (MZ) polymorphs of zirconia supports were synthesised by sol-gel method followed by variation of the calcination temperature. Tungstated (10 wt% WO3) supported on the zirconia polymorphs were prepared by impregnation method by using ammonium metatungstate precursor. The physico-chemical properties of the calcined catalysts were characterised by X-ray diffraction, UV-vis diffused reflectance spectroscopy, X-ray photoelectron spectroscopy (XPS), surface area and pore size distribution measurements to gain insight into the effect of morphology of the catalyst textural properties, and structure. The surface acidic properties have been determined by NH3 TPD method and also with FT-IR spectra of pyridine adsorption. Vapour phase dehydration of glycerol to acrolein was employed to investigate the catalytic functionalities. Glycerol conversion and acrolein selectivity was mainly dependent on the fraction of moderate acid sites with majority of them are due to Brønsted acidic sites. Monoclinic zirconia based catalysts have shown the highest activity and acrolein selectivity compared to the corresponding tetragonal zirconia catalysts.

  11. Vapour phase dehydration of glycerol to acrolein over tungstated zirconia catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Rao Ginjupalli, Srinivasa; Mugawar, Sowmya; Rajan, Pethan N.; Kumar Balla, Putra; Chary Komandur, V.R., E-mail: kvrchary@iict.res.in

    2014-08-01

    Tetragonal (TZ) and monoclinic (MZ) polymorphs of zirconia supports were synthesised by sol–gel method followed by variation of the calcination temperature. Tungstated (10 wt% WO{sub 3}) supported on the zirconia polymorphs were prepared by impregnation method by using ammonium metatungstate precursor. The physico-chemical properties of the calcined catalysts were characterised by X-ray diffraction, UV–vis diffused reflectance spectroscopy, X-ray photoelectron spectroscopy (XPS), surface area and pore size distribution measurements to gain insight into the effect of morphology of the catalyst textural properties, and structure. The surface acidic properties have been determined by NH{sub 3} TPD method and also with FT-IR spectra of pyridine adsorption. Vapour phase dehydration of glycerol to acrolein was employed to investigate the catalytic functionalities. Glycerol conversion and acrolein selectivity was mainly dependent on the fraction of moderate acid sites with majority of them are due to Brønsted acidic sites. Monoclinic zirconia based catalysts have shown the highest activity and acrolein selectivity compared to the corresponding tetragonal zirconia catalysts.

  12. Highly dispersed CoMoS phase on titania nanotubes as efficient HDS catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Cortes-Jacome, M.A.; Escobar, J.; Angeles Chavez, C.; Lopez-Salinas, E.; Romero, E.; Ferrat, G.; Toledo-Antonio, J.A. [Molecular Engineering Program, Instituto Mexicano del Petroleo, Eje Central Lazaro Cardenas 152, San Bartolo Atepehuacan, G.A. Madero, 07730 Mexico, D.F. (Mexico)

    2008-01-15

    Nanotubular titania (NT) to be used as support for CoMo-based hydrodesulfurization (HDS) catalyst was synthesized and characterized by various techniques. NT annealed at 400 C (under nitrogen) was constituted by nanotubes of {proportional_to}5.5 nm (internal diameter) and retained 236 m{sup 2}/g of surface area. Mo at 3 atoms/nm{sup 2} (nominal loading) and cobalt at Co/(Co + Mo) = 0.3 were impregnated under nearly neutral, acidic or basic media. By XPS analyses of NT-supported sulfided catalysts, highly dispersed MoS{sub 2} particles of low stacking degree (1-2 slabs) aligned along the nanotubes were observed by HR-TEM in all sulfided materials. The CoMo catalysts supported on nanostructured titania had dibenzothiophene (DBT) HDS activity (in pseudo first order kinetic constant basis) values {proportional_to}1.35 and {proportional_to}1.7 times (Mo impregnated under near neutral and basic media, respectively) higher to that of a commercial reference with alumina carrier. According to shifts to higher binding energy of the Co 2p peak corresponding to sulfided cobalt (as determined by XPS), MoS{sub 2} dispersed on NT support could be efficiently promoted by Co (''CoMoS'' phase formation), opening the possibility of developing new highly active HDS catalysts. (author)

  13. Zirconia supported catalysts for bioethanol steam reforming: Effect of active phase and zirconia structure

    Energy Technology Data Exchange (ETDEWEB)

    Benito, M.; Padilla, R.; Rodriguez, L.; Sanz, J.L.; Daza, L. [Instituto de Catalisis y Petroleoquimica (CSIC), C/ Marie Curie 2, Campus Cantoblanco, 28049 Madrid (Spain)

    2007-06-10

    Three new catalysts have been prepared in order to study the active phase influence in ethanol steam reforming reaction. Nickel, cobalt and copper were the active phases selected and were supported on zirconia with monoclinic and tetragonal structure, respectively. To characterize the behaviour of the catalysts in reaction conditions a study of catalytic activity with temperature was performed. The highest activity values were obtained at 973 K where nickel and cobalt based catalysts achieved an ethanol conversion of 100% and a selectivity to hydrogen close to 70%. Nickel supported on tetragonal zirconia exhibited the highest hydrogen production efficiency, higher than 4.5 mol H{sub 2}/mol EtOH fed. The influence of steam/carbon (S/C) ratio on product distribution was another parameter studied between the range 3.2-6.5. Nickel supported on tetragonal zirconia at S/C = 3.2 operated at 973 K without by-product production such as ethylene or acetaldehyde. In order to consider a further application in an ethanol processor, a long-term reaction experiment was performed at 973 K, S/C = 3.2 and atmospheric pressure. After 60 h, nickel supported on tetragonal zirconia exhibited high stability and selectivity to hydrogen production. (author)

  14. The interfacial polycondensation of tetrabromobisphenol-a polycarbonate. 2--Reactivities and phase distribution of catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Jentau Gu (China Technical Consultants Inc., Miaoli (Taiwan, Province of China). Catalyst Research Center); Chunshan Wang (National Cheng-Kung Univ., Tainan (Taiwan, Province of China). Dept. of Chemical Engineering)

    1993-10-05

    Tetrabromobisphenol-A (TBBPA), a sterically hindered bisphenol, is known to give only low molecular weight polymers using the interfacial process. The low reactivity is attributed to the bulkiness and electron-withdrawing bromine substituents at the ortho positions. The optimum reaction conditions for the interfacial polymerization of TBBPA using pyridine derivatives as a catalyst have been developed. From the two-phase concentration distribution constant (K[sub e]) and p K's values of triethylamine, 4-dimethylaminopyridine (DMAP), and TBBPA, the critical process parameters were obtained. Because of its high nucleophilicity and facile leaving character, the DMAP catalyst system produces a high molecular weight TBBPA-polycarbonate (PC) successfully. The profile of the process was followed to obtain a better understanding of the reaction mechanism.

  15. Using soluble polymers to enforce catalyst-phase-selective solubility and as antileaching agents to facilitate homogeneous catalysis.

    Science.gov (United States)

    Liang, Yannan; Harrell, Mary L; Bergbreiter, David E

    2014-07-28

    The enforced phase-selective solubility of polyisobutylene (PIB)-bound Rh(II) catalysts in biphasic heptane/acetonitrile mixtures can be used not only to recycle these catalysts but also to minimize bimolecular reactions with ethyl diazoacetate. When cyclopropanation and O-H insertion reactions are carried out with PIB-bound Rh(II) catalysts either with or without addition of an unfunctionalized hydrocarbon polymer cosolvent, dimer by-product formation is suppressed even without slow syringe pump addition of the ethyl diazoacetate. This suppression of by-product formation is shown to be due to increased phase segregation of the soluble polymer-bound catalyst and the ethyl diazoacetate reactant. These studies also reveal that added hydrocarbon polymer cosolvents can function as antileaching agents, decreasing the already small amount of a soluble polymer-bound species that leaches into a polar phase in a biphasic mixture during a liquid/liquid separation step.

  16. Synthesis and Reactions of Five-Membered Heterocycles Using Phase Transfer Catalyst (PTC Techniques

    Directory of Open Access Journals (Sweden)

    Ahmed M. El-Sayed

    2014-01-01

    Full Text Available Phase transfer catalysts (PTCs have been widely used for the synthesis of organic compounds particularly in both liquid-liquid and solid-liquid heterogeneous reaction mixtures. They are known to accelerate reaction rates by facilitating formation of interphase transfer of species and making reactions between reagents in two immiscible phases possible. Application of PTC instead of traditional technologies for industrial processes of organic synthesis provides substantial benefits for the environment. On the basis of numerous reports it is evident that phase-transfer catalysis is the most efficient way for generation and reactions of many active intermediates. In this review we report various uses of PTC in syntheses and reactions of five-membered heterocycles compounds and their multifused rings.

  17. Fischer-Tropsch Reaction Kinetics of Cobalt Catalyst in Supercritical Phase

    Institute of Scientific and Technical Information of China (English)

    Abdullah Irankhah; Ali Haghtalab; Ebrahim Vasheghani Farahani; Kambiz Sadaghianizadeh

    2007-01-01

    Fischer-Tropsch synthesis under supercritical phase condition was examined in a continuous and a high-pressure fixed bed reactor by employing a cobalt catalyst (Co-Ru/γ-Al2O3). An integral reactor model involving Fischer-Tropsch reaction kinetics in the supercritical fluid n-hexane was used to describe the overall performance. On the basis of Langmuir-Hinshelwood-Hougen-Watson (LHHW) model, the reaction rate constants were obtained for the rate equations of CO conversion to CH4 formation under supercritical conditions.

  18. An innovative catalyst system for slurry-phase Fischer-Tropsch synthesis: Cobalt plus a water-gas-shift catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Satterfield, C.N.; Yates, I.C.; Chanenchuk, C.

    1991-07-01

    The feasibility of using a mechanical mixture of a Co/MgO/SiO{sub 2} Fischer-Tropsch catalyst and a Cu-ZnO/Al{sub 2}O{sub 3} water-gas-shift (WGS) catalyst for hydrocarbon synthesis in a slurry reactor has been established. Such a mixture can combine the superior product distribution from cobalt with the high activity for the WGS reaction characteristic of iron. Weight ratios of Co/MgO/SiO{sub 2} to Cu-ZnO/Al{sub 2}O{sub 3} of 0.27 and 0.51 for the two catalysts were studied at 240{degrees}C, 0.79 MPa, and in situ H{sub 2}/CO ratios between 0.8 and 3.0. Each catalyst mixture showed stable Fischer-Tropsch activity for about 400 hours-on-stream at a level comparable to the cobalt catalyst operating alone. The Cu-ZnO/Al{sub 2}O{sub 3} catalyst exhibited a very slow loss of activity under these conditions, but when operated alone it was stable in a slurry reactor at 200--220{degrees}C, 0.79--1.48 MPa, and H{sub 2}/CO in situ ratios between 1.0 and 2.0. The presence of the water-gas-shift catalyst did not affect the long-term stability of the primary Fischer-Tropsch selectivity, but did increase the extent of secondary reactions, such as l-alkene hydrogenation and isomerization.

  19. Certain aspects of the formation and identification of nanosized oxide components in heterogeneous catalysts prepared by different methods

    Energy Technology Data Exchange (ETDEWEB)

    Ellert, Ol' ga G; Novotortsev, Vladimir M [N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Moscow (Russian Federation); Tsodikov, Mark V [A.V. Topchiev Institute of Petrochemical Synthesis, Russian Academy of Sciences, Moscow (Russian Federation)

    2010-10-19

    The results of studies into the relationship 'methods and synthesis conditions of a catalyst{yields}catalyst structure{yields}catalytic properties' in highly efficient crystallo-graphically amorphous copper- and iron-containing heterogeneous systems obtained by different chemical methods are generalized. Polymorphism of active phases and catalytic properties of nanostructured copper-containing zinc, zirconium, manganese and cerium oxides are discussed. Unusual transformations of nanosized Pt- and Pd-containing components on the {gamma}-Al{sub 2}O{sub 3} surface in nanostructured catalysts of ethanol steam reforming into synthesis gas and reductive dehydration of ethanol to alkanes are considered. The results of comparative studies on the crystallographically amorphous mixed iron oxide catalysts synthesized by either the alkoxy method or the deposition on various supports obtained by the Moessbauer and XAFS spectroscopy and magnetic susceptibility measurements are presented. These materials are shown to be efficient catalysts of important processes such as liquid-phase oxidation of hydrocarbons, synthesis of alkenes and alkylaromatic hydrocarbons from CO and H{sub 2}, hydrogenative transformation of brown coal organic mass to hydrocarbons.

  20. Propene Hydroformylation by Supported Aqueous-phase Rh-NORBOS Catalysts

    DEFF Research Database (Denmark)

    Riisager, Anders; Eriksen, Kim Michael; Hjortkjær, Jes

    2003-01-01

    (acac)(CO)(2) and NORBOS ligand. Catalytic performance of silica gel-based catalysts was examined by altering catalyst composition and reaction conditions. Results were compared to analogous TPPTS catalysts and to catalysts supported on alternative support materials, e.g. silica glass, alumina and carbon...

  1. Desulfurization of coal: enhanced selectivity using phase transfer catalysts. Quarterly report, March 1 - May 31, 1996

    Energy Technology Data Exchange (ETDEWEB)

    Palmer, S.R.; Hippo, E.J. [Southern Illinois Univ., Carbondale, IL (United States)

    1996-12-31

    Due to environmental problems related to the combustion of high sulfur Illinois coal, there continues to be interest in the development in viable pre-combustion desulfurization processes. Recent studies by the authors have obtained very good sulfur removals but the reagents that are used are too expensive. Use of cheaper reagents leads to a loss of desired coal properties. This study investigated the application phase transfer catalysts to the selective oxidation of sulfur in coal using air and oxygen as oxidants. The phase transfer catalyst is expected to function as a selectivity moderator by permitting the use of milder reaction conditions that otherwise necessary. This would enhance the sulfur selectivity and help retain the heating value of the coal. The use of certain coal combustion wastes for desulfurization, and the application of cerium (IV) catalyzed air oxidation for selective sulfur oxidation are also being studied. If successful, this project could lead to the rapid development of a commercially viable desulfurization process. This would significantly improve the marketability of Illinois coal.

  2. Continuous gas-phase hydroformylation of 1-butene using supported ionic liquid phase (SILP) catalysts

    DEFF Research Database (Denmark)

    Haumann, Marco; Dentler, Katharina; Joni, Joni;

    2007-01-01

    The concept of supported ionic liquid phase (SILP) catalysis has been extended to 1-butene hydroformylation. A rhodium-sulfoxantphos complex was dissolved in [BMIM][n-C8H17OSO3] and this solution was highly dispersed on silica. Continuous gas-phase experiments in a fixed-bed reactor revealed...

  3. Activity and selectivity of palladium catalysts during the liquid-phase hydrogenation of phenol. Influence of temperature and pressure

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez-Velasco, J.R.; Gonzalez-Marcos, M.P.; Arnaiz, S.; Gutierrez-Ortiz, J.I.; Gutierrez-Ortiz, M.A. [Univ. del Pais Vasco, Bilbao (Spain)

    1995-04-01

    Two series of highly dispersed palladium catalysts supported on alumina have been prepared by adsorption from solution, with palladium contents varying from 0.25 to 2.0 wt %. The first series was calcined at 773 K for 4 h in air, whereas the second series was just heated at 423 K for 1 h in nitrogen, before reduction. Complete dispersion of the metal has been found for the calcined catalysts, and metal dispersion was favored with low palladium contents for the noncalcined catalysts. The kinetic behavior of the catalysts has been analyzed for the liquid-phase hydrogenation of phenol in a stirred tank reactor, ensuring a chemically controlled regime for stirring speed above 750 rpm and catalyst particle below 0.08--0.16 mm in the studied conditions. Despite their higher metallic dispersion, the calcined catalysts presented lower activity than their corresponding noncalcined catalysts. The influence of hydrogen partial pressure on activity showed a reaction order of 2. The apparent activation energy resulted in 56.8 kJ/mol. Selectivity to cyclohexanone was found to be very high for all experiments. Some conclusions on the kinetic reaction rate equations and the apparent activation energies of phenol to cyclohexanone and cyclohexanone to cyclohexanol are given.

  4. Identification of non-precious metal alloy catalysts for selective hydrogenation of acetylene

    DEFF Research Database (Denmark)

    Studt, Felix; Abild-Pedersen, Frank; Bligaard, Thomas

    2008-01-01

    The removal of trace acetylene from ethylene is performed industrially by palladium hydrogenation catalysts ( often modified with silver) that avoid the hydrogenation of ethylene to ethane. In an effort to identify catalysts based on less expensive and more available metals, density functional...... calculations were performed that identified relations in heats of adsorption of hydrocarbon molecules and fragments on metal surfaces. This analysis not only verified the facility of known catalysts but identified nickel- zinc alloys as alternatives. Experimental studies demonstrated that these alloys...

  5. Reduction of Furfural to Furfuryl Alcohol in Liquid Phase over a Biochar-Supported Platinum Catalyst

    Directory of Open Access Journals (Sweden)

    Ariadna Fuente-Hernández

    2017-02-01

    Full Text Available In this work, the liquid phase hydrogenation of furfural has been studied using a biochar-supported platinum catalyst in a batch reactor. Reactions were performed between 170 °C and 320 °C, using 3 wt % and 5 wt % of Pt supported on a maple-based biochar under hydrogen pressure varying from 500 psi to 1500 psi for reaction times between 1 h and 6 h in various solvents. Under all reactive conditions, furfural conversion was significant, whilst under specific conditions furfuryl alcohol (FA was obtained in most cases as the main product showing a selectivity around 80%. Other products as methylfuran (MF, furan, and trace of tetrahydrofuran (THF were detected. Results showed that the most efficient reaction conditions involved a 3% Pt load on biochar and operations for 2 h at 210 °C and 1500 psi using toluene as solvent. When used repetitively, the catalyst showed deactivation although only a slight variation in selectivity toward FA at the optimal experimental conditions was observed.

  6. Aqueous phase hydrogenolysis of glycerol to bio-propylene glycol over Pt-Sn catalysts.

    Science.gov (United States)

    Barbelli, Maria L; Santori, Gerardo F; Nichio, Nora N

    2012-05-01

    PtSn supported on SiO(2) obtained via surface organometallic chemistry techniques catalyzes hydrogenolysis of glycerol to obtain bio-propylene glycol (PG). Bimetallic catalysts with Sn contents between 0.1% and 1% wt were carefully prepared by selective hydrogenolysis of Sn(n-C(4)H(9))(4) on Pt. TEM, TPR, H(2) and CO chemisorptions, and XPS studies have shown that tin selective deposition on the metallic phase is obtained. At 200°C under N(2) or H(2) pressure, the presence of tin increases drastically: both the selectivity and the activity of the glycerol conversion into PG. During 2h batch runs; it could be observed that PtSn catalysts with Sn/Pt ratio=0.2 showed the best performance (PG selectivity=59% and 83% under N(2) and H(2) pressure respectively). The increase in activity and selectivity could be explained by the presence of Sn(+n) species "acid Lewis sites" which would facilitate the C-OH adsorption and its subsequent C-O cleavage favoring the propylene glycol production.

  7. Molecular dissociation in presence of catalysts: Interpreting bond breaking as a quantum dynamical phase transition

    CERN Document Server

    Ruderman, A; Santos, E; Pastawski, H M

    2015-01-01

    In this work we show that the molecular chemical bond formation and dissociation in presence of the d-band of a metal catalyst can be described as a Quantum Dynamical Phase Transition (QDPT). This agree with DFT calculations that predict sudden jumps in some observables as the molecule breaks. According to our model this phenomenon emerges because the catalyst provides for a non- Hermitian Hamiltonian. We show that when the molecule approaches the surface, as occurs in the Heyrovsky reaction of H 2, the bonding H 2 orbital has a smooth crossover into a bonding molecular orbital built with the closest H orbital and the surface metal d-states. The same occurs for the antibonding state. Meanwhile, two resonances appear within the continuous spectrum of the d- band which are associated with bonding and antibonding orbitals between the furthest H atom and the d-states at the second metallic layer. These move towards the band center where they collapse into a pure metallic resonance and an almost isolated H orbital...

  8. Molecular dissociation in the presence of catalysts: interpreting bond breaking as a quantum dynamical phase transition

    Science.gov (United States)

    Ruderman, A.; Dente, A. D.; Santos, E.; Pastawski, H. M.

    2015-08-01

    In this work we show that molecular chemical bond formation and dissociation in the presence of the d-band of a metal catalyst can be described as a quantum dynamical phase transition (QDPT). This agrees with DFT calculations that predict sudden jumps in some observables as the molecule breaks. According to our model this phenomenon emerges because the catalyst provides for a non-Hermitian Hamiltonian. We show that when the molecule approaches the surface, as occurs in the Heyrovsky reaction of H2, the bonding H2 orbital has a smooth crossover into a bonding molecular orbital built with the closest H orbital and the surface metal d-states. The same occurs for the antibonding state. Meanwhile, two resonances appear within the continuous spectrum of the d-band, which are associated with bonding and antibonding orbitals between the furthest H atom and the d-states at the second metallic layer. These move toward the band center, where they collapse into a pure metallic resonance and an almost isolated H orbital. This phenomenon constitutes a striking example of the non-trivial physics enabled when one deals with non-Hermitian Hamiltonian beyond the usual wide band approximation.

  9. Surface Termination of M1 Phase and Rational Design of Propane Ammoxidation Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Guliants, Vadim

    2015-02-16

    This final report describes major accomplishments in this research project which has demonstrated that the M1 phase is the only crystalline phase required for propane ammoxidation to acrylonitrile and that a surface monolayer terminating the ab planes of the M1 phase is responsible for their activity and selectivity in this reaction. Fundamental studies of the topmost surface chemistry and mechanism of propane ammoxidation over the Mo-V-(Te,Sb)-(Nb,Ta)-O M1 and M2 phases resulted in the development of quantitative understanding of the surface molecular structure – reactivity relationships for this unique catalytic system. These oxides possess unique catalytic properties among mixed metal oxides, because they selectively catalyze three alkane transformation reactions, namely propane ammoxidation to acrylonitrile, propane oxidation to acrylic acid and ethane oxidative dehydrogenation, all of considerable economic significance. Therefore, the larger goal of this research was to expand this catalysis to other alkanes of commercial interest, and more broadly, demonstrate successful approaches to rational design of improved catalysts that can be applied to other selective (amm)oxidation processes.

  10. Certain aspects of the formation and identification of nanosized oxide components in heterogeneous catalysts prepared by different methods

    Science.gov (United States)

    Ellert, Ol'ga G.; Tsodikov, Mark V.; Novotortsev, Vladimir M.

    2010-10-01

    The results of studies into the relationship 'methods and synthesis conditions of a catalyst→catalyst structure→catalytic properties' in highly efficient crystallo-graphically amorphous copper- and iron-containing heterogeneous systems obtained by different chemical methods are generalized. Polymorphism of active phases and catalytic properties of nanostructured copper-containing zinc, zirconium, manganese and cerium oxides are discussed. Unusual transformations of nanosized Pt- and Pd-containing components on the γ-Al2O3 surface in nanostructured catalysts of ethanol steam reforming into synthesis gas and reductive dehydration of ethanol to alkanes are considered. The results of comparative studies on the crystallographically amorphous mixed iron oxide catalysts synthesized by either the alkoxy method or the deposition on various supports obtained by the Mössbauer and XAFS spectroscopy and magnetic susceptibility measurements are presented. These materials are shown to be efficient catalysts of important processes such as liquid-phase oxidation of hydrocarbons, synthesis of alkenes and alkylaromatic hydrocarbons from CO and H2, hydrogenative transformation of brown coal organic mass to hydrocarbons.

  11. Preparation of Surface Organometallic Catalysts by Gas-Phase Ligand Stripping and Reactive Landing of Mass-Selected Ions

    Energy Technology Data Exchange (ETDEWEB)

    Johnson, Grant E.; Laskin, Julia

    2010-12-27

    Organometallic complexes immobilized on surfaces combine the high selectivity of homogeneous catalysts with the ease of separation of catalyst from products of heterogeneous materials. Here we report a novel approach for the highly controlled preparation of surface organometallic catalysts by gas-phase ligand stripping combined with reactive landing of mass-selected ions onto self assembled monolayer surfaces. Collision induced dissociation is used to generate highly reactive undercoordinated metal complexes in the gas-phase for subsequent surface immobilization. Complexes with an open coordination shell around the metal center are demonstrated to show enhanced activity towards reactive landing in comparison to fully ligated species. In situ TOF-SIMS analysis indicates that the immobilized complexes exhibit behaviour consistent with catalytic activity when exposed to gaseous reagents.

  12. The kinetics and mechanism of induced thermal decomposition of peroxomonosulphate by phase transfer catalysts

    Indian Academy of Sciences (India)

    T Balakrishnan; S Damodar Kumar

    2000-08-01

    The kinetics of induced decomposition of potassium peroxomonosulphate (PMS) by the phase transfer catalysts (PTC), viz. tetrabutylammonium chloride [TBAC] and tetrabutylphosphonium chloride [TBPC] have been investigated. The effect of [PMS], [PTC], ionic strength of the medium and temperature on the rate of decomposition of PMS was studied. The rate of decomposition of PMS was monitored under pseudo-first-order condition at a constant temperature (50 ± 0 1°C). The rate of decomposition was first order with respect to PMS for TBAC and half order for TBPC. The order with respect of PTC was found to be unity for TBAC and half order for TBPC. A suitable kinetic scheme has been proposed to account for the experimental data and its significance is discussed.

  13. Synergy effects between bismuth molybdate catalyst phases (Bi/Mo from 0.57 to 2) for the selective oxidation of propylene to arcrolein

    DEFF Research Database (Denmark)

    Le, Minh Thang; Well, Willy van; Stoltze, Per

    2005-01-01

    In this work, the synergy effect between different phases of bismuth molybdate catalysts was investigated systematically. The catalysts were prepared by spray drying and had a Bi/Mo atomic between 0.57 and 2. It is found that the synergy effect is only observed in mixtures containing γ-phase. A m...

  14. A Novel Sulfided Mo/C Catalyst for Direct Vapor Phase Carbonylation of Methanol at Atmospheric Pressure

    Institute of Scientific and Technical Information of China (English)

    Feng Peng

    2003-01-01

    The direct carbonylation of methanol, without any halide in the feed as a promoter, ispresented. A series of Mo catalysts supported on activated carbon, γ-Al2O3 and SiO2 were prepared.The results show that the support greatly affects the Mo catalyst in the direct vapor-phase carbonylationof methanol, and activated carbon is the best supports of the investigated supports. In addition, therelationships between adsorptions of NH3 and CO and carbonylation of methanol were investigated. A novelsulfided Mo/C catalyst had high activity and selectivity for the vapor phase carbonylation of methanol tomethyl acetate without the addition ofa CH3I promoter to the feed. The reaction conditions were optimizedat a reaction temperature of 573 K, a methanol concentration of 23 mol% and a carbon monoxide spacevelocity of 3,000 L/(kg.h). Under these optimal conditions a methanol conversion of 50%, carbonylationselectivity of 80 mol%, and space-time yield of 8.0 mol/(kg.h) were obtained. The active phase of thisnovel sulfided Mo/C catalyst is the non-crystalline phase, and the active component is present as MoS2.5on the surface of the activated carbon.

  15. A Continuum Model for Water Transport in the Ionomer-Phase of Catalyst Coated Membranes for PEMFCs

    Directory of Open Access Journals (Sweden)

    Vladimir Gurau

    2010-01-01

    Full Text Available We study the problem of water transport in the ionomer-phase of catalyst coated membranes (CCMs for proton exchange membrane fuel cells (PEMFCs, where microscopic-scale phenomena at the distributed interfaces between structural components control the water management. Existing models for water transport in CCMs describe the transport in systems which consist exclusively of an ionomer-phase. Interfacial water fluxes across distributed interfaces representing various mechanisms of water transfer between ionomer and catalyst layer pores are not captured properly in these models. Here we develop a continuum model for water transport in CCMs using the method of volume averaging. Water is exchanged between ionomer and the catalyst layer pores by electro-osmotic discharge (EOD through the three-phase boundary (TPB regions and by sorption and desorption across the ionomer-pore interfaces. While the former mechanism does not affect directly the water content in the ionomer-phase, it represents an effective mechanism for water transfer during fuel cell operation and controls directly the water saturation in the catalyst pores.

  16. Application of Magnetic Dicationic Ionic Liquid Phase Transfer Catalyst in Nuclophilic Substitution Reactions of Benzyl Halids in Water

    OpenAIRE

    Manouchehr Aghajeri; Ali Reza Kiasat; Bijan Mombeni Goodajdar

    2016-01-01

    magnetic dicationic ionic liquid (MDIL) was successfully prepared and evaluated as phase-transfer catalyst for nucleophilic substitution reactions. The reactions was occurred in water and furnished the corresponding benzyl derivatives in high yields. No evidence for the formation of by-product for example benzyl alcohol of the reaction was observed and the products were obtained in pure form without further purification.

  17. Highly selective bimetallic Pt-Cu/Mg(Al)O catalysts for the aqueous-phase reforming of glycerol

    NARCIS (Netherlands)

    Boga, D.A.; Oord, R.; Beale, A.M.; Chung, Y.M.; Bruijnincx, P.C.A.; Weckhuysen, B.M.

    2013-01-01

    Monometallic Pt and bimetallic Pt-Cu catalysts supported on Mg(Al)O mixed oxides, obtained by calcination of the corresponding layered double hydroxides (LDHs), were prepared and tested in the aqueous-phase reforming (APR) of glycerol. The effect of the Mg/Al ratio and calcination temperature of the

  18. Efficient oxidation of benzyl alcohol with heteropolytungstate as reaction-controlled phase-transfer catalyst

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    A series of heteropolytungstates has been synthesized and utilized as catalysts to catalyze oxidation of benzyl alcohol with aqueous hydrogen peroxide. The results indicated that three of these catalysts showed the properties of reaction-controlled phasetransfer catalysis, and they had excellent catalytic ability to the oxidation of benzyl alcohol. No other by-products were detected by gas chromatography. Once the hydrogen peroxide was consumed completely, the catalyst precipitated from solvent, and the results of the catalyst recycle showed that the catalyst had high stability.

  19. Using Mechanical Alloying to Create Bimetallic Catalysts for Vapor-Phase Carbon Nanofiber Synthesis

    Directory of Open Access Journals (Sweden)

    Laura Guevara

    2015-10-01

    Full Text Available Carbon nanofibers were generated over bimetallic catalysts in an atmospheric pressure chemical vapor deposition (APCVD reactor. Catalyst compositions of Fe 30 at%, Cu and Ni 30 at% and Cu were mechanically alloyed using high-energy ball milling over durations of 4, 8, 12, 16, and 20 h. The catalyst powders were then used to produce carbon nanofibers in ethylene and hydrogen (4:1 at temperatures of 500, 550, and 600 °C. The microstructures of the catalysts were characterized as a function of milling time as well as at deposition temperature. The corresponding carbon deposition rates were assessed and are correlated to the microstructural features of each catalyst. The milling process directly determines the performance of each catalyst toward carbon deposition, and both catalysts performed comparably to those made by traditional co-precipitation methods. Considerations in miscible and immiscible nanostructured alloy systems are discussed.

  20. Heteropolymolybdate as a New Reaction-controlled Phase-transfer Catalyst for Efficient Alcohol Oxidation with Hydrogen Peroxide

    Institute of Scientific and Technical Information of China (English)

    Zhi Huan WENG; Jin Yan WANG; Xi Gao JIAN

    2006-01-01

    A new catalytic process for the synthesis of aldehyde from alcohol by oxidation with H2O2 with high selectivity was studied. In this system, heteropolymolybdate [C7H7N(CH3)3]3{PO4[MoO(O2)2]4} was utilized as the reaction-controlled phase-transfer catalyst to catalyze oxidation of benzyl and aliphatic alcohols. The molar ratio of H2O2 and alcohol was 0.75, no other by-products were detected by gas chromatography, the results of oxidation reaction indicated that the catalyst has high activity and stability.

  1. A TWO-PHASE APPROACH TO FUZZY SYSTEM IDENTIFICATION

    Institute of Scientific and Technical Information of China (English)

    Ta-Wei HUNG; Shu-Cherng FANG; Henry L.W.NUTTLE

    2003-01-01

    A two-phase approach to fuzzy system identification is proposed. The first phase produces a baseline design to identify a prototype fuzzy system for a target system from a coIlection of input-output data pairs. It uses two easily implemented clustering techniques: the subtractive clustering method and the fuzzy c-means (FCM) clustering algorithm. The second phase (fine tuning)is executed to adjust the parameters identified in the baseline design. This phase uses the steepest descent and recursive least-squares estimation methods. The proposed approach is validated by applying it to both a function approximation type of problem and a classification type of problem. An analysis of the learning behavior of the proposed approach for the two test problems is conducted for further confirmation.

  2. Liquid-phase processing of fast pyrolysis bio-oil using platinum/HZSM-5 catalyst

    Science.gov (United States)

    Santos, Bjorn Sanchez

    Recent developments in converting biomass to bio-chemicals and liquid fuels provide a promising sight to an emerging biofuels industry. Biomass can be converted to energy via thermochemical and biochemical pathways. Thermal degradation processes include liquefaction, gasification, and pyrolysis. Among these biomass technologies, pyrolysis (i.e. a thermochemical conversion process of any organic material in the absence of oxygen) has gained more attention because of its simplicity in design, construction and operation. This research study focuses on comparative assessment of two types of pyrolysis processes and catalytic upgrading of bio-oil for production of transportation fuel intermediates. Slow and fast pyrolysis processes were compared for their respective product yields and properties. Slow pyrolysis bio-oil displayed fossil fuel-like properties, although low yields limit the process making it uneconomically feasible. Fast pyrolysis, on the other hand, show high yields but produces relatively less quality bio-oil. Catalytic transformation of the high-boiling fraction (HBF) of the crude bio-oil from fast pyrolysis was therefore evaluated by performing liquid-phase reactions at moderate temperatures using Pt/HZSM-5 catalyst. High yields of upgraded bio-oils along with improved heating values and reduced oxygen contents were obtained at a reaction temperature of 200°C and ethanol/HBF ratio of 3:1. Better quality, however, was observed at 240 °C even though reaction temperature has no significant effect on coke deposition. The addition of ethanol in the feed has greatly attenuated coke deposition in the catalyst. Major reactions observed are esterification, catalytic cracking, and reforming. Overall mass and energy balances in the conversion of energy sorghum biomass to produce a liquid fuel intermediate obtained sixteen percent (16 wt.%) of the biomass ending up as liquid fuel intermediate, while containing 26% of its initial energy.

  3. Vapor phase hydrogenation of furfural over nickel mixed metal oxide catalysts derived from layered double hydroxides

    Energy Technology Data Exchange (ETDEWEB)

    Sulmonetti, Taylor P.; Pang, Simon H.; Claure, Micaela Taborga; Lee, Sungsik; Cullen, David A.; Agrawal, Pradeep K.; Jones, Christopher W.

    2016-05-01

    The hydrogenation of furfural is investigated over various reduced nickel mixed metal oxides derived from layered double hydroxides (LDHs) containing Ni-Mg-Al and Ni-Co-Al. Upon reduction, relatively large Ni(0) domains develop in the Ni-Mg-Al catalysts, whereas in the Ni-Co-Al catalysts smaller metal particles of Ni(0) and Co(0), potentially as alloys, are formed, as evidenced by XAS, XPS, STEM and EELS. All the reduced Ni catalysts display similar selectivities towards major hydrogenation products (furfuryl alcohol and tetrahydrofurfuryl alcohol), though the side products varied with the catalyst composition. The 1.1Ni-0.8Co-Al catalyst showed the greatest activity per titrated site when compared to the other catalysts, with promising activity compared to related catalysts in the literature. The use of base metal catalysts for hydrogenation of furanic compounds may be a promising alternative to the well-studied precious metal catalysts for making biomass-derived chemicals if catalyst selectivity can be improved in future work by alloying or tuning metal-oxide support interactions.

  4. Unlocking the potential of supported liquid phase catalysts with supercritical fluids: low temperature continuous flow catalysis with integrated product separation.

    Science.gov (United States)

    Franciò, Giancarlo; Hintermair, Ulrich; Leitner, Walter

    2015-12-28

    Solution-phase catalysis using molecular transition metal complexes is an extremely powerful tool for chemical synthesis and a key technology for sustainable manufacturing. However, as the reaction complexity and thermal sensitivity of the catalytic system increase, engineering challenges associated with product separation and catalyst recovery can override the value of the product. This persistent downstream issue often renders industrial exploitation of homogeneous catalysis uneconomical despite impressive batch performance of the catalyst. In this regard, continuous-flow systems that allow steady-state homogeneous turnover in a stationary liquid phase while at the same time effecting integrated product separation at mild process temperatures represent a particularly attractive scenario. While continuous-flow processing is a standard procedure for large volume manufacturing, capitalizing on its potential in the realm of the molecular complexity of organic synthesis is still an emerging area that requires innovative solutions. Here we highlight some recent developments which have succeeded in realizing such systems by the combination of near- and supercritical fluids with homogeneous catalysts in supported liquid phases. The cases discussed exemplify how all three levels of continuous-flow homogeneous catalysis (catalyst system, separation strategy, process scheme) must be matched to locate viable process conditions.

  5. Aqueous-phase reforming of biomass using various types of supported precious metal and raney-nickel catalysts for hydrogen production

    Energy Technology Data Exchange (ETDEWEB)

    Meryemoglu, Bahar; Hesenov, Arif; Irmak, Sibel [Department of Chemistry, Cukurova University, Arts and Sciences Faculty, Balcali, Adana 01330 (Turkey); Atanur, Osman Malik [International Centre for Hydrogen Energy Technologies (UNIDO-ICHET), Cevizlibag, 34015 Zeytinburnu, Istanbul (Turkey); Erbatur, Oktay [Department of Chemistry, Cukurova University, Arts and Sciences Faculty, Balcali, Adana 01330 (Turkey); International Centre for Hydrogen Energy Technologies (UNIDO-ICHET), Cevizlibag, 34015 Zeytinburnu, Istanbul (Turkey)

    2010-11-15

    Aqueous-phase reforming (APR) of real biomass was studied for production of hydrogen gas. Wheat straw, an abundant by-product from wheat production was used as representative lignocellulosic biomass. Wheat straw was hydrolyzed in an environmentally benign-sub critical water condition. APR experiments of wheat straw hydrolysates were performed using commercial catalysts which were made of Pt, Pd and Ru doped on carbon, activated carbon and alumina supports for production of hydrogen rich gas mixture. The activity and selectivity of two commercial raney-nickel catalysts were also monitored in terms of hydrogen production. Among the precious metal catalysts tested, activity of the metals for hydrogen production was in the following descending order: Pt > Ru > Pd. Results indicated that alumina support significantly lowered the catalytic performance of the catalysts. Based on whole catalyst material, raney-nickel catalysts were more active than supported precious metal catalysts tested. (author)

  6. Oxidative homocoupling of alkynes using supported ionic liquid phase (SILP) catalysts--systematic investigation of the support influence.

    Science.gov (United States)

    Szesni, Normen; Kaiser, Melanie; Putzien, Sophie; Fischer, Richard W

    2012-02-01

    Supported Ionic Liquid Phase (SILP) catalysts have been prepared by effective immobilization of [Cu(TMEDA)(OH)]Cl in a nano-metric film of an ionic liquid on various oxidic support materials. The catalysts were tested for the oxidative homocoupling of 1-alkynes to the corresponding diynes in in a combined high throughput and conventional batch reaction approach. Among the screened support materials silica based materials performed best. The results indicate that for the specific reaction the thickness of the ionic liquids layer and therefore the mobility of the homogeneous copper complex within the ionic liquid layer as deduced from solid state nmr measurements have major impact on the catalytic performance. The optimized catalysts could be recycled up to four times without any loss of activity.

  7. Gas Phase Selective Catalytic Oxidation of Toluene to Benzaldehyde on V2O5-Ag2O/η-Al2O3 Catalyst

    Institute of Scientific and Technical Information of China (English)

    Tonglai Zhang; Liqiu Mao; Weihua Liu

    2004-01-01

    Gas phase selective catalytic oxidation of toluene to benzaldehyde was studied on V2O5-Ag2O/η-Al2O3 catalyst prepared by impregnation. The catalyst was characterized by XRD, XPS, TEM,and FT-IR. The catalytic results showed that toluene conversion and selectivity for benzaldehyde on catalyst sample No.4 (V/(V+Ag)=0.68) was higher than other catalysts with different V/Ag ratios. This was attributed to the higher surface area, larger pore volume and pore diameter of the catalyst sample No.4 than the other catalysts. The XRD patterns recorded from the catalyst before and after the oxidation reaction revealed that the new phases were developed, and this suggested that silver had entered the vanadium lattice. XPS results showed that the vanadium on the surface of No.4 and No.5 sample was more than that in the bulk, thus forming a vanadium rich layer on the surface. It was noted that when the catalyst was doped by potassium promoter, the toluene conversion and selectivity for benzaldehyde were higher than those on the undoped catalyst. This was attributed to the disordered structure of V2O5 lattice of the K-doped catalyst and a better interfacial contact between the particles.

  8. Computational Chemistry-Based Identification of Ultra-Low Temperature Water-Gas-Shift Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Manos Mavrikakis

    2008-08-31

    The current work seeks to identify novel, catalytically-active, stable, poison-resistant LWGS catalysts that retain the superior activity typical of conventional Cu catalysts but can be operated at similar or lower temperatures. A database for the Binding Energies (BEs) of the LWGS relevant species, namely CO, O and OH on the most-stable, close-packed facets of a set of 17 catalytically relevant transition metals was established. This BE data and a database of previously established segregation energies was utilized to predict the stability of bimetallic NSAs that could be synthesized by combinations of the 17 parent transition metals. NSAs that were potentially stable both in vacuo and under the influence of strong-binding WGS intermediates were then selected for adsorption studies. A set of 40 NSAs were identified that satisfied all three screener criteria and the binding energies of CO, O and OH were calculated on a set of 66, 43 and 79 NSA candidates respectively. Several NSAs were found that bound intermediates weaker than the monometallic catalysts and were thus potentially poison-resistant. Finally, kinetic studies were performed and resulted in the discovery of a specific NSA-based bimetallic catalyst Cu/Pt that is potentially a promising LWGS catalyst. This stable Cu/Pt subsurface alloy is expected to provide facile H{sub 2}O activation and remain relatively resistant from the poisoning by CO, S and formate intermediates.

  9. Effect of phase interaction on catalytic CO oxidation over the SnO2/Al2O3 model catalyst

    Science.gov (United States)

    Chai, Shujing; Bai, Xueqin; Li, Jing; Liu, Cheng; Ding, Tong; Tian, Ye; Liu, Chang; Xian, Hui; Mi, Wenbo; Li, Xingang

    2017-04-01

    We investigated the catalytic CO oxidation over the SnO2/Al2O3 model catalysts. Our results show that interaction between the Al2O3 and SnO2 phases results in the significantly improved catalytic activity because of the formation of the oxygen vacancies. The oxygen storage capacity of the SnO2/Al2O3 catalyst prepared by the physically mixed method is nearly two times higher than that of the SnO2, which probably results from the change of electron concentration on the interface of the SnO2 and Al2O3 phases. Introducing water vapor to the feeding gas would a little decrease the activity of the catalysts, but the reaction rate could completely recover after removal of water vapor. The kinetics results suggest that the surface Sn4+ cations are effective CO adsorptive sites, and the surface adsorbed oxygen plays an important role upon CO oxidation. The reaction pathways upon the SnO2-based catalysts for CO oxidation follow the Langmuir-Hinshelwood model.

  10. Synthesis of dimethyl ether and alternative fuels in the liquid phase from coal-derived synthesis gas. Task 3.2: Screen novel catalyst systems; Task 3.3:, Evaluation of the preferred catalyst system

    Energy Technology Data Exchange (ETDEWEB)

    Underwood, R.P.

    1993-01-01

    As part of the DOE-sponsored contract ``Synthesis of Dimethyl Ether and Alternative Fuels in the Liquid Phase from Coal-Derived Syngas`` experimental evaluations of the one-step synthesis of alternative fuels were carried out. The objective of this work was to develop novel processes for converting coal-derived syngas to fuels or fuel additives. Building on a technology base acquired during the development of the Liquid Phase Methanol (LPMEOH) process, this work focused on the development of slurry reactor based processes. The experimental investigations, which involved bench-scale reactor studies, focused primarily on three areas: (1) One-step, slurry-phase syngas conversion to hydrocarbons or methanol/hydrocarbon mixtures using a mixture of methanol synthesis catalyst and methanol conversion catalyst in the same slurry reactor. (2) Slurry-phase conversion of syngas to mixed alcohols using various catalysts. (3) One-step, slurry-phase syngas conversion to mixed ethers using a mixture of mixed alcohols synthesis catalyst and dehydration catalyst in the same slurry reactor. The experimental results indicate that, of the three types of processes investigated, slurry phase conversion of syngas to mixed alcohols shows the most promise for further process development. Evaluations of various mixed alcohols catalysts show that a cesium-promoted Cu/ZnO/Al{sub 2}O{sub 3} methanol synthesis catalyst, developed in Air Products` laboratories, has the highest performance in terms of rate and selectivity for C{sub 2+}-alcohols. In fact, once-through conversion at industrially practical reaction conditions yielded a mixed alcohols product potentially suitable for direct gasoline blending. Moreover, an additional attractive aspect of this catalyst is its high selectivity for branched alcohols, potential precursors to iso-olefins for use in etherification.

  11. A comparison of the pharmacophore identification programs: Catalyst, DISCO and GASP.

    Science.gov (United States)

    Patel, Yogendra; Gillet, Valerie J; Bravi, Gianpaolo; Leach, Andrew R

    2002-01-01

    Three commercially available pharmacophore generation programs, Catalyst/HipHop, DISCO and GASP, were compared on their ability to generate known pharmacophores deduced from protein-ligand complexes extracted from the Protein Data Bank. Five different protein families were included Thrombin, Cyclin Dependent Kinase 2, Dihydrofolate Reductase, HIV Reverse Transcriptase and Thermolysin. Target pharmacophores were defined through visual analysis of the data sets. The pharmacophore models produced were evaluated qualitatively through visual inspection and according to their ability to generate the target pharmacophores. Our results show that GASP and Catalyst outperformed DISCO at reproducing the five target pharmacophores.

  12. Study of Nanoconfined Phases for the Rational Synthesis of Supported Catalysts

    NARCIS (Netherlands)

    Eggenhuisen, T.M.

    2012-01-01

    Catalysts are indispensable for modern day society since they are used in the production of transportation fuels, chemicals and materials. Understanding the structure-activity relation for a catalytic system allows the formulation of catalyst structure specifications that optimizes activity, selecti

  13. Oxidation of methanol to formaldehyde on supported vanadium oxide catalysts compared to gas phase molecules.

    Science.gov (United States)

    Döbler, Jens; Pritzsche, Marc; Sauer, Joachim

    2005-08-10

    The oxidation of methanol to formaldehyde on silica supported vanadium oxide is studied by density functional theory. For isolated vanadium oxide species silsesquioxane-type models are adopted. The first step is dissociative adsorption of methanol yielding CH3O(O=)V(O-)2 surface complexes. This makes the O=V(OCH3)3 molecule a suited model system. The rate-limiting oxidation step involves hydrogen transfer from the methoxy group to the vanadyl oxygen atom. The transition state is biradicaloid and needs to be treated by the broken-symmetry approach. The activation energies for O=V(OCH3)3 and the silsesquioxane surface model are 147 and 154 kJ/mol. In addition, the (O=V(OCH3)3)(2) dimer (a model for polymeric vanadium oxide species) and the O=V(OCH3)3(*+) radical cation are studied. For the latter the barrier is only 80 kJ/mol, indicating a strong effect of the charge on the energy profile of the reaction and questioning the significance of gas-phase cluster studies for understanding the activity of supported oxide catalysts.

  14. Propene and l-octene hydroformylation with silica-supported, ionic liquid-phase (SILP) Rh-phosphine catalysts in continuous fixed-bed mode

    DEFF Research Database (Denmark)

    Riisager, Anders; Eriksen, Kim Michael; Wasserscheid, Peter

    2003-01-01

    Supported ionic liquid-phase (SILP) catalysts were made by immobilizing Rh-monophosphine complexes of bis(m-phenylguanidinium) phenylphosphine 1 and NORBOS 2 ligands in 1-n-butyl-3-methylimidazolium hexafluorophosphate, [BMIM] [PF6], on a silica support. The catalysts were active in continuous ga...

  15. Western Renewable Energy Zones, Phase 1: QRA Identification Technical Report

    Energy Technology Data Exchange (ETDEWEB)

    Pletka, R.; Finn, J.

    2009-10-01

    This report describes the Western Renewable Energy Zones (WREZ) Initiative Phase 1 Qualified Resource Area identification process, including the identification and economic analysis of Qualified Resource Areas (QRAs) and 'non-REZ' resources. These data and analyses will assist the Western US in its renewable energy transmission planning goals. The economic analysis in this report produced the input data for the WREZ Generation and Transmission model, which is a screening-level model to determine the optimal routing for and cost of delivering renewable energy from QRAs to load centers throughout the Western Interconnection. In June 2009, the Western Governors' Association accepted the Western Governors' Association WREZ Phase 1 Report in which the QRAs were mapped and the entire WREZ Phase 1 process was explained in general. That same month the Lawrence Berkeley National Laboratory released the WREZ Generation and Transmission Model (GTM), which was also developed by Black & Veatch. This report details the assumptions and methodologies that were used to produce the maps and resource analyses in the WGA report as well as the economic data used by the WREZ GTM. This report also provides the results of the non-REZ resource analysis for the first time in the WREZ initiative.

  16. Extending Tabletop XUV Spectroscopy to the Liquid Phase to Examine Transition Metal Catalysts

    Science.gov (United States)

    Benke, Kristin; Ryland, Elizabeth S.; Vura-Weis, Josh

    2017-06-01

    M-edge spectroscopy of first row transition metals (3p to 3d excitation) is the low energy analogue of more well-known K- and L-edge spectroscopy, but can be implemented without the use of a synchrotron. Instead, M-edge spectroscopy can be performed as a tabletop method, relying on high harmonic generation (HHG) to produce ultrashort (˜ 20 fs) pulses of extreme ultraviolet (XUV) light in the range of 10-100s of eV. We have shown tabletop M-edge spectroscopy to be a valuable tool in determining the electronic structure of metal-centered coordination complexes and have demonstrated its capacity to yield element-specific information about a compound's oxidation state, spin state, and ligand field. The power of this technique to distinguish these features makes it a promising addition to the arsenal of methods used to study metal-centered catalysts. A catalytic reaction can be initiated photochemically and the XUV probe can be used to track oxidative and structural changes to identify the key intermediates. Until recently tabletop XUV spectroscopy has been performed on thin film samples, but in order to examine homogeneous catalysis, the technique must be adapted to look at samples in the liquid phase. The challenges of adapting tabletop XUV spectroscopy to the liquid phase lie in the lower attenuation length of XUV light compared to soft and hard x-rays and the lower flux compared to synchrotron methods. As a result, the sample must be limited to a sub-micron thickness as well as isolated from the vacuum environment required for x-ray spectroscopy. I am developing a liquid flow cell that relies on confining the sample between two x-ray transmissive SiN membranes, as has been demonstrated for use at synchrotrons, but adapted to the unique difficulties encountered in tabletop XUV spectroscopy.

  17. Ultrasound-assisted phase-transfer catalysis: benzoylation of sodium 4-acetylphenoxide by dual-site phase-transfer catalyst in a tri-liquid system.

    Science.gov (United States)

    Yang, Hung-Ming; Chiu, Chun-Cheng

    2011-01-01

    A novel dual-site phase-transfer catalyst (PTC) was prepared and used to conduct the benzoylation of sodium 4-acetylphenoxide by ultrasound-assisted third-liquid phase-transfer catalysis. The catalyst 1,4-bis(tributylammoniomethyl)benzene dibromide (BTBAMBB) was synthesized from the reaction of p-xylylene dibromide and tributylamine in toluene at 70°C. The dual-site PTC was employed to form the third-liquid phase by extra addition of 0.04-0.05 mol of NaCl into 10 cm(3) of water. In the condition of 0.0425 mol of NaCl at 30°C, the catalytic intermediate in the third-liquid phase reached a maximum value. Almost 80% of the catalyst was transferred from the aqueous phase into the third-liquid phase. The distributions of the catalytic intermediate and dual-site PTC between phases and the kinetics of benzoylation of sodium 4-acetylphenoxide catalyzed by BTBAMBB with ultrasound irradiation were performed. The pseudo-first-order kinetic equation was applied to describe the overall reaction. Under ultrasound irradiation (28 kHz/300 W) in a batch reactor, the yield of product 4-acetylphenyl benzoate in the organic phase was 98.1% in 2 min at 30°C and 250 rpm with the apparent rate constant k(app) to be 0.0075 s(-1), which was 6 times faster than that without using ultrasound (yield=14.4%, k(app)=0.0013 s(-1)). The present study provides a green method to synthesize esters by ultrasound-assisted third-liquid phase-transfer catalysis.

  18. Kinetics of Heterogeneous Solvent-free Liquid Phase Oxidation of Alcohol Using ZrO2 Catalyst with Molecular Oxygen

    Institute of Scientific and Technical Information of China (English)

    ILYAS Mohammad; SADIQ Mohammad

    2008-01-01

    Clean liquid phase solvent-free oxidation of alcohol to aldehyde/ketone using ZrO2 catalyst with molecular oxygen has been studied.Monoclinic phase ZrO2 has been synthesized and characterized by XRD,SEM,EDX and surface and pore size analyses.Oxidation of alcohol was carded out in a typical batch reactor at different sDeed of agitation(150-1200 r/min),temperature(373-413 K),catalyst loading(50-300 mg)and partial pressure of oxygen(12-101 kPa).These parameters influence alcohol conversion as well as selectivity.A handy touch of kinetics was given to the experimental data and apparent activation energy was calculated.

  19. Application of Magnetic Dicationic Ionic Liquid Phase Transfer Catalyst in Nuclophilic Substitution Reactions of Benzyl Halids in Water

    Directory of Open Access Journals (Sweden)

    Manouchehr Aghajeri

    2016-06-01

    Full Text Available magnetic dicationic ionic liquid (MDIL was successfully prepared and evaluated as phase-transfer catalyst for nucleophilic substitution reactions. The reactions was occurred in water and furnished the corresponding benzyl derivatives in high yields. No evidence for the formation of by-product for example benzyl alcohol of the reaction was observed and the products were obtained in pure form without further purification.

  20. PhasePApy: A robust pure Python package for automatic identification of seismic phases

    Science.gov (United States)

    Chen, Chen; Holland, Austin

    2016-01-01

    We developed a Python phase identification package: the PhasePApy for earthquake data processing and near‐real‐time monitoring. The package takes advantage of the growing number of Python libraries including Obspy. All the data formats supported by Obspy can be supported within the PhasePApy. The PhasePApy has two subpackages: the PhasePicker and the Associator, aiming to identify phase arrival onsets and associate them to phase types, respectively. The PhasePicker and the Associator can work jointly or separately. Three autopickers are implemented in the PhasePicker subpackage: the frequency‐band picker, the Akaike information criteria function derivative picker, and the kurtosis picker. All three autopickers identify picks with the same processing methods but different characteristic functions. The PhasePicker triggers the pick with a dynamic threshold and can declare a pick with false‐pick filtering. Also, the PhasePicker identifies a pick polarity and uncertainty for further seismological analysis, such as focal mechanism determination. Two associators are included in the Associator subpackage: the 1D Associator and 3D Associator, which assign phase types to picks that can best fit potential earthquakes by minimizing root mean square (rms) residuals of the misfits in distance and time, respectively. The Associator processes multiple picks from all channels at a seismic station and aggregates them to increase computational efficiencies. Both associators use travel‐time look up tables to determine the best estimation of the earthquake location and evaluate the phase type for picks. The PhasePApy package has been used extensively for local and regional earthquakes and can work for active source experiments as well.

  1. Selective hydrogenation of 1,3-butadiene in presence of 1-butene under liquid phase conditions with NiPd/Al^sub 2^O3 catalysts

    National Research Council Canada - National Science Library

    Franklin J Méndez; Roger Solano; Yanet Villasana; Julia Guerra; Susana Curbelo; Marcel Inojosa; Claudio Olivera-Fuentes; Joaquín L Brito

    2016-01-01

      The catalytic performance of Al2O3-supported monometallic and bimetallic catalysts in selective hydrogenation of 1,3-butadiene in the presence of 1-butene under liquid phase conditions was studied...

  2. Vapor-phase Beckmann rearrangement of cyclohexanone oxime over solid acid catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Murakami, Y.; Saeki, Y.; Ito, K.

    1978-01-01

    Of various catalysts tested for the conversion of cyclohexanone oxime to epsilon-caprolactam, best results were obtained with the catalyst having the strongest acid sites, silica-alumina, which gave 60% selectivity at 100% conversion at 330/sup 0/C, 0.505 g catalyst hr/mole, and 0.0563 atm cyclohexanone oxime partial pressure. A decline in activity without loss of selectivity was observed for all catalysts as carbonaceous deposits formed with time on stream (e.g., the caprolactam yield on silica-alumina declined to 90% after 120 min and to 35% after 270 min). Pulse reactor tests with silica-alumina with and without preadsorbed caprolactam showed that cyclohexanone oxime adsorbed even more strongly than the strongly adsorbed caprolactam. The mechanism is discussed. Graphs and 21 references.

  3. Slurry phase Fischer-Tropsch synthesis: Cobalt plus a water-gas shift catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Chanenchuk, C.A.; Yates, I.C.; Satterfield, C.N.

    1990-01-01

    A Co/MgO/SiO[sub 2] Fischer-Tropsch catalyst was operated simultaneously with a Cu/ZnO/Al[sub 2]O[sub 3] water-gas-shift catalyst in a slurry reactor for over 400 hours. The process conditions were held constant at a temperature of 240[degrees]C, a pressure of 0.79 MPa, and a 1.1 H[sub 2]/CO feed of 0.065 Nl/min-g.cat. The Fischer-Tropsch activity remained constant at the level predicted by the operation of the Co/MgO/SiO[sub 2] catalyst alone. The water-gas-shift reaction was near equilibrium. The hydrocarbon product distribution of the combined catalyst system was stable and matched that of the CO/MgO/SiO[sub 2] operating alone under similar conditions. The combined catalyst system exhibited a high selectivity to n-alkanes. Neither catalysts's operation appeared to have a detrimental effect on that of the other, showing promise for future option.

  4. Liquid-Phase Catalytic Transfer Hydrogenation of Furfural over Homogeneous Lewis Acid-Ru/C Catalysts.

    Science.gov (United States)

    Panagiotopoulou, Paraskevi; Martin, Nickolas; Vlachos, Dionisios G

    2015-06-22

    The catalytic performance of homogeneous Lewis acid catalysts and their interaction with Ru/C catalyst are studied in the catalytic transfer hydrogenation of furfural by using 2-propanol as a solvent and hydrogen donor. We find that Lewis acid catalysts hydrogenate the furfural to furfuryl alcohol, which is then etherified with 2-propanol. The catalytic activity is correlated with an empirical scale of Lewis acid strength and exhibits a volcano behavior. Lanthanides are the most active, with DyCl3 giving complete furfural conversion and a 97 % yield of furfuryl alcohol at 180 °C after 3 h. The combination of Lewis acid and Ru/C catalysts results in synergy for the stronger Lewis acid catalysts, with a significant increase in the furfural conversion and methyl furan yield. Optimum results are obtained by using Ru/C combined with VCl3 , AlCl3 , SnCl4 , YbCl3 , and RuCl3 . Our results indicate that the combination of Lewis acid/metal catalysts is a general strategy for performing tandem reactions in the upgrade of furans.

  5. Production of renewable hydrogen from aqueous-phase reforming of glycerol over Pt catalysts supported on different oxides

    Energy Technology Data Exchange (ETDEWEB)

    Menezes, Andre O. [Instituto Nacional de Tecnologia/MCT, Laboratorio de Catalise, Av. Venezuela 82/507, Rio de Janeiro/RJ 22081-312 (Brazil); Instituto Militar de Engenharia, Praca General Tiburcio, 80 Praia Vermelha, Rio de Janeiro/RJ 22290-270 (Brazil); Rodrigues, Michelly T.; Zimmaro, Adriana; Fraga, Marco A. [Instituto Nacional de Tecnologia/MCT, Laboratorio de Catalise, Av. Venezuela 82/507, Rio de Janeiro/RJ 22081-312 (Brazil); Borges, Luiz E.P. [Instituto Militar de Engenharia, Praca General Tiburcio, 80 Praia Vermelha, Rio de Janeiro/RJ 22290-270 (Brazil)

    2011-02-15

    Aqueous-phase reforming of oxygenated hydrocarbons for hydrogen production presents several advantages as feed molecules can be easily found in a wide range of biomass, there is no need for its vaporization and the process allows thorough exploitation of the environmental benefits of using hydrogen as an energy carrier. The use of glycerol in particular is motivated due to its availability as a consequence of increasing biodiesel production worldwide. In this contribution, the performance of Pt-based catalysts supported on different oxides (Al{sub 2}O{sub 3}, ZrO{sub 2}, MgO and CeO{sub 2}) is studied on glycerol reforming. All catalysts led to a hydrogen-rich gas phase. However, a good potential activity with high production of hydrogen and low concentration of undesired hydrocarbons was accomplished over the catalysts supported on MgO and ZrO{sub 2}. The high electron donating character of such oxides indicates the influence of the nature of the support in catalytic performance for glycerol reforming. (author)

  6. Structural and catalytic properties of a novel vanadium containing solid core mesoporous silica shell catalysts for gas phase oxidation reaction

    Indian Academy of Sciences (India)

    N Venkatathri; Vijayamohanan K Pillai; A Rajini; M Nooka Raju; I A K Reddy

    2013-01-01

    A novel vanadium containing solid core mesoporous silica shell catalyst was synthesized with different Si/V ratios by sol-gel method under neutral conditions. The synthesized materials were characterized by various techniques and gas phase diphenyl methane oxidation reaction. The mesoporosity combined with microporosity are formed by incorporation of octadecyltrichloro silane and triethylamine in the catalyst and it was found out from E-DAX and BET—surface area analysis. The material was found to be nanocrystalline. Vanadium is present as V4+ species in as-synthesized samples and convert to V5+ on calcination. Most of the vanadium is present in tetrahedral or square pyramidal environment. Incorporation of vanadium in silica framework was confirmed by 29Si MAS NMR analysis. Among the various vanadium containing solid core mesoporous silica shell catalysts, the Si/V =100 ratio exhibited maximum efficiency towards diphenyl methane to benzophenone gas phase reaction. The optimum condition required for maximum conversion and selectivity was found out from the catalytic studies.

  7. Aqueous-Phase Preparation of Model HDS Catalysts on Planar Alumina Substrates: Support Effect on Mo Adsorption and Sulfidation.

    Science.gov (United States)

    Bara, Cédric; Plais, Lucie; Larmier, Kim; Devers, Elodie; Digne, Mathieu; Lamic-Humblot, Anne-Félicie; Pirngruber, Gerhard D; Carrier, Xavier

    2015-12-23

    The role of the oxide support on the structure of the MoS2 active phase (size, morphology, orientation, sulfidation ratio, etc.) remains an open question in hydrotreating catalysis and biomass processing with important industrial implications for the design of improved catalytic formulations. The present work builds on an aqueous-phase surface-science approach using four well-defined α-alumina single crystal surfaces (C (0001), A (112̅0), M (101̅0), and R (11̅02) planes) as surrogates for γ-alumina (the industrial support) in order to discriminate the specific role of individual support facets. The reactivity of the various surface orientations toward molybdenum adsorption is controlled by the speciation of surface hydroxyls that determines the surface charge at the oxide/water interface. The C (0001) plane is inert, and the R (11̅02) plane has a limited Mo adsorption capacity while the A (112̅0) and M (101̅0) surfaces are highly reactive. Sulfidation of model catalysts reveals the highest sulfidation degree for the A (112̅0) and M (101̅0) planes suggesting weak metal/support interactions. Conversely, a low sulfidation rate and shorter MoS2 slabs are found for the R (11̅02) plane implying stronger Mo-O-Al bonds. These limiting cases are reminiscent of type I/type II MoS2 nanostructures. Structural analogies between α- and γ- alumina surfaces allow us to bridge the material gap with real Al2O3-supported catalysts. Hence, it can be proposed that Mo distribution and sulfidation rate are heterogeneous and surface-dependent on industrial γ-Al2O3-supported high-surface-area catalysts. These results demonstrate that a proper control of the γ-alumina morphology is a strategic lever for a molecular-scale design of hydrotreating catalysts.

  8. First principle identification of SiC monolayer as an efficient catalyst for CO oxidation

    Energy Technology Data Exchange (ETDEWEB)

    Sinthika, S., E-mail: ranjit.t@res.srmuniv.ac.in, E-mail: sinthika90@gmail.com; Thapa, Ranjit, E-mail: ranjit.t@res.srmuniv.ac.in, E-mail: sinthika90@gmail.com [SRM Research Institute, SRM University, Kattankulathur 603203, Tamil Nadu (India); Reddy, C. Prakash [Department of Physics and Nanotechnology, SRM University, Kattankulathur 603203, Tamil Nadu (India)

    2015-06-24

    Using density functional theory, we investigated the electronic properties of SiC monolayer and tested its catalytic activity toward CO oxidation. The planar nature of a SiC monolayer is found to stable and is a high band gap semiconductor. CO interacts physically with SiC surface, whereas O{sub 2} is adsorbed with moderate binding. CO oxidation on SiC monolayer prefers the Eley Rideal mechanism over the Langmuir Hinshelwood mechanism, with an easily surmountable activation barrier during CO{sub 2} formation. Overall metal free SiC monolayer can be used as efficient catalyst for CO oxidation.

  9. Catalytic oxidation of benzene in the gas phase over alumina-supported silver catalysts.

    Science.gov (United States)

    Einaga, Hisahiro; Ogata, Atsushi

    2010-04-01

    Catalytic properties of Ag/Al(2)O(3) for complete oxidation of benzene with ozone at 295-373 K were studied and compared with those of Mn/Al(2)O(3). At the reaction temperature of 295 K, the Ag/Al(2)O(3) catalysts showed selectivity to CO(x) (ca. 80%) higher than that of the oxide of metals in the first transition series (Fe, Mn, Co, Ni, Cu) supported on Al(2)O(3), which had selectivities of 28-62%. The catalyst showed gradual deactivation from accumulation of byproduct compounds on the catalyst surface. FTIR studies revealed that the byproduct compounds consisted of easily decomposable species and hardly decomposable species. The rate for benzene oxidation linearly increased with Ag loadings (approximately 15 wt %) and was not improved at higher loading levels. The ratios of ozone decomposition to benzene oxidation and ozone decomposition to CO(x) selectivity were evaluated to be 7.5 and 80%, respectively, and they were independent of benzene conversion. The Ag/Al(2)O(3) catalyst showed steady-state activities at a reaction temperature of 313-373 K, and the conversion increased with the increase in the reaction temperature. The presence of water vapor in the reaction gas inhibited the catalyst deactivation, and steady-state activity was obtained at a reaction temperature of 295 K, while it did not affect the activities for benzene oxidation but improved the CO(2) selectivity.

  10. Formation of Multiple-Phase Catalysts for the Hydrogen Storage of Mg Nanoparticles by Adding Flowerlike NiS.

    Science.gov (United States)

    Xie, Xiubo; Ma, Xiujuan; Liu, Peng; Shang, Jiaxiang; Li, Xingguo; Liu, Tong

    2017-02-22

    In order to enhance the hydrogen storage properties of Mg, flowerlike NiS particles have been successfully prepared by solvothermal reaction method, and are subsequently ball milled with Mg nanoparticles (NPs) to fabricate Mg-5 wt % NiS nanocomposite. The nanocomposite displays Mg/NiS core/shell structure. The NiS shell decomposes into Ni, MgS and Mg2Ni multiple-phases, decorating on the surface of the Mg NPs after the first hydrogen absorption and desorption cycle at 673 K. The Mg-MgS-Mg2Ni-Ni nanocomposite shows enhanced hydrogenation and dehydrogenation rates: it can quickly uptake 3.5 wt % H2 within 10 min at 423 K and release 3.1 wt % H2 within 10 min at 573 K. The apparent hydrogen absorption and desorption activation energies are decreased to 45.45 and 64.71 kJ mol(-1). The enhanced sorption kinetics of the nanocomposite is attributed to the synergistic catalytic effects of the in situ formed MgS, Ni and Mg2Ni multiple-phase catalysts during the hydrogenation/dehydrogenation process, the porthole effects for the volume expansion and microstrain of the phase transformation of Mg2Ni and Mg2NiH4 and the reduced hydrogen diffusion distance caused by nanosized Mg. This novel method of in situ producing multiple-phase catalysts gives a new horizon for designing high performance hydrogen storage material.

  11. In-situ HRTEM study of the reactive carbide phase of Co/MoS{sub 2} catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Ramos, Manuel, E-mail: manuel.ramos@uacj.mx [Departamento de Física y Matemáticas, Instituto de Ingeniería y Tecnología, UACJ, 32310 Ciudad Juárez, México (Mexico); Materials Research and Technology Institute, UT-El Paso, El Paso, TX 79902 (United States); Ferrer, Domingo [Microelectronics Research Laboratory, UT-Austin, Austin, TX 78758 (United States); Martinez-Soto, Eduan [Departamento de Química, Universidad Metropolitana, San Juan, PR 00926-2602 (United States); Lopez-Lippmann, Hugo; Torres, Brenda [Materials Research and Technology Institute, UT-El Paso, El Paso, TX 79902 (United States); Berhault, Gilles [Institut de Recherches sur la Catalyse et l’Environnement, IRCELYON, CNRS, Université de Lyon, Villeurbanne 69100 (France); Chianelli, Russell R. [Materials Research and Technology Institute, UT-El Paso, El Paso, TX 79902 (United States)

    2013-04-15

    Hydrotreatment catalytic operations are commonly performed industrially by layered molybdenum sulfide promoted by cobalt or nickel in order to remove heteroelements (S, N, O) from fossil fuels and biofuels. Indeed, these heteroelements are responsible of the emission of pollutants when these fuels are used in vehicles. In this respect, previous studies made by our research group have shown that the active phase under steady state conditions is partially carbided while strong bending effects of MoS{sub 2} slabs were also observed. However, up to now, the morphology of the resulting Co/MoS{sub x}C{sub y} carbided catalyst has not been fully characterized. In the present study, for the first time, a chemical reaction between the carbon content of a TEM Cu/C grid and a freshly sulfide Co/MoS{sub 2} catalyst was in situ observed at 300 °C and 450 °C by HRTEM experimental techniques at ∼10 nm of resolution. Results indicate that bending of MoS{sub 2} layers occurred due to carbon addition on MoS{sub 2} edge sites, as observed in stabilized catalysts after HDS reaction. Using a silicon grid, only cracks of MoS{sub 2} slabs were observed without bending effect confirming the role of structural-carbon in this change of morphology.

  12. Ultrasound assisted free radical polymerization of glycidyl methacrylate by a new disite phase-transfer catalyst system: A kinetic study.

    Science.gov (United States)

    Sankar, Kavitha; Rajendran, Venugopal

    2012-11-01

    The kinetics of multi-site phase-transfer catalyzed free radical polymerisation of glycidyl methacrylate (GMA) using potassium peroxy disulphate (PDS) as water soluble initiator and newly synthesized 1,4-dihexadecylpyrazine-1,4-diium dibromide as multi-site phase-transfer catalyst (MPTC) has been investigated in ethyl acetate/water two phase system at constant temperature 65±1°C under nitrogen atmosphere and ultrasound irradiation conditions. The rate of polymerization increases with an increase in concentrations of GMA, PDS and MPTC. The order with respect to monomer, initiator and MPTC were found to be 1.0, 0.5 and 1.0, respectively. The comparative study reveals that the Rp of GMA determined in the presence of PTC combined with ultrasound has shown more enhancements in the activity than PTC alone. Based on the observed results a suitable mechanism has been proposed to account for the experimental observations and its significance was discussed.

  13. Liquid phase in situ hydrodeoxygenation of biomass-derived phenolic compounds to hydrocarbons over bifunctional catalysts

    Science.gov (United States)

    Junfeng Feng; Chung-yun Hse; Zhongzhi Yang; Kui Wang; Jianchun Jiang; Junming Xu

    2017-01-01

    The objective of this study was to find an effective method for converting renewable biomass-derived phenolic compounds into hydrocarbons bio-fuel via in situ catalytic hydrodeoxygenation. The in situ hydrodeoxygenation of biomass-derived phenolic compounds was carried out in methanol-water solvent over bifunctional catalysts of Raney Ni and HZSM-5 or H-Beta. In the in...

  14. In search of efficient catalysts and appropriate reaction conditions for gas phase nitration of benzene

    Directory of Open Access Journals (Sweden)

    Anton P. Koskin

    2016-09-01

    Full Text Available The present paper is dedicated to the development of a method for the nitrobenzene production using solid acid catalysts, as an alternative to industrial nitration, based on a mixture of concentrated acids. The influence of key parameters of the nitration process (temperature, reagent flow rate, nitrating agent concentration etc. on the conversion of the initial substrate, the degree of decomposition of nitric acid and the quantity of resulting oxygenates was studied. Recommendations for the selection of effective catalytic systems (high content of Brønsted acid sites with Ho < −4, high specific surface and resistance to HNO3 were developed and the best conditions for process reactions (temperature 200 °C, aqueous solution of nitric acid with concentration of 30 wt%, “nitric acid:benzene” ratio = 0.76 were found. A method for regeneration of the catalytic activity without unloading the catalyst was proposed. As an example, MoO3/SiO2 sample was tested in a dual-mode nitration/regeneration process, which allowed us to increase the flow rates of reagents and obtain catalyst efficiency of up to STY = 4.09 g/(gcat ⋅ h. Several of the most promising catalysts (MoO3/SiO2, WO3/ZrO2 and Nafion/support composite for the process were tested in identical conditions.

  15. Catalytic activity of bimetallic catalysts highly sensitive to the atomic composition and phase structure at the nanoscale.

    Science.gov (United States)

    Shan, Shiyao; Petkov, Valeri; Prasai, Binay; Wu, Jinfang; Joseph, Pharrah; Skeete, Zakiya; Kim, Eunjoo; Mott, Derrick; Malis, Oana; Luo, Jin; Zhong, Chuan-Jian

    2015-12-07

    phase segregation into distinct chemically-ordered (B2-type) and disordered (fcc-type) domains. This finding is significant since it provides a rational basis for streamlining the design and preparation of Pd-based nanoalloy catalysts in terms of atomic structure and phase state.

  16. Ionic liquids as efficient phase-transfer catalysts for the solid base-promoted monoalkylation of diethyl malonate

    Institute of Scientific and Technical Information of China (English)

    Hui Sun; Juan Li; Xiao Chen Cai; Dong Jiang; Li Yi Dai

    2007-01-01

    Ionic liquids (ILs) based on 1,3-dialkylimidazolium and teraalkylammonium cations were employed as a series of efficient,environmentally benign phase-transfer catalysts (PTCs) for the base-promoted monoalkylation of diethyl malonate. The influence of various heterogeneous bases on yields was studied. Good yields and high selectivity were obtained. Solvent-free, mild reaction condition, short reaction time, and easy purification were the merits of this method. The catalytic system (IL-base) could also be recycled after the extraction of products with ether.

  17. Direct gas-phase epoxidation of propylene to propylene oxide using air as oxidant on supported gold catalyst

    Institute of Scientific and Technical Information of China (English)

    Zhanghuai Suo; Mingshan Jin; Jiqing Lu; Zhaobin Wei; Can Li

    2008-01-01

    Gold catalysts supported on SiO2, TiO2, TiO2-SiO2, and ZrO2-SiO2 supports were prepared by impregnating each support with a basic solution of tetrachloroauric acid. X-ray diffraction (XRD), transmission electron microscopy (TEM), and X-ray photoelectron spectroscopy (XPS) techniques were used to characterize their structure and surface composition. The results indicated that the size of gold particles could be controlled to below 10 nm by this method of preparation. Washing gold catalysts with water could markedly enhance the dispersion of metallic gold particles on the surface, but it could not completely remove the chloride ions left on the surface. The catalytic performance of direct vapor-phase epoxidation of propylene using air as an oxidant over these catalysts was evaluated at atmospheric pressure. The selectivity to propylene oxide (PO) was found to vary with reaction time on the stream. At the reaction conditions of atmosphere pressure, temperature 325 ℃, feed gas ratio V(C3H6)/V(O2) = 1/2, and GHSV = 6000 h-1, 17.9% PO selectivity with 0.9% propylene conversion were obtained at initial 10 min for Au/SiO2 catalyst. After reacting 60 min only 8.9% PO selectivity were detected, but the propylene conversion rises to 1.4% and the main product is transferred to acrolein (72% selectivity). Washing Au/TiO2-SiO2 and Au/ZrO2-SiO2 samples with magnesium citrate solution could markedly enhance the activity and PO selectivity because smaller gold particles were obtained.

  18. A systematic investigation of quaternary ammonium ions as asymmetric phase-transfer catalysts. Application of quantitative structure activity/selectivity relationships.

    Science.gov (United States)

    Denmark, Scott E; Gould, Nathan D; Wolf, Larry M

    2011-06-01

    Although the synthetic utility of asymmetric phase-transfer catalysis continues to expand, the number of proven catalyst types and design criteria remains limited. At the origin of this scarcity is a lack in understanding of how catalyst structural features affect the rate and enantioselectivity of phase transfer catalyzed reactions. Described in this paper is the development of quantitative structure-activity relationships (QSAR) and -selectivity relationships (QSSR) for the alkylation of a protected glycine imine with libraries of quaternary ammonium ion catalysts. Catalyst descriptors including ammonium ion accessibility, interfacial adsorption affinity, and partition coefficient were found to correlate meaningfully with catalyst activity. The physical nature of the descriptors was rationalized through differing contributions of the interfacial and extraction mechanisms to the reaction under study. The variation in the observed enantioselectivity was rationalized employing a comparative molecular field analysis (CoMFA) using both the steric and electrostatic fields of the catalysts. A qualitative analysis of the developed model reveals preferred regions for catalyst binding to afford both configurations of the alkylated product.

  19. The influence of reduction methods and conditions on the activity of alumina-supported platinum catalysts for the liquid phase hydrogenation of benzaldehyde in ethanol

    Energy Technology Data Exchange (ETDEWEB)

    Arai, M.; Obata, A.; Nishiyama, Y. [Tohoku Univ., Sendai (Japan)

    1997-02-01

    The activities of supported metal catalysts depend on various preparation variables, including the method of reduction. A variety of reduction procedures can be applied to the preparation of supported metal catalysts. Previously, the authors used a solid-liquid reduction by sodium tetrahydroborate solution for preparing supported platinum catalysts. In this reduction, platinum precursors adsorbed on supports were brought into contact with the reducing solution. The alumina-supported platinum catalysts prepared in this way were found to display interesting activities in the liquid-phase hydrogenation of {alpha},{beta}-unsaturated aldehydes; they were highly selective to the formation of unsaturated alcohols. The selective hydrogenation of C=O bonds of {alpha},{beta}-unsaturated aldehydes is difficult to achieve with platinum catalysts without using some additives like tin and iron. The maximum temperature that the supported platinum catalysts went through was 110{degrees}C, required for the removal of water. This thermal history is a possible reason for the catalytic activity observed. Following those observations, in the present work, the authors have further examined the influence of reduction procedures by using hydrazine as well as sodium tetrahydroborate and different temperatures common during gas-phase reduction with hydrogen. The catalytic activity has been tested by the liquid-phase hydrogenation of benzaldehyde (BAL) in ethanol under mild conditions. 12 refs., 3 figs.

  20. Activity of Catalyst for Liquid Phase Methanol Synthesis%液相合成甲醇催化剂活性的研究

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The effects of reduction procedure, reaction temperature and composition of feed gas on the activity of a CuO-ZnO-Al2O3 catalyst for liquid phase methanol synthesis were studied. An optimized procedure different from conventional ones was developed to obtain higher activity and better stability of the catalyst. Both CO and CO2 in the feed gas were found to be necessary to maintain the activity of catalyst in the synthesis process.Reaction temperature was limited up to 523 K, otherwise the catalyst will be deactivated rapidly. Experimental results show that the catalyst deactivation is caused by sintering and fouling, and the effects of CO and CO2 on the catalyst activity are also investigated. The experimental results indicate that the formation of water in the methanol synthesis is negligible when the feed gas contains both CO and CO2. The mechanism for liquid-phase methanol synthesis was discussed and it differed slightly from that for gas-phase synthesis.

  1. Aqueous Phase Glycerol Reforming by PtMo Bimetallic Nano-Particle Catalyst: Product Selectivity and Structural Characterization

    Energy Technology Data Exchange (ETDEWEB)

    Stach E. A.; Dietrich, P.J.; Lobo-Lapidus, R.J.; Wu, T.; Sumer, A.; Akatay, M.C.; Fingland, B.R.; Guo, N.; Dumesic, J.A.; Marshall, C.L.; Jellinek, J.; Delgass, W.N.; Ribeiro, F.H.; Miller, J.T.

    2012-03-01

    A carbon supported PtMo aqueous phase reforming catalyst for producing hydrogen from glycerol was characterized by analysis of the reaction products and pathway, TEM, XPS and XAS spectroscopy. Operando X-ray absorption spectroscopy (XAS) indicates the catalyst consists of bimetallic nano-particles with a Pt rich core and a Mo rich surface. XAS of adsorbed CO indicates that approximately 25% of the surface atoms are Pt. X-ray photoelectron spectroscopy indicates that there is unreduced and partially reduced Mo oxide (MoO{sub 3} and MoO{sub 2}), and Pt-rich PtMo bimetallic nano-particles. The average size measured by transmission electron microscopy of the fresh PtMo nano-particles is about 2 nm, which increases in size to 5 nm after 30 days of glycerol reforming at 31 bar and 503 K. The catalyst structure differs from the most energetically stable structure predicted by density functional theory (DFT) calculations for metallic Pt and Mo atoms. However, DFT indicates that for nano-particles composed of metallic Pt and Mo oxide, the Mo oxide is at the particle surface. Subsequent reduction would lead to the experimentally observed structure. The aqueous phase reforming reaction products and intermediates are consistent with both C-C and C-OH bond cleavage to generate H{sub 2}/CO{sub 2} or the side product CH{sub 4}. While the H{sub 2} selectivity at low conversion is about 75%, cleavage of C-OH bonds leads to liquid products with saturated carbon atoms. At high conversions (to gas), these will produced additional CH{sub 4} reducing the H{sub 2} yield and selectivity.

  2. Kinetic studies on vapor phase carbonylation of methanol to acetic acid over Rh/Ys catalyst

    Institute of Scientific and Technical Information of China (English)

    柳忠阳; 潘平来; 朱长城; 袁国卿

    1997-01-01

    A novel catalyst Rh/Ys for the carbonylation of methanol to acetic acid with CH3I as the promoter shows excellent activity and selectivity.The reaction is kinetically controlled.The reaction rate is in proportion to the concentration of Rh and CH3I but has nothing to do with those of CH3OHH and CO.The surface active energy is Ea ~51.02 kJ/mol.A mechanism is also proposed.

  3. Liquid-Phase Deposition of Aligned Carbon Nanotubes Using Cobalt Catalyst

    Science.gov (United States)

    Nishitani-Gamo, Mikka; Shibasaki, Takeshi; Gamo, Hidenori; Nakagawa, Kiyoharu; Ando, Toshihiro

    2007-09-01

    We have recently developed a novel catalytic method for synthesizing a wide variety of carbon nanomaterials in the organic liquid. The method enabled us to realize a simple, rapid, and high-purity growth of carbon nanotubes (CNTs) in alcohol liquids. In this study, cobalt (Co) was used as a catalyst metal. In order to control the structure of carbon nanomaterials, we investigated the relationship between the growth conditions and the grown materials. Scanning electron microscopy (SEM) observation revealed that the morphology of the grown carbon nanomaterials strongly depended on the reaction temperature. Under the reaction temperature in the range from 873 to 973 K, fibriform deposits were mainly obtained. Transmission electron microscopy (TEM) revealed that the fibriform deposits were CNTs. The amount of the supported Co catalyst affected the fine tubular structure of the CNTs. We found that the existence of the reaction temperature of 873 K during the reaction time was essential for growing a fibriform structure in this study. The longer duration time for the reaction temperature of 1127 K resulted in a higher crystal quality for CNTs. We also demonstrated that the Co catalyst thermal oxidation at 1173 K resulted in the growth of aligned CNTs with the higher density.

  4. Evolutionary Adaptive Discovery of Phased Array Sensor Signal Identification

    Energy Technology Data Exchange (ETDEWEB)

    Timothy R. McJunkin; Milos Manic

    2011-05-01

    Tomography, used to create images of the internal properties and features of an object, from phased array ultasonics is improved through many sophisiticated methonds of post processing of data. One approach used to improve tomographic results is to prescribe the collection of more data, from different points of few so that data fusion might have a richer data set to work from. This approach can lead to rapid increase in the data needed to be stored and processed. It also does not necessarily lead to have the needed data. This article describes a novel approach to utilizing the data aquired as a basis for adapting the sensors focusing parameters to locate more precisely the features in the material: specifically, two evolutionary methods of autofocusing on a returned signal are coupled with the derivations of the forumulas for spatially locating the feature are given. Test results of the two novel methods of evolutionary based focusing (EBF) illustrate the improved signal strength and correction of the position of feature using the optimized focal timing parameters, called Focused Delay Identification (FoDI).

  5. Slurry phase Fischer-Tropsch synthesis: Cobalt plus a water-gas shift catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Yates, I.C.; Satterfield, C.N.

    1989-01-01

    The rate of synthesis gas consumption over a cobalt FischerTropsch catalyst was measured in a well-mixed, continuous-flow, slurry reactor at 220 to 240[degrees]C, 0.5 to 1.5 MPa, H[sub 2]/CO feed ratios of 1.5 to 3.5 and conversions of 7 to 68% of hydrogen and 11 to 73% of carbon monoxide. The inhibiting effect of carbon monoxide was determined quantitatively and a Langmuir-Hinshelwood-type equation of the following form was found to best represent the results: -R[sub H[sub 2+Co

  6. Glucose- and Cellulose-Derived Ni/C-SO3H Catalysts for Liquid Phase Phenol Hydrodeoxygenation

    Energy Technology Data Exchange (ETDEWEB)

    Kasakov, Stanislav; Zhao, Chen; Barath, Eszter; Chase, Zizwe A.; Fulton, John L.; Camaioni, Donald M.; Vjunov, Aleksei; Shi, Hui; Lercher, Johannes A.

    2015-01-19

    Sulfonated carbons were explored as functionalized supports for Ni nanoparticles to hydrodeoxygenate (HDO) phenol. Both hexadecane and water were used as solvents. The dual-functional Ni catalysts supported on sulfonated carbon (Ni/C-SO3H) showed high rates for phenol hydrodeoxygenation in liquid hexadecane, but not in water. Glucose and cellulose were precursors to the carbon supports. Changes in the carbons resulting from sulfonation of the carbons resulted in variations of carbon sheet structures, morphologies and the surface concentrations of acid sites. While the C-SO3H supports were active for cyclohexanol dehydration in hexadecane and water, Ni/C-SO3H only catalyzed the reduction of phenol to cyclohexanol in water. The state of 3 – 5 nm grafted Ni particles was analyzed by in situ X-ray absorption spectroscopy. The results show that the metallic Ni was rapidly formed in situ without detectable leaching to the aqueous phase, suggesting that just the acid functions on Ni/C-SO3H are inhibited in presence of water. Using in situ IR spectroscopy, it was shown that even in hexadecane, phenol HDO is limited by the dehydration step. Thus, phenol HDO catalysis was further improved by physically admixing C-SO3H with the Ni/C-SO3H catalyst to balance the two catalytic functions. The minimum addition of 7 wt.% C-SO3H to the most active of the Ni/C-SO3H catalysts enabled nearly quantitative conversion of phenol and the highest selectivity (90%) towards cyclohexane in 6 h, at temperatures as low as 473 K, suggesting that the proximity to Ni limits the acid properties of the support.

  7. An innovative catalyst system for slurry-phase Fischer-Tropsch synthesis: Cobalt plus a water-gas-shift catalyst. Final technical report

    Energy Technology Data Exchange (ETDEWEB)

    Satterfield, C.N.; Yates, I.C.; Chanenchuk, C.

    1991-07-01

    The feasibility of using a mechanical mixture of a Co/MgO/SiO{sub 2} Fischer-Tropsch catalyst and a Cu-ZnO/Al{sub 2}O{sub 3} water-gas-shift (WGS) catalyst for hydrocarbon synthesis in a slurry reactor has been established. Such a mixture can combine the superior product distribution from cobalt with the high activity for the WGS reaction characteristic of iron. Weight ratios of Co/MgO/SiO{sub 2} to Cu-ZnO/Al{sub 2}O{sub 3} of 0.27 and 0.51 for the two catalysts were studied at 240{degrees}C, 0.79 MPa, and in situ H{sub 2}/CO ratios between 0.8 and 3.0. Each catalyst mixture showed stable Fischer-Tropsch activity for about 400 hours-on-stream at a level comparable to the cobalt catalyst operating alone. The Cu-ZnO/Al{sub 2}O{sub 3} catalyst exhibited a very slow loss of activity under these conditions, but when operated alone it was stable in a slurry reactor at 200--220{degrees}C, 0.79--1.48 MPa, and H{sub 2}/CO in situ ratios between 1.0 and 2.0. The presence of the water-gas-shift catalyst did not affect the long-term stability of the primary Fischer-Tropsch selectivity, but did increase the extent of secondary reactions, such as l-alkene hydrogenation and isomerization.

  8. Catalysts for liquid phase oxidation of olefins and sulfur compounds; Catalyseurs pour l'oxydation en phase liquide d'olefines et de composes soufres

    Energy Technology Data Exchange (ETDEWEB)

    Palomeque Santiago, J.F.

    2002-07-01

    Several basic, acid and acid-base catalysts were studied for the epoxidation of olefins activated or not and dibenzo-thiophene.Hydrotalcite activation by thermic treatment and in situ re-hydration improves catalytic activity for 2-cyclohexene-1-one and isophorone. Bronsted basic sites were found to be more active than Lewis sites. Total conversion of 2-cyclohexene-1-one is reached in 1.5 h in polar solvents. W{sub 7}O{sub 24}{sup 6-} Iso-poly-anion was exchanged onto a meixnerite by a new preparation method, A meso-porous solid was obtained with good catalytic properties for cyclohexene epoxidation 100% selective to epoxide. W{sub 7}O{sub 24}{sup 6-} and WO{sub 5}{sup 2-} anions and phenyl and dodecyl-phospho-tungstates were grafted on hydrotalcites. Due to the acid-base characteristics of these solid catalysts, cyclohexene yields products of allylic reactions. Mg-La, and Mg-Al-La mixed oxides were synthesized and mixed phases were gotten. Their basic characteristics account for hydrogen peroxide decomposition which prevents DBT oxidation reaction to sulfone. On the contrary, Mg-Al re-hydrated hydrotalcites are very active for this reaction and remove 100% of sulfur compounds in 1 hour. New catalyst W-ZrO{sub 2} were synthesized with high acid properties. stable structure with temperature and high DBT conversion in less than 5 minutes of reaction. These catalytic systems can be applied for hydrocarbon desulfurization of fuels like naphtha, gas oil and kerosene. (author)

  9. Influence of Phases Content on Pt/TiO2, Pd/TiO2 Catalysts for Degradation of 4-Chlorophenol at Room Temperature

    Directory of Open Access Journals (Sweden)

    D. S. García-Zaleta

    2016-01-01

    Full Text Available Different Pt/TiO2 and Pd/TiO2 catalysts were prepared by sol-gel method. The influence of different amounts of noble metals (1–5 mol-% present on the microstructure as well as the photocatalytic property under 4-chlorophenol degradation was evaluated. The anatase phase was favored at low Pt content; however, the apparition of new phases after 3 mol-% (PtO suggests a saturation lattice considering our solubility limit at 1 mol-%. Similar trend was observed when Pd was added to the TiO2 lattice. The as-prepared catalysts were deeply characterized by X-ray diffraction (XRD with the Rietveld Method, Raman spectroscopy, high resolution scanning electron microscopy (HRSEM, scanning transmission electron microscopy (STEM, Brunauer-Emmett-Teller (BET adsorption analysis, and X-Ray photoelectron spectroscopy (XPS. Unit-cell parameter of TiO2 phases varied from 30 to 93 vol-% depending on the amount of Pt or Pd added to the composite. HRTEM and HRSEM identified the phases in the catalysts and confirmed the nanometric size and morphology of the catalysts. An improvement in removal efficiency of 4-chlorophenol was obtained in all the specimens compared with the commercial Degussa P25, which can be explained in terms of phase composition and modification of the band gap.

  10. KINETIC STUDY OF SELECTIVE GAS-PHASE OXIDATION OF ISOPROPANOL TO ACETONE USING MONOCLINIC ZRO2 AS A CATALYST

    Directory of Open Access Journals (Sweden)

    Mohammad Sadiq

    2015-08-01

    Full Text Available Zirconia was prepared by a precipitation method and calcined at 723 K, 1023 K, and 1253 K in order to obtain monoclinic zirconia. The prepared zirconia was characterized by XRD, SEM, EDX, surface area and pore size analyzer, and particle size analyzer. Monoclinic ZrO2 as a catalyst was used for the gas-phase oxidation of isopropanol to acetone in a Pyrex-glass-flow-type reactor with a temperature range of 443 K - 473 K. It was found that monoclinic ZrO2 shows remarkable catalytic activity (68% and selectivity (100% for the oxidation of isopropanol to acetone. This kinetic study reveals that the oxidation of isopropanol to acetone follows the L-H mechanism.

  11. POLYMER-SUPPORTED SINGLE AND MIXED AMMONIUM AND PHOSPHONIUM SALTS AS CATALYSTS FOR PHASE-TRANSFER REACTIONS

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    In this study was to investigate, by phase-transfer catalysis, the activity of single and mixed ammonium and phosphonium salts grafted on a "gel-type" styrene-7% divinylbenzene copolymer in the oxidation of benzyl alcohol with hydrogen peroxide.A wide variety of catalysts with different quaternary groups and different quaternary chain length substituents were examined.The activity of single "onium" salts increases as a consequence of the association of ammonium and phosphonium salts grafted on the same polymeric support. The activity of polymer-supported ammonium and phosphonium salts increases with the number of carbon atoms contained in the alkyl radicals of the -onium and of the functionalization degree with phosphonium groups.

  12. Liquid-phase benzene isopropylation using alumina solid lewis superacid-supported platinum catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Yamada, K.; Honda, K.; Kitahara, D.; Miyamoto, M.; Shiga, M.; Ayame, A. [Muroran Inst. of Tech., Hokkaido (Japan)

    2000-03-01

    Supporting platinum on alumina solid Lewis superacid (AmLSA; J. C. S., Chem. Commun., 645 (1989)) was prepared by using of the in situ CVD technique at 773 K with Ar{sup +}-sputtered platinum fine particles and dry chlorine, followed by reduction with hydrogen at 673 K. The AmLSA-supported platinum catalyst (Pt/AmLSA) was applied to isopropylation of benzene with propene in the hydrogen stream at ambient temperature, using a semibatch reactor. Products were mono-, di-, tri-, and tetra-isopropylbenzenes. Conversion of propene to propane was below 1 %, and a trace amount of cyclohexane from benzene was also observed. Deactivation of AmLSA due to strong adsorption of poly-substituted benzenes and/or propene oligomers was remarkably depressed by supporting platinum and supplying hydrogen into the propene stream. Consequently, the activity of Pt/AmLSA catalyst had increased almost 1.5 times that of AmLSA. At the same level of benzene conversion, the product distribution f isopropyl-substituted benzenes obtained on Pt/AmLSA was identical to that on AmLSA, and had shifted slightly into the mono-substituted benzene side compared with the result on AmLSA in the absence of hydrogen. In the isopropylation of benzene with 2-chloropropane, the results quite similar to those described above were obtained. From the above observations, synergetic effects of platinum supporting and hydrogen supplying were considered to be due to the presence of hydrogen atoms spilled over from the platinum surface to the strong Lewis acid sites. (author)

  13. Uniformly active phase loaded selective catalytic reduction catalysts (V{sub 2}O{sub 5}/TNTs) with superior alkaline resistance performance

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Haiqiang; Wang, Penglu [Key Laboratory of Environment Remediation and Ecological Health, Ministry of Education, College of Environmental & Resources Science, Zhejiang University, 310058 Hangzhou (China); Zhejiang Provincial Engineering Research Center of Industrial Boiler & Furnace Flue Gas Pollution Control, Hangzhou 310027 (China); Chen, Xiongbo [South China Institute of Environmental Sciences, Ministry of Environmental Protection, Guangzhou 510655 (China); Wu, Zhongbiao, E-mail: zbwu@zju.edu.cn [Key Laboratory of Environment Remediation and Ecological Health, Ministry of Education, College of Environmental & Resources Science, Zhejiang University, 310058 Hangzhou (China); Zhejiang Provincial Engineering Research Center of Industrial Boiler & Furnace Flue Gas Pollution Control, Hangzhou 310027 (China)

    2017-02-15

    Highlights: • VOSO{sub 4} exhibited better synergistic effect with titanate nanotubes than NH{sub 4}VO{sub 3}. • Ion-exchange reaction occurs between VOSO{sub 4} and titanate nanotubes. • Ion-exchange resulting in uniformly vanadium distribution on titanate nanotubes. • VOSO{sub 4}-based catalyst exhibited impressive SCR activity and alkaline resistance. - Abstract: In this work, protonated titanate nanotubes was performed as a potential useful support and different vanadium precursors (NH{sub 4}VO{sub 3} and VOSO{sub 4}) were used to synthesize deNO{sub x} catalysts. The results showed that VOSO{sub 4} exhibited better synergistic effect with titanate nanotubes than NH{sub 4}VO{sub 3}, which was caused by the ion-exchange reaction. Then high loading content of vanadium, uniformly active phase distribution, better dispersion of vanadium, more acid sites, better V{sup 5+}/V{sup 4+} redox cycles and superior oxygen mobility were achieved. Besides, VOSO{sub 4}-based titanate nanotubes catalysts also showed enhanced alkaline resistance than particles (P25) based catalysts. It was strongly associated with its abundant acid sites, large surface area, flexible redox cycles and oxygen transfer ability. For the loading on protonated titanate nanotubes, active metal with cation groups was better precursors than anion ones. V{sub 2}O{sub 5}/TNTs catalyst was a promising substitute for the commercial vanadium catalysts and the work conducted herein provided a useful idea to design uniformly active phase loaded catalyst.

  14. SYNTHESIS AND APPLICATIONS OF CROSS-LINKED POLY(DIALLYLDIMETHYL AMMONIUM CHLORIDE) AND ITS DERIVATIVE COPOLYMERS AS EFFICIENT PHASE TRANSFER CATALYST FOR NUCLEOPHILIC SUBSTITUTION REACTIONS

    Institute of Scientific and Technical Information of China (English)

    Hossein Mahdavi; Mahdi Mahmoudian

    2011-01-01

    Cross-linked poly(diallyldimethylammonium chloride) and its derivative eopolymers were synthesized and used as phase transfer catalyst in the nucleophilic substitution reaction especially halogen exchange reactions. In addition, the effect of hydrophilic-hydrophobic character of the polymers in the nucleophilic reactions was investigated.

  15. Synthesis of 2,3-epoxy-1-phenyl-3-aryl-1-propanone by combination of phase transfer catalyst and ultrasound irradiation

    Directory of Open Access Journals (Sweden)

    Ji-Tai Li

    2009-03-01

    Full Text Available Seven 2,3-epoxy-1-phenyl-3-aryl-1-propanones were synthesized via epoxidation of thecorresponding 1-phenyl-3-aryl-2-propen-1-ones with 30% aqueous hydrogen peroxide in 74-99% yields usingbenzyldimethyltetradecylammonium chloride as phase transfer catalyst under ultrasound irradiation.

  16. 2D and 3D imaging of the gas phase close to an operating model catalyst by planar laser induced fluorescence.

    Science.gov (United States)

    Blomberg, Sara; Zhou, Jianfeng; Gustafson, Johan; Zetterberg, Johan; Lundgren, Edvin

    2016-11-16

    In recent years, efforts have been made in catalysis related surface science studies to explore the possibilities to perform experiments at conditions closer to those of a technical catalyst, in particular at increased pressures. Techniques such as high pressure scanning tunneling/atomic force microscopy (HPSTM/AFM), near ambient pressure x-ray photoemission spectroscopy (NAPXPS), surface x-ray diffraction (SXRD) and polarization-modulation infrared reflection absorption spectroscopy (PM-IRAS) at semi-realistic conditions have been used to study the surface structure of model catalysts under reaction conditions, combined with simultaneous mass spectrometry (MS). These studies have provided an increased understanding of the surface dynamics and the structure of the active phase of surfaces and nano particles as a reaction occurs, providing novel information on the structure/activity relationship. However, the surface structure detected during the reaction is sensitive to the composition of the gas phase close to the catalyst surface. Therefore, the catalytic activity of the sample itself will act as a gas-source or gas-sink, and will affect the surface structure, which in turn may complicate the assignment of the active phase. For this reason, we have applied planar laser induced fluorescence (PLIF) to the gas phase in the vicinity of an active model catalysts. Our measurements demonstrate that the gas composition differs significantly close to the catalyst and at the position of the MS, which indeed should have a profound effect on the surface structure. However, PLIF applied to catalytic reactions presents several beneficial properties in addition to investigate the effect of the catalyst on the effective gas composition close to the model catalyst. The high spatial and temporal resolution of PLIF provides a unique tool to visualize the on-set of catalytic reactions and to compare different model catalysts in the same reactive environment. The technique can be

  17. 2D and 3D imaging of the gas phase close to an operating model catalyst by planar laser induced fluorescence

    Science.gov (United States)

    Blomberg, Sara; Zhou, Jianfeng; Gustafson, Johan; Zetterberg, Johan; Lundgren, Edvin

    2016-11-01

    In recent years, efforts have been made in catalysis related surface science studies to explore the possibilities to perform experiments at conditions closer to those of a technical catalyst, in particular at increased pressures. Techniques such as high pressure scanning tunneling/atomic force microscopy (HPSTM/AFM), near ambient pressure x-ray photoemission spectroscopy (NAPXPS), surface x-ray diffraction (SXRD) and polarization-modulation infrared reflection absorption spectroscopy (PM-IRAS) at semi-realistic conditions have been used to study the surface structure of model catalysts under reaction conditions, combined with simultaneous mass spectrometry (MS). These studies have provided an increased understanding of the surface dynamics and the structure of the active phase of surfaces and nano particles as a reaction occurs, providing novel information on the structure/activity relationship. However, the surface structure detected during the reaction is sensitive to the composition of the gas phase close to the catalyst surface. Therefore, the catalytic activity of the sample itself will act as a gas-source or gas-sink, and will affect the surface structure, which in turn may complicate the assignment of the active phase. For this reason, we have applied planar laser induced fluorescence (PLIF) to the gas phase in the vicinity of an active model catalysts. Our measurements demonstrate that the gas composition differs significantly close to the catalyst and at the position of the MS, which indeed should have a profound effect on the surface structure. However, PLIF applied to catalytic reactions presents several beneficial properties in addition to investigate the effect of the catalyst on the effective gas composition close to the model catalyst. The high spatial and temporal resolution of PLIF provides a unique tool to visualize the on-set of catalytic reactions and to compare different model catalysts in the same reactive environment. The technique can be

  18. Polymer-Supported Cinchona Alkaloid-Derived Ammonium Salts as Recoverable Phase-Transfer Catalysts for the Asymmetric Synthesis of α-Amino Acids

    Directory of Open Access Journals (Sweden)

    Carmen Nájera

    2004-04-01

    Full Text Available Alkaloids such as cinchonidine, quinine and N-methylephedrine have been N-alkylated using polymeric benzyl halides or co-polymerized and then N-alkylated, thus affording a series of polymer-supported chiral ammonium salts which have been employed as phase-transfer catalysts in the asymmetric benzylation of an N-(diphenylmethyleneglycine ester. These new polymeric catalysts can be easily recovered by simple filtration after the reaction and reused. The best ee’s were achieved when Merrifield resin-anchored cinchonidinium ammonium salts were employed.

  19. High-pressure vapor-phase hydrodeoxygenation of lignin-derived oxygenates to hydrocarbons by a PtMo bimetallic catalyst: Product selectivity, reaction pathway, and structural characterization

    Energy Technology Data Exchange (ETDEWEB)

    Yohe, Sara L.; Choudhari, Harshavardhan J.; Mehta, Dhairya D.; Dietrich, Paul J.; Detwiler, Michael D.; Akatay, Cem M.; Stach, Eric A.; Miller, Jeffrey T.; Delgass, W. Nicholas; Agrawal, Rakesh; Ribeiro, Fabio H.

    2016-12-01

    High-pressure, vapor-phase, hydrodeoxygenation (HDO) reactions of dihydroeugenol (2-methoxy-4-propylphenol), as well as other phenolic, lignin-derived compounds, were investigated over a bimetallic platinum and molybdenum catalyst supported on multi-walled carbon nanotubes (5%Pt2.5%Mo/MWCNT). Hydrocarbons were obtained in 100% yield from dihydroeugenol, including 98% yield of the hydrocarbon propylcyclohexane. The final hydrocarbon distribution was shown to be a strong function of hydrogen partial pressure. Kinetic analysis showed three main dihydroeugenol reaction pathways: HDO, hydrogenation, and alkylation. The major pathway occurred via Pt catalyzed hydrogenation of the aromatic ring and methoxy group cleavage to form 4-propylcyclohexanol, then Mo catalyzed removal of the hydroxyl group by dehydration to form propylcyclohexene, followed by hydrogenation of propylcyclohexene on either the Pt or Mo to form the propylcyclohexane. Transalkylation by the methoxy group occurred as a minor side reaction. Catalyst characterization techniques including chemisorption, scanning transmission electron microscopy, X-ray absorption spectroscopy, and X-ray photoelectron spectroscopy were employed to characterize the catalyst structure. Catalyst components identified were Pt particles, bimetallic PtMo particles, a Mo carbide-like phase, and Mo oxide phases.

  20. Phase Composition of Ni/Mg1−xNixO as a Catalyst Prepared for Selective Methanation of CO in H2-Rich Gas

    Directory of Open Access Journals (Sweden)

    Mengmeng Zhang

    2015-01-01

    Full Text Available Supported Ni catalysts Ni/Mg1−xNixO were prepared by reducing samples NiO-MgO in H2/N2 mixture gas at 500°C~800°C for selective methanation of CO in H2-rich gas (CO-SMET. The samples NiO-MgO were obtained by heating water slurry of MgO and Ni(NO32 in a rotary evaporator at 80°C and a final calcination in air at 400°C~800°C. X-ray diffraction (XRD and temperature programmed reduction (TPR measurements demonstrate that the samples NiO-MgO were composed of solid solution Mg1−yNiyO as the main phase and a minor amount of NiO at calcination temperature of 400°C, and amount of the NiO was decreased as calcination temperature increased. Phase composition of the catalysts Ni/Mg1−xNixO was estimated by the Rietveld method. Effects of reduction temperature, feed Ni/Mg ratio, and calcination temperature on phase composition and catalytic activity of the catalysts were investigated. It is clear that CO conversion was generally enhanced by an increased amount of metallic Ni of the catalysts.

  1. Research on Si-Al based catalysts prepared by complete liquid-phase method for DME synthesis in a slurry reactor

    Science.gov (United States)

    Li, Zhihong; Zuo, Zhijun; Huang, Wei; Xie, Kechang

    2011-01-01

    A series of Si-Al based DME synthesis catalysts were prepared by complete liquid-phase method and characterized by in situ XPS, XRD, N 2 adsorption and NH 3-TPD analyses. Based on the results, the addition of Si could adjust the pore structure and surface acidity of catalyst, exhibiting a strong promoting effect on the CO conversion and DME selectivity. However, when Si/Al ratio is higher, Si would cover active sites and increase the amount of strong acidity sites, causing the reduction in catalytic activity. It was found from in situ XPS characterization that Cu 0 is the active center of methanol synthesis in DME production, and the addition of Si changes the chemical surroundings of active components and weaken the interaction between Cu, Zn and Al, which maybe give rise to the decrease in catalyst stability.

  2. Gauss linear frequency modulation wavelet transforms and its application to seismic phases identification

    Institute of Scientific and Technical Information of China (English)

    刘希强; 周惠兰; 曹文海; 李红; 李永红; 季爱东

    2002-01-01

    Based on the characteristics of gradual change style seismic signal onset which has more high frequency signal components but less magnitude, this paper selects Gauss linear frequency modulation wavelet as base function to study the change characteristics of Gauss linear frequency modulation wavelet transform with difference wavelet and signal parameters, analyzes the error origin of seismic phases identification on the basis of Gauss linear frequency modulation wavelet transform, puts forward a kind of new method identifying gradual change style seismic phases with background noise which is called fixed scale wavelet transform ratio, and presents application examples about simulation digital signal and actual seismic phases recording onsets identification.

  3. Aqueous-phase hydrogenation of acetic acid over transition metal catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Olcay, Hakan [University of Massachusetts, Amherst; Xu, Lijun [ORNL; Xu, Ye [ORNL; Huber, George [University of Massachusetts, Amherst

    2010-01-01

    Catalytic hydrogenation of acetic acid to ethanol has been carried out in aqueous phase on several metals, with ruthenium being the most active and selective. DFT calculations suggest that the initial CO bond scission yielding acetyl is the key step and that the intrinsic reactivity of the metals accounts for the observed activity.

  4. Unsupported PVA- and PVP-stabilized Pd nanoparticles as catalyst for nitrite hydrogenation in aqueous phase

    NARCIS (Netherlands)

    Zhao, Y.; Baeza, J.A.; Koteswara Rao, N.; Calvo, L.; Gilarranz, M.A.; Li, Y.D.; Lefferts, L.

    2014-01-01

    Pd colloids stabilized with polyvinyl alcohol (PVA) and polyvinylpyrrolidone (PVP) have been prepared, characterized with TEM, zeta potential measurements, CO chemisorption in aqueous phase, and ATR-IR spectroscopy using CO as a probe molecule, and finally tested for performance in nitrite hydrogena

  5. Liquid-phase oxidation of naphthalene with H ₂O ₂ in the presence of ordered mesoporous V-m-Al ₂O ₃ catalysts

    Indian Academy of Sciences (India)

    ZHIWEI ZHOU; YANG YU; JUAN QIN; JIAQI ZHANG; FULIN CHENG; WENLIANG WU

    2017-09-01

    The ordered mesoporous V-m- Al ₂O ₃ catalysts were successfully synthesized via a facile one-pot evaporation-induced self-assembly (EISA) strategy and applied in the liquid-phase oxidation of naphthalene with hydrogen peroxide in the presence of ascorbic acid as a reductant. The physicochemical properties of the catalysts were investigated using various techniques, like XRD, N₂ sorption, UV-Vis spectra, Raman spectroscopy, XPS, XRF and TEM. Small-angle XRD, N₂ sorption and TEM results show that mesoporous V-m- Al ₂O ₃ catalysts possess a highly ordered mesostructure with large surface areas and narrow pore-size distributions. Highangle XRD, UV-Vis spectra and Raman spectroscopy results indicate that VOx species were homogeneously incorporated in thematrix ofmesoporous Al ₂O ₃.The catalytic performance in the liquid oxidation of naphthalene with H ₂O ₂ over 8V-m- Al ₂O ₃ catalyst (naphthalene conversion 45.4% and phthalic anhydride selectivity 61.0%) was higher than other catalysts. The vanadium species incorporated in the 8V-m- Al ₂O ₃ sample were stable, and its catalytic stability was kept well even after repeated use for 5 times, which indicates a green and economical pathway for naphthalene degradation.

  6. Pyridine-H5PMo10V2O40 hybrid catalysts for liquid-phase hydroxylation of benzene to phenol with molecular oxygen

    Institute of Scientific and Technical Information of China (English)

    2009-01-01

    Pyridine(Py)-modified Keggin-type vanadium-substituted heteropoly acids(PynPMo10V2O40,n=1 to 5) were prepared by a precipitation method as organic/inorganic hybrid catalysts for direct hydroxylation of benzene to phenol in a pressured batch reactor and their structures were detected by FT-IR.Among various catalysts,Py3PMo10V2O40 exhibits the highest catalytic activity(yield of phenol,11.5%),without observing the formation of catechol,hydroquinone and benzoquinone in the reaction with 80 vol% aqueous acetic acid,molecular oxygen and ascorbic acid used as the solvent,oxidant and reducing reagent,respectively.Influences of reaction temperature,reaction time,oxygen pressure,amount of ascorbic acid and catalyst on yield of phenol were investigated to obtain the optimal reaction conditions for phenol formation.Pyridine can greatly promote the catalytic activity of the Py-free catalyst(H5PMo10V2O40),mostly because the organic π electrons in the hybrid catalyst may extend their conjugation to the inorganic framework of heteropoly acid and dramatically modify the redox properties,at the same time,pyridine adsorbed on heteropoly acids can promote the effect of "pseudo-liquid phase",thus accounting for the enhancement of phenol yield.

  7. Pyridine-H5PMo10V2O40 hybrid catalysts for liquid-phase hydroxylation of benzene to phenol with molecular oxygen

    Institute of Scientific and Technical Information of China (English)

    GE HanQing; LENG Yan; ZHANG FuMin; PIAO JiaRui; ZHOU ChangJiang; WANG Jun

    2009-01-01

    Pyridine(Py)-modified Keggin-type vanadium-substituted heteropoly acids (PynPMo10V2O40,n=1 to 5) were prepared by a precipitation method as organic/inorganic hybrid catalysts for direct hydroxylation of benzene to phenol in a pressured batch reactor and their structures were detected by FT-IR.Among various catalysts,Py3PMo10V2O40 exhibits the highest catalytic activity (yield of phenol,11.5%),without observing the formation of catechol,hydroquinone and benzoquinone in the reaction with 80 vol% aqueous acetic acid,molecular oxygen and ascorbic acid used as the solvent,oxidant and reducing reagent,respectively.Influences of reaction temperature,reaction time,oxygen pressure,amount of ascorbic acid and catalyst on yield of phenol were investigated to obtain the optimal reaction conditions for phenol formation.Pyridine can greatly promote the catalytic activity of the Py-free catalyst (H5PMo10V2O40),mostly because the organic π electrons in the hybrid catalyst may extend their conjugation to the inorganic framework of heteropoly acid and dramatically modify the redox properties,at the same time,pyridine adsorbed on heteropoly acids can promote the effect of "pseudo-liquid phase",thus accounting for the enhancement of phenol yield.

  8. Effect of CeO₂ addition to Al₂O₃ supports for Pt catalysts on the aqueous-phase reforming of glycerol.

    Science.gov (United States)

    Rahman, M M; Church, Tamara L; Minett, Andrew I; Harris, Andrew T

    2013-06-01

    A series of Pt catalysts supported on Al₂O₃ that was doped with different amounts of CeO₂ was developed, characterized, and tested in the aqueous-phase reforming (APR) of glycerol to H₂. Catalyst 3Pt/3CeAl, which bore 3 wt% Pt on a support that contained 3 wt % CeO₂, showed the highest carbon conversion to gas (85%) and the highest H₂ yield (80%) for a feedstock of 1 wt% glycerol in water at 240 °C and 40 bar. A CeO₂/Al₂O₃ support with only 1 wt% Pt also showed high H₂ selectivity and carbon conversion to gas, as well as a much lower CH₄ yield than the benchmark 3Pt/Al catalyst, clearly demonstrating that doping the support with 3 wt% CeO2 improved the APR of glycerol. H₂ chemisorption results showed that the highest metal dispersion (58%) and active surface area (4.3 m(2)g(-1)) were achieved for the support that contained 3 wt% CeO₂, and this effect appeared to be primarily responsible for the high H₂ yield and carbon conversion to gas. No CO was observed in the product gas; therefore, this gas could potentially be used directly in proton exchange membrane fuel cells. Thus, including CeO₂ in the Al₂O₃ catalyst support enhanced both the activity and selectivity towards H₂ of a Pt catalyst for the APR of glycerol.

  9. Factors influencing catalytic wet peroxide oxidation of maleic acid in aqueous phase over copper/micelle templated silica-3-aminopropyltrimethoxysilane catalyst.

    Science.gov (United States)

    Daniel, Lilian; Katima, Jamidu H Y

    2009-01-01

    Catalytic wet peroxide oxidation (CWPO) of initial maleic acid feed concentration (0.005 to 0.03 M) was carried out in a temperature range of 20-50 degrees Celsius, on micelle templated silica-3-aminopropyltrimethoxysilane (MTS-AMP) supported copper catalyst. The influence of various operating parameters such as initial feed concentration of maleic acid, temperature, catalyst loading and the stability of the catalyst were investigated. CWPO reactions were performed in a stirred batch reactor at an atmospheric pressure in the presence of H(2)O(2) as an oxidant. Total conversion of maleic acid into acetic acid was obtained under mild conditions (i.e. atmospheric pressure and 40 degrees Celsius). Blank experiments showed no measurable maleic acid conversion (i.e. only approximately 0.5% conversion of initial maleic acid), indicating that a significant oxidation reaction of maleic acid is enhanced by the presence of a catalyst. Copper on micelle templated silica-3-aminopropyltrimethoxysilane catalyst therefore was found to be suitable for aqueous phase oxidation of maleic acid with 100% of maleic acid conversion.

  10. From the Lindlar catalyst to supported ligand-modified palladium nanoparticles: selectivity patterns and accessibility constraints in the continuous-flow three-phase hydrogenation of acetylenic compounds.

    Science.gov (United States)

    Vilé, Gianvito; Almora-Barrios, Neyvis; Mitchell, Sharon; López, Núria; Pérez-Ramírez, Javier

    2014-05-12

    Site modification and isolation through selective poisoning comprise an effective strategy to enhance the selectivity of palladium catalysts in the partial hydrogenation of triple bonds in acetylenic compounds. The recent emergence of supported hybrid materials matching the stereo- and chemoselectivity of the classical Lindlar catalyst holds promise to revolutionize palladium-catalyzed hydrogenations, and will benefit from an in-depth understanding of these new materials. In this work, we compare the performance of bare, lead-poisoned, and ligand-modified palladium catalysts in the hydrogenation of diverse alkynes. Catalytic tests, conducted in a continuous-flow three-phase reactor, coupled with theoretical calculations and characterization methods, enable elucidation of the structural origins of the observed selectivity patterns. Distinctions in the catalytic performance are correlated with the relative accessibility of the active site to the organic substrate, and with the adsorption configuration and strength, depending on the ensemble size and surface potentials. This explains the role of the ligand in the colloidally prepared catalysts in promoting superior performance in the hydrogenation of terminal and internal alkynes, and short-chain alkynols. In contrast, the greater accessibility of the active surface of the Pd-Pb alloy and the absence of polar groups are shown to be favorable in the conversion of alkynes containing long aliphatic chains and/or ketone groups. These findings provide detailed insights for the advanced design of supported nanostructured catalysts.

  11. Liquid Phase Hydrogenation of Benzalacetophenone:Effect of Solvent,Catalyst Support,Catalytic Metal and Reaction Conditions%Liquid Phase Hydrogenation of Benzalacetophenone: Effect of Solvent, Catalyst Support, Catalytic Metal and Reaction Conditions

    Institute of Scientific and Technical Information of China (English)

    Achim STOLLE; Christine SCHMOGER; Bernd ONDRUSCHKA; Werner BONRATH; Thomas F. KELLER; Klaus D. JANDT

    2011-01-01

    Innovative catalysts based on a “porous glass” support material were developed and investigated for the reduction of benzalacetophenone.The easy preparation conditions and possibility to use different metals (e.g.Pd,Pt,Rh) for impregnation gave a broad variety of these catalysts.Hydrogenation experiments with these supported catalysts were carried out under different hydrogen pressures and temperatures.Porous glass catalysts with Pd as the active component gave chemoselective hydrogenation of benzalacetophenone,while Pt- and Rh-catalysts tended to further reduce the carbonyl group,especially at elevated hydrogen pressures and temperatures.Kinetic analysis of the reactions revealed these had zero order kinetics,which was independent of the type of porous glass support and solvent used.

  12. Oxidation catalyst

    Science.gov (United States)

    Ceyer, Sylvia T.; Lahr, David L.

    2010-11-09

    The present invention generally relates to catalyst systems and methods for oxidation of carbon monoxide. The invention involves catalyst compositions which may be advantageously altered by, for example, modification of the catalyst surface to enhance catalyst performance. Catalyst systems of the present invention may be capable of performing the oxidation of carbon monoxide at relatively lower temperatures (e.g., 200 K and below) and at relatively higher reaction rates than known catalysts. Additionally, catalyst systems disclosed herein may be substantially lower in cost than current commercial catalysts. Such catalyst systems may be useful in, for example, catalytic converters, fuel cells, sensors, and the like.

  13. Excited-state dynamics of a ruthenium(II) catalyst studied by transient photofragmentation in gas phase and transient absorption in solution

    Energy Technology Data Exchange (ETDEWEB)

    Imanbaew, D.; Nosenko, Y. [Fachbereich Chemie, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 52–54, 67663 Kaiserslautern (Germany); Forschungszentrum OPTIMAS, Erwin-Schrödinger-Str. 46, 67663 Kaiserslautern (Germany); Kerner, C. [Fachbereich Chemie, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 52–54, 67663 Kaiserslautern (Germany); Chevalier, K.; Rupp, F. [Fachbereich Physik, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 46, 67663 Kaiserslautern (Germany); Riehn, C., E-mail: riehn@chemie.uni-kl.de [Fachbereich Chemie, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 52–54, 67663 Kaiserslautern (Germany); Forschungszentrum OPTIMAS, Erwin-Schrödinger-Str. 46, 67663 Kaiserslautern (Germany); Thiel, W.R. [Fachbereich Chemie, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 52–54, 67663 Kaiserslautern (Germany); Diller, R. [Fachbereich Physik, Technische Universität Kaiserslautern, Erwin-Schrödinger-Str. 46, 67663 Kaiserslautern (Germany)

    2014-10-17

    Graphical abstract: - Highlights: • Ultrafast dynamics of new Ru(II) catalysts investigated in gas phase and solution. • Catalyst activation (HCl loss) achieved in ion trap by UV photoexcitation. • Electronic relaxation proceeds by IVR and IC followed by ground state dissociation. • No triplet formation in contrast to other Ru-polypyridine complexes. • Solvent prohibits catalyst activation in solution by fast vibrational cooling. - Abstract: We report studies on the excited state dynamics of new ruthenium(II) complexes [(η{sup 6}-cymene)RuCl(apypm)]PF{sub 6} (apypm=2-NR{sub 2}-4-(pyridine-2-yl)-pyrimidine, R=CH{sub 3} (1)/H (2)) which, in their active form [1{sup +}-HCl] and [2{sup +}-HCl], catalyze the transfer hydrogenation of arylalkyl ketones in the absence of a base. The investigations encompass femtosecond pump–probe transient mass spectrometry under isolated conditions and transient absorption spectroscopy in acetonitrile solution, both on the cations [(η{sup 6}-cymene)RuCl(apypm)]{sup +} (1{sup +}, 2{sup +}). Gas phase studies on mass selected ions were performed in an ESI ion trap mass spectrometer by transient photofragmentation, unambiguously proving the formation of the activated catalyst species [1{sup +}-HCl] or [2{sup +}-HCl] after photoexcitation being the only fragmentation channel. The primary excited state dynamics in the gas phase could be fitted to a biexponential decay, yielding time constants of <100 fs and 1–3 ps. Transient absorption spectroscopy performed in acetonitrile solution using femtosecond UV/Vis and IR probe laser pulses revealed additional deactivation processes on longer time scales (∼7–12 ps). However, the formation of the active catalyst species after photoexcitation could not be observed in solution. The results from both studies are compared to former CID investigations and DFT calculations concerning the activation mechanism.

  14. Magnetic catalyst bodies

    NARCIS (Netherlands)

    Teunissen, Wendy; Bol, A.A.; Geus, John W.

    2001-01-01

    After a discussion about the importance of the size of the catalyst bodies with reactions in the liquid-phase with a suspended catalyst, the possibilities of magnetic separation are dealt with. Deficiencies of the usual ferromagnetic particles are the reactivity and the clustering of the particles.

  15. Characterization and parametrical study of Rh-TPPTS supported ionic liquid phase (SILP) catalysts for ethylene hydroformylation

    DEFF Research Database (Denmark)

    Hanh, Nguyen Thi Ha; Duc, Duc Truong; Thang, Vu Dao

    2012-01-01

    , BET surface area and pore morphology of the catalysts depended on the content of ionic liquid. Hence, catalysts with high ionic liquid loading content showed deactivation at high reaction temperatures, possibly caused by redistribution of ionic liquid out of the pores under these conditions. (C) 2012...

  16. Phase purity of NiCo2O4, a catalyst candidate for electrolysis of water

    Science.gov (United States)

    Singer, J.; Fielder, W. L.; Garlick, R. G.; Negas, T.

    1987-01-01

    NiCo2O4 is shown to be difficult to obtain as a pure phase, and may never have been so obtained. High resolution x-ray diffractometry is required for its precise characterization. Film XRD is not likely to show the asymmetry in the spinel diffraction lines, caused by poorly crystallized NiO, as seen in diffractometer traces. The Co3O4 which is expected to accompany NiO as an impurity in NiCo2O4 syntheses has the same diffraction pattern as the binary oxide. Firings of the co-precipitated hydroxides at 300, 350, and 400 C, including one in pure O2, failed to produce single phase cobaltate. Scanning electron microscopy showed all the sintered products to range over several orders of magnitude in agglomerate/particle size. Surface areas by BET were all in the range 40 to 110 m sq/g, equivalent to particles of 200 to 100 Angstrom diameter. The spinel diffraction line breadths were compatible with those approximate dimensions.

  17. Development of latent fingermarks on surfaces submerged in water: Optimization studies for phase transfer catalyst (PTC) based reagents.

    Science.gov (United States)

    Jasuja, O P; Kumar, Parveen; Singh, Gagandeep

    2015-09-01

    The use of a phase transfer catalyst (PTC) based reagent for the development of latent fingermarks is relatively a recent one and therefore a thorough evaluation is required before making any suggestion for its use in the routine fingermark development protocol. In the present study, non-porous surfaces including the sticky side of adhesive tapes loaded with latent fingermarks (eccrine, groomed and natural fingermarks) were submerged in water for different times and were treated with a PTC based reagent to develop fingermarks. The PTC based reagent was able to develop latent fingermarks on various surfaces submerged in water for different time intervals. The proposed method has been compared with standard methods like superglue fuming, small particle reagent and gentian violet (for adhesive tapes). The results have shown that the duration of submersion and the method selected for visualization have influences on the quality of developed fingermarks. The performance of the PTC technique against conventional methods was evaluated and compared thoroughly as a part of the optimization studies for the reagent. Copyright © 2015 Forensic Science Society. Published by Elsevier Ireland Ltd. All rights reserved.

  18. Identification of an anomalous phase in Ni–W electrodeposits

    DEFF Research Database (Denmark)

    Mizushima, Io; Tang, Peter Torben; Somers, Marcel A. J.

    2008-01-01

    In the present work Ni–W layers electrodeposited from electrolytes based on NiSO4, Na2WO4, citrate, glycine and triethanolamine are characterized with glow discharge optical emission spectroscopy (GD-OES) and X-ray diffraction analysis (XRD). XRD showed the occurrence of an anomalous phase in the...

  19. Hot wire chemical vapor deposition chemistry in the gas phase and on the catalyst surface with organosilicon compounds.

    Science.gov (United States)

    Shi, Yujun

    2015-02-17

    shown that ring-opening reactions play a vital role in characterizing the reaction chemistry. On the other hand, exocyclic Si-H(CH3) bond cleavages are more important in the less-puckered disilacyclobutane molecules. Metal filaments are essential in HWCVD since they serve as catalysts to decompose precursor gases to reactive species, which initiate gas-phase reaction chemistry and thin film growth. We discuss the structural changes in metal filaments when exposed to various precursor gases. Depending on the nature of the radical intermediates formed from the hot-wire decomposition and subsequent gas-phase reactions, metal silicides and carbides can be formed. Overall, study of the gas-phase reaction chemistry in HWCVD provides important knowledge of the chemical species produced prior to their deposition on a substrate surface. This helps in identifying the major contributor to alloy formation on the filament itself and the film growth, and consequently, in determining the properties of the deposited films. An integrated knowledge of the gas-phase reaction chemistry, filament alloy formation, and thin film deposition is required for an efficient deposition of high-quality thin films and nanomaterials.

  20. Ruthenium promotion of Co/SBA-15 catalysts for Fischer-Tropsch synthesis in slurry-phase reactors

    Institute of Scientific and Technical Information of China (English)

    Jocielys Jovelino Rodrigues; Gina Pecchi; Fabiano André Narciso Fernandes; Meiry Gláucia Freire Rodrigues

    2012-01-01

    The aim of this work was to evaluate the catalytic properties of a Ru promoted Co/SBA-15 catalyst for Fischer-Tropsch synthesis (FTS).The Ru promoted Co/SBA-15 catalyst was prepared by wet impregnation method and was characterized by X-ray diffraction,X-ray energy dispersion spectrophotometer,N2 adsorption-desorption,temperature-programmed reduction and transmission electron microscopy.The Fischer-Tropsch synthesis using the catalyst was carried out to evaluate the catalyst activity and its effect on FTS product distribution.The synthesis was carried out in a slurry reactor operating at 513 K,20 atm,CO ∶ H2 molar ratio of 1 ∶ 1.X-ray diffraction showed that the calcined cobalt catalyst did not modify the structure of SBA-15,proving that Co was present in the form of Co3O4 in the catalyst.The addition of cobalt in SBA-15 decreased the specific superficial area of the molecular sieve.Fischer-Tropsch synthesis activity and C5+ hydrocarbon selectivity increased with the addition of Ru.The increases in activity and selectivity were attributed to the increased number of active sites resulting from higher reducibility and the synergetic effect of Ru and Co.Ru/Co/SBA-15 catalysts showed moderate conversion (40%) and high selectivity towards the production of C5+ (80 wt%).

  1. Catalysts for Vapor-Phase Selective Hydrogenation of Crotonaldehyde to Crotyl Alcohol%巴豆醛气相选择性加氢催化剂

    Institute of Scientific and Technical Information of China (English)

    陈萍; 谢冠群; 罗孟飞

    2012-01-01

    The vapor-phase selective hydrogenation of crotonaldehyde, a classical or, 13-unsaturated aldehyde, to crotyl alcohol over heterogeneous catalysts is an appealing green process of great importance from both industrial and academic points of view. This paper reviews the latest progresses of the heterogeneous catalysts for selective hydrogenation of crotonaldehyde to crotyl alcohol in the past ten years. Noble metal catalysts such as platinum, silver, gold and iridium and non-noble metal catalysts such as cobalt and copper employed for selective hydrogenation of crotonaldehyde are summarized. The parameters influencing the catalytic behaviors of the catalyst system such as active sites, metal particle size, support type, promoters are discussed. Also, catalyst deactivation and reaction mechanism are investigated. Finally, the current problems of the vapor-phase selective hydrogenation of erotonaldehyde are summarized and development trend of catalyst systems for this reaction is proposed. It is pointed out that the vapor-phase selective hydrogenation of crotonaldehyde over non-noble metal catalysts will be a main research direction because its much lower cost compared to the noble metal catalysts. As the catalyst deactivation is the main obstacle for this reaction, the research should be focused on the understanding of the reaction and deactivation mechanism.%巴豆醛是α,β-不饱和醛中最具代表性的一类有机化合物,采用气相催化巴豆醛选择加氢制备巴豆醇符合原子经济和绿色化学要求,具有重要的工业应用和学术价值。本文综述了近十年国内外.巴豆醛气相选择性加氢合成巴豆醇的负载型催化剂的研究成果,评述了贵金属催化剂(铂、金、铱、银、钯)和非贵金属催化剂(钴、铜)上巴豆醛选择性加氢性能,分析了活性组分、载体、助剂以及活性组分粒径对催化剂性能的影响,探讨了巴豆醛选择性加氢的反应机理和

  2. X-ray phase Identification of Chocolate is Possible

    Energy Technology Data Exchange (ETDEWEB)

    Guthrie,S.; Mazzanti, G.; Idziak, S.

    2005-01-01

    When examining chocolate samples by means of X-ray diffraction, it has become common practice for any sugar to be removed through repeated rinsing in cold water. While necessary in some cases, we show that it is possible to determine the phase of certain dark chocolate samples without sugar removal, through examination of distinctive X-ray diffraction peaks corresponding to lattice spacings of 3.98 and 3.70 Angstroms.

  3. Improving early clinical trial phase identification of promising therapeutics.

    Science.gov (United States)

    Kent, Thomas A; Shah, Shreyansh D; Mandava, Pitchaiah

    2015-07-21

    This review addresses decision-making underlying the frequent failure to confirm early-phase positive trial results and how to prioritize which early agents to transition to late phase. While unexpected toxicity is sometimes responsible for late-phase failures, lack of efficacy is also frequently found. In stroke as in other conditions, early trials often demonstrate imbalances in factors influencing outcome. Other issues complicate early trial analysis, including unequally distributed noise inherent in outcome measures and variations in natural history among studies. We contend that statistical approaches to correct for imbalances and noise, while likely valid for homogeneous conditions, appear unable to accommodate disease complexity and have failed to correctly identify effective agents. While blinding and randomization are important to reduce selection bias, these methods appear insufficient to insure valid conclusions. We found potential sources of analytical errors in nearly 90% of a sample of early stroke trials. To address these issues, we recommend changes in early-phase analysis and reporting: (1) restrict use of statistical correction to studies where the underlying assumptions are validated, (2) select dichotomous over continuous outcomes for small samples, (3) consider pooled samples to model natural history to detect early therapeutic signals and increase the likelihood of replication in larger samples, (4) report subgroup baseline conditions, (5) consider post hoc methods to restrict analysis to subjects with an appropriate match, and (6) increase the strength of effect threshold given these cumulative sources of noise and potential errors. More attention to these issues should lead to better decision-making regarding selection of agents to proceed to pivotal trials.

  4. Removal of gas phase low-concentration toluene over Mn, Ag and Ce modified HZSM-5 catalysts by periodical operation of adsorption and non-thermal plasma regeneration.

    Science.gov (United States)

    Wang, Wenzheng; Wang, Honglei; Zhu, Tianle; Fan, Xing

    2015-07-15

    Ag/HZSM-5, Mn/HZSM-5, Ce/HZSM-5, Ag-Mn/HZSM-5 and Ce-Mn/HZSM-5 were prepared by impregnation method. Both their adsorption capacity and catalytic activity were investigated for the removal of gas phase low-concentration toluene by periodical operation of adsorption and non-thermal plasma regeneration. Results show that catalysts loaded with Ag (Ag/HZSM-5 and Ag-Mn/HZSM-5) had larger adsorption capacity for toluene than the other catalysts. And Ag-Mn/HZSM-5 displayed the best catalytic performance for both toluene oxidation by non-thermal plasma and byproducts suppression. On the other hand, the deactivated catalyst can be fully regenerated by calcining in air stream when its adsorption capacity and catalytic activity of the Ag-Mn/HZSM-5 catalyst was found to be decreased after 10 cycles of periodical adsorption and non-thermal regeneration. Copyright © 2015. Published by Elsevier B.V.

  5. Methods to synthesize NiPt bimetallic nanoparticles by a reversed-phase microemulsion, deposition of NiPt bimetallic nanoparticles on a support, and application of the supported catalyst for CO.sub.2 reforming of methane

    KAUST Repository

    Biausque, Gregory

    2015-04-28

    Methods to synthesize NiPt bimetallic nanoparticles by a reversed-phase microemulsion, deposition of NiPt bimetallic nanoparticles on a support, and application of the supported catalyst for CO.sub.2 reforming of methane

  6. PHotometry Assisted Spectral Extraction (PHASE) and identification of SNLS supernovae

    CERN Document Server

    Baumont, S; Astier, Pierre; Guy, J; Hardin, D; Howell, D A; Lidman, C; Mouchet, M; Pain, R; Regnault, N

    2008-01-01

    Aim: We present new extraction and identification techniques for supernova (SN) spectra developed within the Supernova Legacy Survey (SNLS) collaboration. Method: The new spectral extraction method takes full advantage of photometric information from the Canada-France-Hawai telescope (CFHT) discovery and reference images by tracing the exact position of the supernova and the host signals on the spectrogram. When present, the host spatial profile is measured on deep multi-band reference images and is used to model the host contribution to the full (supernova + host) signal. The supernova is modelled as a Gaussian function of width equal to the seeing. A chi-square minimisation provides the flux of each component in each pixel of the 2D spectrogram. For a host-supernova separation greater than <~ 1 pixel, the two components are recovered separately and we do not use a spectral template in contrast to more standard analyses. This new procedure permits a clean extraction of the supernova separately from the ho...

  7. Relationship between surface acidity and activity of solid-acid catalysts in vapour phase dehydration of methanol

    Energy Technology Data Exchange (ETDEWEB)

    Mollavali, M.; Atashi, H. [Department of Chemical Engineering, Faculty of Engineering, University of Sistan and Baluchestan, P.O. Box 98164-161, Zahedan (Iran); Yaripour, F.; Mohammadi-Jam, S. [Catalyst Research Group, Petrochemical Research and Technology Company, National Petrochemical Company, 14358, Tehran (Iran)

    2009-09-15

    A series of solid-acid catalysts comprised of {gamma}-alumina and modified {gamma}-alumina with different of silica were prepared by co-precipitation method. The catalysts were characterized using XRD, TGA, NH{sub 3}-TPD and BET techniques. Dehydration of methanol to dimethyl ether (DME) on solid-acid catalysts was studied in a fixed-bed reactor at the same operating conditions (T = 300 C, P = 16 bar, WHSV = 26.07 h{sup -} {sup 1}). According to the experimental results, silica-modified catalysts have shown better performance compared to the pure {gamma}-alumina. It was found that surface areas increase with increasing silica loading. The results of NH{sub 3}-TPD analysis showed that the surface acidity of aluminosilicate catalysts increases with increase in SiO{sub 2}/Al{sub 2}O{sub 3} molar ratio. Also, it was found that the catalysts with highest portion of weak and/or moderate acid sites exhibit the best catalytic performance and stability. The sample with 3 wt.% silica loading has exhibited the best activity for methanol conversion. (author)

  8. Efficient hydrogen production from ethanol and glycerol by vapour-phase reforming processes with new cobalt-based catalysts.

    Science.gov (United States)

    Pereira, Evandro Brum; de la Piscina, Pilar Ramírez; Homs, Narcís

    2011-02-01

    The aim of this study was to investigate biohydrogen production from biofuel-reforming processes using new multi-component bulk-type cobalt-based catalysts. The addition of different components to improve the catalytic performance was studied. Monometallic cobalt catalyst and catalysts containing Ru (ca. 1%) and/or Na (ca. 0.5%) were characterized and tested in the 623-673 K temperature range in ethanol steam reforming (ESR) with a steam/carbon ratio (S/C) of 3. The catalysts showed a high performance for hydrogen production and, except for H(2) and CO(2), only small amounts of by-products were obtained, depending on the temperature and the catalyst used. The catalyst containing both Ru and Na (Co-Ru(Na)) showed the best catalytic behavior in ESR. It operated stably for at least 12 days under cycles of oxidative steam reforming of glycerol/ethanol mixtures (S/C=2) and activation under O(2).

  9. SCR at bio fuels combustion - phase 2. Measures to extend catalyst life time; SCR vid biobraensleeldning - etapp 2. Aatgaerder foer att foerlaenga katalysatorns livslaengd

    Energy Technology Data Exchange (ETDEWEB)

    Andersson, Christer; Bodin, Henrik; Sahlqvist, Aasa [Vattenfall Utveckling AB, Aelvkarleby (Sweden); Khodayari, Raziyeh; Odenbrand, Ingemar [Lund Univ. (Sweden). Dept. of Chemical Engineering II

    2000-07-01

    In this project phase, the deactivation of catalysts during combustion of bio fuels, and different methods of regeneration have been investigated. The overall purpose is to improve the economic and technical possibilities to use SCR at bio fuels combustion. The two different methods for regeneration are washing with water and so called sulphation (treatment with sulphur dioxide). The results from wood fired FB-boilers show that the catalyst lose 25% (average) of the relative activity during a normal heat production season. The tendency is that a boiler with short residence time between final combustion and catalyst and/or high flame temperatures gives a faster deactivation. Such unfavourable conditions arise in FB-boilers with a large part of the combustion in freeboard/cyclone. The alkali content of the fuel (wood fuel) is of minor importance for the deactivation rate compared with the combustion conditions. The flue gas temperature within the interval 250 - 375 deg C is not an important parameter for the deactivation in the time interval 3 000 - 6 000 h. The 'new' honeycomb catalysts that were tested during phase two, BiotypA-C, evidently show different deactivation trends. The highly active BiotypC e.g. increases its activity during the first thousand hours. Calculations indicate that BiotypC at 315 deg C requires the smallest volume of catalyst over ten years of operation in order to maintain given performance. Practical consequences for downstream equipment also need to be carefully checked. Sulphation with SO{sub 2} works in the laboratory as a regeneration method for all of the tested samples. The sulphatised samples deactivation are almost comparable to a fresh sample when exposed to flue gas. About 80 % of the lost activity can be regained only by using sulphation. Plate-type catalysts gets a somewhat lower increase in activity compared to honeycomb-types, probably related to chemical rather than geometric design. High SO{sub 2}-concentration

  10. Identification of reactive oxygen species in iridium-based OER catalysts by in situ photoemission and absorption spectroscopy

    OpenAIRE

    Pfeifer, V.

    2016-01-01

    A change in our energy supply from fossil fuels to intermittent renewables requires energy storage capacity. Part of this capacity may be delivered from chemical energy conversion relying on H2 as basic fuel. Renewable H2 can be generated using proton exchange membrane (PEM) electrolyzers able to adapt to the varying voltage inputs of intermittent sources. Such PEM electrolyzers operate in acidic environments requiring corrosion-resistant catalysts for the H2 and O2 evolution reactions (HER &...

  11. Identification of biogenic paraffins and their thermal phase transitions

    Science.gov (United States)

    Kotel'Nikova, E. N.; Platonova, N. V.; Filatov, S. K.

    2007-12-01

    Natural normal paraffin hydrocarbons C n H2 n + 2 ( n = 17 41) of a biological origin were investigated in terms of their composition, structure, polymorph modification, and thermal phase transition. Paraffin compositions were studied from beeswax (honeycombs and their cappings), plant wax (apple and pumpkin rinds), as well as from different parts of rat cerebrum (cortex, subcortex, brainstem, cerebellum, cerebral hemispheres, myelin, chromatin, etc.). X-ray diffraction analysis (XRD), chromatography, and high-temperature XRD, as well as original analytical methods elaborated upon by the authors, were used. The beeswax paraffin composition that corresponds to the six-component solid solution with a superperiodic four-layer orthorhombic cell was subjected to experimental modeling for the first time. The prepared mixture simulated a paraffin composition ( n = 23, 25, 27, 29, 31, 33) and the asymmetric distribution of homologues by n.

  12. Mutagenicity of diesel engine exhaust is eliminated in the gas phase by an oxidation catalyst but only slightly reduced in the particle phase.

    Science.gov (United States)

    Westphal, Götz A; Krahl, Jürgen; Munack, Axel; Ruschel, Yvonne; Schröder, Olaf; Hallier, Ernst; Brüning, Thomas; Bünger, Jürgen

    2012-06-05

    Concerns about adverse health effects of diesel engine emissions prompted strong efforts to minimize this hazard, including exhaust treatment by diesel oxidation catalysts (DOC). The effectiveness of such measures is usually assessed by the analysis of the legally regulated exhaust components. In recent years additional analytical and toxicological tests were included in the test panel with the aim to fill possible analytical gaps, for example, mutagenic potency of polycyclic aromatic hydrocarbons (PAH) and their nitrated derivatives (nPAH). This investigation focuses on the effect of a DOC on health hazards from combustion of four different fuels: rapeseed methyl ester (RME), common mineral diesel fuel (DF), SHELL V-Power Diesel (V-Power), and ARAL Ultimate Diesel containing 5% RME (B5ULT). We applied the European Stationary Cycle (ESC) to a 6.4 L turbo-charged heavy load engine fulfilling the EURO III standard. The engine was operated with and without DOC. Besides regulated emissions we measured particle size and number distributions, determined the soluble and solid fractions of the particles and characterized the bacterial mutagenicity in the gas phase and the particles of the exhaust. The effectiveness of the DOC differed strongly in regard to the different exhaust constituents: Total hydrocarbons were reduced up to 90% and carbon monoxide up to 98%, whereas nitrogen oxides (NO(X)) remained almost unaffected. Total particle mass (TPM) was reduced by 50% with DOC in common petrol diesel fuel and by 30% in the other fuels. This effect was mainly due to a reduction of the soluble organic particle fraction. The DOC caused an increase of the water-soluble fraction in the exhaust of RME, V-Power, and B5ULT, as well as a pronounced increase of nitrate in all exhausts. A high proportion of ultrafine particles (10-30 nm) in RME exhaust could be ascribed to vaporizable particles. Mutagenicity of the exhaust was low compared to previous investigations. The DOC reduced

  13. Water-dispersable hybrid Au-Pd nanoparticles as catalysts in ethanol oxidation, aqueous phase Suzuki-Miyaura and Heck reactions

    KAUST Repository

    Song, Hyon Min

    2012-01-01

    The catalytic activities of water-dispersable Au@Pd core-shell nanoparticles (NPs) and Au-Pd alloy NPs were examined. There is growing interest in Au-Pd hybridized NPs in a supported matrix or non-supported forms as catalysts in various reactions that are not limited to conventional Pd-related reactions. Four different Au@Pd core-shell NPs in this study were prepared at room temperature with help from the emulsion phase surrounding the Au core NPs. Au-Pd alloy NPs were prepared over 90 °C, and underwent phase transfer to aqueous medium for their catalytic use. Au@Pd core-shell NPs show catalytic activity in ethanol oxidation reactions as electrocatalysts, and both core-shell and alloy NPs are good to excellent catalysts in various Suzuki-Miyaura and Heck reactions as heterogeneous catalysts. Specifically, Au@Pd core-shell NPs with sharp branched arms show the highest yield in the reactions tested in this study. A relatively small amount (0.25 mol%) was used throughout the catalytic reactions. © 2012 The Royal Society of Chemistry.

  14. Butanol Dehydration over V2O5-TiO2/MCM-41 Catalysts Prepared via Liquid Phase Atomic Layer Deposition

    Directory of Open Access Journals (Sweden)

    Jong-Ki Jeon

    2013-04-01

    Full Text Available MCM-41 was used as a support and, by using atomic layer deposition (ALD in the liquid phase, a catalyst was prepared by consecutively loading titanium oxide and vanadium oxide to the support. This research analyzes the effect of the loading amount of vanadium oxide on the acidic characteristics and catalytic performance in the dehydration of butanol. The physical and chemical characteristics of the TiO2-V2O5/MCM-41 catalysts were analyzed using XRF, BET, NH3-TPD, XRD, Py-IR, and XPS. The dehydration reaction of butanol was performed in a fixed bed reactor. For the samples with vanadium oxide loaded to TiO2/MCM-41 sample using the liquid phase ALD method, it was possible to increase the loading amount until the amount of vanadium oxide reached 12.1 wt %. It was confirmed that the structural properties of the mesoporous silica were retained well after titanium oxide and vanadium loading. The NH3-TPD and Py-IR results indicated that weak acid sites were produced over the TiO2/MCM-41 samples, which is attributed to the generation of Lewis acid sites. The highest activity of the V2O5(12.1-TiO2/MCM-41 catalyst in 2-butanol dehydration is ascribed to it having the highest number of Lewis acid sites, as well as the highest vanadium dispersion.

  15. Incoherent optical correlators and phase encoding of identification codes for access control or authentication

    Science.gov (United States)

    Brasher, James D.; Johnson, Eric G.

    1997-09-01

    We show how phase-only filters can be used in incoherent optical correlators for security applications such as access control, identification, or authentication. As a specific example, a biometric signature, a fingerprint, is encoded in a phase-only representation. The phase encoding is accomplished with the method of generalized projections onto constraint sets implemented by an iterated Fourier transform algorithm. The operation of an incoherent optical security system using both a phase-only filter generated with the generalized projections algorithm and a phase-only matched filter is simulated. The results demonstrate that the selected access pattern was accepted while a false pattern was rejected by the security system and that better recognition and discrimination performance was attained with the phase-only filter produced by the generalized projections algorithm.

  16. Investigation of the promoting effect of Mn on a Pt/C catalyst for the steam and aqueous phase reforming of glycerol

    Energy Technology Data Exchange (ETDEWEB)

    Bossola, Filippo; Pereira-Hernández, Xavier Isidro; Evangelisti, Claudio; Wang, Yong; Dal Santo, Vladimiro

    2017-05-01

    The catalytic performances in steam reforming (SR) and aqueous phase reforming (APR) of glycerol of a bimetallic Pt-Mn catalyst supported on activated carbon are investigated and correlated with the surface properties of the catalyst. Under SR conditions, Mn showed a significant promoting effect over Pt/C, both in terms of hydrogen production rate and conversion, with a higher selectivity toward the glycerol dehydration products. Upon addition of Mn the amount of strong Lewis acid sites increased, promoting the dehydration of glycerol and favoring the CAO over CAC cleavage at expenses of hydrogen selectivity. Conversely, under APR conditions, a slightly higher hydrogen selectivity and only minimal enhancement in hydrogen production were found, while the products selectivity was comparable to Pt/C. Most of Mn leached into the aqueous media, but the remaining (<5% of the fresh parent sample) might be alloyed with Pt and promote the CO desorption from neighbor Pt sites.

  17. Organic solvent- and phase transfer catalyst-free oxida-tion of cyclohexanol to cyclo-hexanone with dilute H2O2

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The oxidation of cyclohexanol to cyclohexanone with 30% aqueous hydrogen peroxide by using peroxotungstate complexes formed in situ from sodium tungstate dihydrate and various bidentate organic ligands as the catalysts, without organic solvents, halide and phase transfer catalyst has been carried out. The influence of 13 ligands on the oxidation is investigated. The maximum yield of cyclohexanone is obtained when using 1,10-phenanthroline (96%) and oxalic acid (95%) as the ligand. Very high yields (around 90%) have also been obtained for the instances of using salicylic acid, 3,5-dibromosalicylic acid, and 8-hydro- xylquinoline as ligands. A research to improve the reaction condition using cheap oxalic acid as the ligand indicates that the optimum condition is that the reaction mixture with a molar ratio of cycohexanol︰tungstate dihydrate︰oxalic acid︰30% H2O2=100︰2︰2︰120 was stirred at 85-90℃ for 12 h.

  18. Hydrothermal Stability of Ru/SiO2–C: A Promising Catalyst for Biomass Processing through Liquid-Phase Reactions

    Directory of Open Access Journals (Sweden)

    Martín N. Gatti

    2016-12-01

    Full Text Available In this work, structural and morphological properties of SiO2–C composite material to be used as support for catalysts in the conversion of biomass-derived oxygenated hydrocarbons, such as glycerol, were investigated in liquid water under various temperatures conditions. The results show that this material does not lose surface area, and the hot liquid water does not generate changes in the structure. Neither change in relative concentrations of oxygen functional groups nor in Si/C ratio due to hydrothermal treatment was revealed by X-ray photoelectron spectroscopy (XPS analysis. Raman analysis showed that the material is made of a disordered graphitic structure in an amorphous silica matrix, which remains stable after hydrothermal treatment. Results of the hydrogenolysis of glycerol using a Ru/SiO2–C catalyst indicate that the support gives more stability to the active phase than a Ru/SiO2 consisting of commercial silica.

  19. Revisiting source identification, weathering models, and phase discrimination for Exxon Valdez oil

    Energy Technology Data Exchange (ETDEWEB)

    Driskell, W.B.; Payne, J.R. [Payne Environmental Consultants Inc., Encinitas, CA (United States); Shigenaka, G. [National Oceanic and Atmospheric Administration, Seattle, WA (United States)

    2005-07-01

    A large chemistry data set for polycyclic aromatic hydrocarbon (PAH) and saturated hydrocarbon (SHC) contamination in sediment, water and tissue samples has emerged in the aftermath of the 1989 Exxon Valdez oil spill in Prince William Sound, Alaska. When the oil was fresh, source identification was a primary objective and fairly reliable. However, source identification became problematic as the oil weathered and its signatures changed. In response to concerns regarding when the impacted area will be clean again, this study focused on developing appropriate tools to confirm hydrocarbon source identifications and assess weathering in various matrices. Previous efforts that focused only on the whole or particulate-phase oil are not adequate to track dissolved-phase signal with low total PAH values. For that reason, a particulate signature index (PSI) and dissolved signature index (DSI) screening tool was developed in this study to discriminate between these 2 phases. The screening tool was used to measure the dissolved or water-soluble fraction of crude oil which occurs at much lower levels than the particulate phase, but which is more widely circulated and equally as important as the particulate oil phase. The discrimination methods can also identify normally-discarded, low total PAH samples which can increase the amount of usable data needed to model other effects of oil spills. 37 refs., 3 tabs., 10 figs.

  20. Aqueous-phase catalytic hydrogenation of furfural to cyclopentanol over Cu-Mg-Al hydrotalcites derived catalysts:Model reaction for upgrading of bio-oil

    Institute of Scientific and Technical Information of China (English)

    Minghao; Zhou; Zuo; Zeng; Hongyan; Zhu; Guomin; Xiao; Rui; Xiao

    2014-01-01

    A series of Cu-Mg-Al hydrotalcites derived oxides with a(Cu+Mg)/Al mole ratio of 3 and varied Cu/Mg mole ratio(from 0.07 to 0.30) were prepared by co-precipitation and calcination methods, then they were introduced to the hydrogenation of furfural in aqueous-phase. Effects of Cu/Mg mole ratio, reaction temperature, initial hydrogen pressure, reaction time and catalyst amount on the conversion rate of furfural as well as the selectivity toward desired product cyclopentanol were systematically investigated. The conversion of furfural over calcined hydrotalcite catalyst with a Cu/Mg mole ratio of 0.2 was up to 98.5% when the reaction was carried out under 140 ?C and the initial hydrogen pressure of 4 MPa for 10 h, while the selectivity toward cyclopentanol was up to 94.8%. The catalysts were characterized by XRD and SEM. XRD diffraction of all the samples showed characteristic pattern of hydrotalcite with varied peak intensity as a result of different Cu content. The catalytic activity was improved gradually with the increase of Cu component in the hydrotalcite.

  1. Polymerization of ethyl methacrylate under the influence of ultrasound assisted a new multi-site phase-transfer catalyst system--a kinetic study.

    Science.gov (United States)

    Sankar, Kavitha; Rajendran, Venugopal

    2013-01-01

    The kinetics of multi-site phase-transfer catalyzed free radical polymerisation of ethyl methacrylate (EMA) using potassium peroxy disulphate (PDS) as a water soluble initiator and newly synthesized 1,4-dihexadecylpyrazine-1,4-diium dibromide as multi-site phase-transfer catalyst (MPTC) has been investigated in ethyl acetate/water two phase system at constant temperature 55 ± 1 °C under nitrogen atmosphere and ultrasound irradiation conditions. The rate of polymerization increases with an increase in concentrations of EMA, PDS and MPTC. The order with respect to monomer, initiator and MPTC were found to be 1.03, 0.52 and 0.53, respectively. Based on the observed results a suitable mechanism has been proposed to account for the experimental observations and its significance was discussed.

  2. Hydrogenation of fast pyrolyis oil and model compounds in a two-phase aqueous organic system using homogeneous ruthenium catalysts

    NARCIS (Netherlands)

    Mahfud, F. H.; Ghijsen, F.; Heeres, H. J.

    2007-01-01

    The use of homogeneous ruthenium catalysts to hydrogenate the water-soluble fraction of pyrolysis oil is reported. Pyrolysis oil, which is obtained by fast pyrolysis of lignocellulosic biomass at 450-600 degrees C, contains significant amounts of aldehydes and ketones (e.g. 1-hydroxy-2-propanone (1)

  3. Correlating metal poisoning with zeolite deactivation in an individual catalyst particle by chemical and phase sensitive X-ray microscopy

    NARCIS (Netherlands)

    Ruiz-Martinez, J.; Beale, A.M.; Deka, U.; O'Brien, M.G.; Quinn, P.D.; Mosselmans, J.F.W.; Weckhuysen, B.M.

    2013-01-01

    Fluid catalytic cracking (FCC) is the main conversion process used in oil refineries. An X-ray microscopy method is used to show that metal poisoning and related structural changes in the zeolite active material lead to a non-uniform core–shell deactivation of FCC catalyst particles. The study links

  4. Direct oxidation of benzene to phenol in liquid phase by H2O2 over vanadium catalyst supported on highly ordered nanoporous silica

    Directory of Open Access Journals (Sweden)

    A. R. Badiei

    2011-01-01

    Full Text Available Vanadium supported on highly ordered nanoporous silica (VOx-LUS-1 was synthesized and characterized by XRD, Nitrogen adsorption‑desorption isotherms and UV-visible spectrophotometer. Direct oxidation of benzene to phenol in liquid phase by H2O2 peroxide were examined by using various solvents (methanol, acetone, acetic acid, acetonitryl. The maximum yield (25% and selectivity (73% of the phenol  produced were obtained in the presence of acetic acid. The catalyst can be reused for  several times without any appreciable loss of activity.

  5. Role of the Support and Reaction Conditions on the Vapor-Phase Deoxygenation of m-Cresol over Pt/C and Pt/TiO2 Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Griffin, Michael B.; Ferguson, Glen A.; Ruddy, Daniel A.; Biddy, Mary J.; Beckham, Gregg T.; Schaidle, Joshua A.

    2016-04-01

    The catalytic deoxygenation of biomass fast pyrolysis vapors offers a promising route for the sustainable production of liquid transportation fuels. However, a clear understanding of the mechanistic details involved in this process has yet to be achieved, and questions remain regarding the role of the catalyst support and the influence of reaction conditions. In order to gain insight into these questions, the deoxygenation of m-cresol was investigated over Pt/C and Pt/TiO2 catalysts using experimental and computational techniques. The performance of each catalyst was evaluated in a packed-bed reactor under two conditions (523 K, 2.0 MPa and 623 K, 0.5 MPa), and the energetics of the ring hydrogenation, direct deoxygenation, and tautomerization mechanisms were calculated over hydrogen-covered Pt(111) and oxygen vacancies on the surface of TiO2(101). Over Pt(111), ring hydrogenation to 3-methylcyclohexanone and 3-methylcyclohexanol was found to be the most energetically favorable pathway. Over TiO2(101), tautomerization and direct deoxygenation to toluene were identified as additional energetically favorable routes. These calculations are consistent with the experimental data, in which Pt/TiO2 was more active on a metal site basis and exhibited higher selectivity to toluene at 623 K relative to Pt/C. On the basis of these results, it is likely that the reactivity of Pt/TiO2 and Pt/C is driven by the metallic phase at 523 K, while contributions from the TiO2 support enhance deoxygenation at 623 K. These results highlight the synergistic effects between hydrogenation catalysts and reducible metal oxide supports and provide insight into the reaction pathways responsible for their enhanced deoxygenation performance.

  6. Segmentation of elemental EDS maps by means of multiple clustering combined with phase identification.

    Science.gov (United States)

    Münch, B; Martin, L H J; Leemann, A

    2015-12-01

    An imaging concept is proposed for the phase identification and segmentation of elemental map images from energy dispersive spectroscopy. The procedure starts with presegmentation using common clustering algorithms, continues with automated identification of the chemical compositions, followed by their screening by professional expertise. The ultimate phases are finally clustered by applying a minimum Euclidean distance classifier. The potential, performance and limitations of the approach are presented on energy dispersive spectroscopy maps acquired by a scanning electron microscope and conducted on samples produced from cement clinker, natural rock and hydrated cement mortar. Nevertheless, the technique is suitable for arbitrary types of materials and general devices for energy dispersive spectroscopy acquisition. It is an approach for extending common energy dispersive spectroscopy analysis by means of visual examination and ratio plots towards quantitative rating.

  7. Lanthanum-Promoted Nickel Catalyst for Vapor-Phase Methanol Carbonylation%新型Ni-La催化剂催化甲醇气相羰基化反应

    Institute of Scientific and Technical Information of China (English)

    李峰波; 邹瑾; 袁国卿

    2003-01-01

    @@ Methanol carbonylation is the main process for producing acetic acid. The current technology is based on precious rhodium and iridium catalysts dissolved in liquid phase[1,2]. A heterogeneous catalyst based on a cheaper metal will have much theoretical and economic significance in improving the methanol carbonylation process, by solving many problems in homogeneous process. To achieve this purpose, a lanthanum-promoted nickel catalyst supported on polymer-derived carbon beads[3] with high activity and selectivity was developed by a new strategy.

  8. Risk Identification for the Construction Phases of the Large Bridge Based on WBS-RBS

    Directory of Open Access Journals (Sweden)

    Qing-Fu Li

    2013-07-01

    Full Text Available For the construction environment of large bridges is complex and there are too much uncertain factors during the course of the construction, it is difficult for the general method of risk identification to identify the risks wholly and systematically. This study presents a new method of risk identification with modular analysis based on WBS-RBS (Work Breakdown Structure-Risk Breakdown Structure. For the purpose of the better application of this new method in the risk identification of large bridges, a BCICS (Bridge Construction Information Classification System suitable for construction phase of large bridges was established based on the information classification system of ISO (International Standardization Organization. In order to provide a uniform communication language for the risk analysis personnel, the WBS of the construction of large bridges was established, which was beneficial to the judgment of the matrix elements of the RBM (Risk Breakdown Structure applying the method of NGT (Nominal Group Technique. The coding system based on BCICS and RBS presented in this study is convenient for the modularized computer storage of the risk information of large bridges in construction phase and has great contribution to establishing the risk database of large bridges in construction phase

  9. Evidence for the Active Phase of Heterogeneous Catalysts through In Situ Reaction Product Imaging and Multiscale Modeling

    Energy Technology Data Exchange (ETDEWEB)

    Matera, S.; Blomberg, S.; Hoffmann, M. J.; Zetterberg, J.; Gustafson, J.; Lundgren, E.; Reuter, K.

    2015-06-17

    We use multiscale modeling to analyze laser-induced fluorescence (LIF) measurements of the CO oxidation reaction over Pd(100) at near-ambient reaction conditions. Integrating density functional theory-based kinetic Monte Carlo simulations of the active catalyst into fluid-dynamical simulations of the mass transport inside the reactor chamber, we calculate the reaction product concentration directly above the catalyst surface. Comparing corresponding data calculated for different surface models against the measured LIF signals, we can discriminate the one that predominantly actuates the experimentally measured catalytic activity. For the probed CO oxidation reaction conditions, the experimental activity is due to pristine Pd(100) possibly coexisting with other (oxidic) domains on the surface.

  10. Mechanistic studies of the vapor-phase Beckmann rearrangement on solid catalysts by in situ solid-state NMR spectroscopy

    OpenAIRE

    Marthala, Venkata Ramana Reddy

    2009-01-01

    Epsilon-Caprolactam, the main product of the Beckmann rearrangement of cyclohexanone oxime, is an intermediate in the manufacture of nylon-6. Currently, most of the industrial plants produce epsilon-caprolactam by the Beckmann rearrangement of cyclohexanone oxime using sulphuric acid or oleum as a homogeneous catalyst. This process has two main disadvantages: (i) The production of uneconomical by-product, such as ammonium sulphate, and (ii) the environmentally unfriendly corrosive reaction me...

  11. Identification of Active Phase for Selective Oxidation of Benzyl Alcohol with Molecular Oxygen Catalyzed by Copper-Manganese Oxide Nanoparticles

    Directory of Open Access Journals (Sweden)

    Roushown Ali

    2013-01-01

    Full Text Available Catalytic activity of copper-manganese mixed oxide nanoparticles (Cu/Mn = 1 : 2 prepared by coprecipitation method has been studied for selective oxidation of benzyl alcohol using molecular oxygen as an oxidizing agent. The copper-manganese (CuMn2 oxide catalyst exhibited high specific activity of 15.04 mmolg−1 h−1 in oxidation of benzyl alcohol in toluene as solvent. A 100% conversion of the benzyl alcohol was achieved with >99% selectivity to benzaldehyde within a short reaction period at 102°C. It was found that the catalytic performance is dependent on calcination temperature, and best activity was obtained for the catalyst calcined at 300°C. The high catalytic performance of the catalyst can be attributed to the formation of active MnO2 phase or absence of less active Mn2O3 phase in the mixed CuMn2 oxide. The catalyst has been characterized by powder X-ray diffraction (XRD, thermogravimetric analysis (TGA, scanning electron microscopy (SEM, transmission electron microscopy (TEM, Brunauer Emmett-Teller (BET surface area measurement, and Fourier transform infrared (FT-IR spectroscopies.

  12. Mixed-phase oxide catalyst based on Mn-mullite (Sm, Gd)Mn2O5 for NO oxidation in diesel exhaust.

    Science.gov (United States)

    Wang, Weichao; McCool, Geoffrey; Kapur, Neeti; Yuan, Guang; Shan, Bin; Nguyen, Matt; Graham, Uschi M; Davis, Burtron H; Jacobs, Gary; Cho, Kyeongjae; Hao, Xianghong

    2012-08-17

    Oxidation of nitric oxide (NO) for subsequent efficient reduction in selective catalytic reduction or lean NO(x) trap devices continues to be a challenge in diesel engines because of the low efficiency and high cost of the currently used platinum (Pt)-based catalysts. We show that mixed-phase oxide materials based on Mn-mullite (Sm, Gd)Mn(2)O(5) are an efficient substitute for the current commercial Pt-based catalysts. Under laboratory-simulated diesel exhaust conditions, this mixed-phase oxide material was superior to Pt in terms of cost, thermal durability, and catalytic activity for NO oxidation. This oxide material is active at temperatures as low as 120°C with conversion maxima of ~45% higher than that achieved with Pt. Density functional theory and diffuse reflectance infrared Fourier transform spectroscopy provide insights into the NO-to-NO(2) reaction mechanism on catalytically active Mn-Mn sites via the intermediate nitrate species.

  13. Preparation of manganese oxide immobilized on SBA-15 by atomic layer deposition as an efficient and reusable catalyst for selective oxidation of benzyl alcohol in the liquid phase

    Energy Technology Data Exchange (ETDEWEB)

    Mahdavi, Vahid, E-mail: v-mahdavi@araku.ac.ir; Mardani, Mahdieh

    2015-04-01

    Manganese oxide supported on mesoporous silica SBA-15 catalyst (Mn-SBA-15) was tested with Mn contents in the range of 0.8–23 wt%. Samples were prepared by the controlled grafting process of atomic layer deposition (ALD). Other sample was prepared for comparisons by the wet impregnation method. These samples were characterized by the techniques of ICP, XRD, SEM, Raman, FT-IR spectroscopy, diffuse reflectance UV–Vis, TGA-DSC, and N{sub 2} absorption–desorption surface area measurement. Results indicated that anchored manganese oxide particles have been successfully synthesized over the surface of SBA-15. These samples contained Red-Ox ion pairs of Mn{sup 2+} and Mn{sup 3+} highly dispersed on the mesoporous silica surface. The impregnated sample exhibited lower surface area and contained Red-Ox ion pairs of Mn{sup 3+} and Mn{sup 4+} more aggregated particles on the SBA-15 surface. Results determined Mn-SBA-15 as an efficient and selective catalyst for oxidation of benzyl alcohol with tert-butylhydroperoxide in liquid phase. In accordance with expectations, there was a negligible amount of leaching of immobilized manganese oxide from the support during the reaction, because of strong surface interaction between manganese oxide and hydroxyls groups. The influences of reaction temperature, reaction time, solvent, TBHP/benzyl alcohol molar ratio, amount of catalyst and reusability were investigated. Under optimized conditions (0.2 g catalyst, TBHP/benzyl alcohol molar ratio 1, solvent acetonitrile; T = 90 °C; reaction time 8 h), results achieved 70% conversion of benzyl alcohol and 100% selectivity to benzaldehyde. - Highlights: • Manganese oxide immobilized on SBA-15 were prepared by atomic layer deposition (ALD). • Oxidation of benzyl alcohol to benzaldehyde over this catalyst were investigated. • Effects of loading of manganese oxide, T, oxidant/alcohol ratio were investigated. • The leaching of manganese oxide from support during the reaction was

  14. [Adsorption and removal of gas-phase Hg(0) over a V2O5/AC catalyst in the presence of SO2].

    Science.gov (United States)

    Wang, Jun-wei; Yang, Jian-li; Liu, Zhen-yu

    2009-12-01

    The adsorption and removal behaviors of gas-phase Hg(0) over V2O5/AC and AC were studied under a simulated flue gas (containing N2, SO2, O2) in a fixed-bed reactor. The influences of the V2O5, loading, SO2 concentration and adsorption temperature on Hg0 adsorption were investigated. The speciation of mercury adsorbed was determined by X-ray photoelectron spectroscopy (XPS). It was found that the V2O5/AC catalyst has a much higher capability than AC for Hg(0) adsorption and removal, mainly because of the catalytic oxidation activity of V2O5. The Hg(0) adsorption capability depends on the V2O5 content of the V2O5/AC catalyst. The amounts of mercury adsorbed increase from 75.9 microg x g(-1) to 89.6 microg x g(-1) (in the absence of O2) and from 115.9 microg x g(-1) to 185.5 microg x g(-1) (in the presence of O2) as the V2O5 loading increases from 0.5% to 1.0%, which are much higher than those over AC under the same conditions (9.6 microg x g(-1) and 23.3 microg x g(-1)). SO2 in the flue gas enhances Hg(0) adsorption over the V2O5/AC catalyst, which is due to the reaction of SO2 and Hg(0) on V2O3/AC. But as the SO2 concentration increases from 500 x 10(-6) to 2000 x 10(-6), the amount of mercury adsorbed has only a slight increase. The optimal temperature for Hg(0) adsorption over the V2O5/AC catalyst is around 150 degrees C, at which the amounts of mercury adsorbed are up to 98.5 microg x g(-1) (in the absence of O2) and 187.7 microg x g(-1) (in the presence of O2). The XPS results indicate the formation of Hg(0) and HgSO4 on the surface of the V2O5/AC catalyst, which confirms the role of V2O5 and SO2.

  15. Effect of ultrasound in the free radical polymerization of acrylonitrile under a new multi-site phase-transfer catalyst - a kinetic study.

    Science.gov (United States)

    Selvaraj, Varathan; Sakthivel, Perumal; Rajendran, Venugopal

    2015-01-01

    The kinetics of polymerization of acrylonitrile (AN) was carried out under heterogeneous condition using a new multi-site phase-transfer catalyst (MPTC), viz., N,N'-dihexyl-4,4'-bipyridinium dibromide in the presence of water soluble initiator, potassium peroxydisulphate (PDS) under chlorobenzene/water two phase system assisted by ultrasound irradiation at constant temperature 60+1°C under nitrogen atmosphere. The rate of polymerization increases with an increasing the concentrations of AN, MPTC and PDS. The order with respect to [AN], [MPTC], and [PDS] were found to be 1.01, 1.03 and 0.52, respectively. Based on the observed results a suitable mechanism has been proposed to account for the experimental observations followed by a discussion on its significance.

  16. Synergetic effect of TeMo5O16 and MoO3 phases in MoTeOx catalysts used for the partial oxidation of propylene

    Institute of Scientific and Technical Information of China (English)

    Yiming He; Ying Wu; Weizheng Weng; Huilin Wan

    2011-01-01

    A detailed study on the synergetic effect of TeMo5O16 and MoO3 phases in the MoTeOx catalysts for the partial oxidation of propylene to acrolein has been reported in this work. It was found that both propylene conversion and acrolein selectivity increased with the addition of MoO3 to TeMo5O16. Based on the results of N2 adsorption-desorption, XRD, XPS, in-situ XRD, O2-TPO, and 2-propanol decomposition reaction, the higher catalytic performance and synergetic effect could be attributed to the enhancement of acidity and the oxygen transfer from TeMo5O16 to MoO3 phase.

  17. Artificial neural network based fault identification scheme implementation for a three-phase induction motor.

    Science.gov (United States)

    Kolla, Sri R; Altman, Shawn D

    2007-04-01

    This paper presents results from the implementation and testing of a PC based monitoring and fault identification scheme for a three-phase induction motor using artificial neural networks (ANNs). To accomplish the task, a hardware system is designed and built to acquire three-phase voltages and currents from a 1/3 HP squirrel-cage, three-phase induction motor. A software program is written to read the voltages and currents, which are first used to train a feed-forward neural network structure using the JavaNNS program. The trained network is placed in a LabVIEW based program formula node that monitors the voltages and currents online and displays the fault conditions and turns the motor off. The complete system is successfully tested in real time by creating different faults on the motor.

  18. Reduced cobalt phases of ZrO{sub 2} and Ru/ZrO{sub 2} promoted cobalt catalysts and product distributions from Fischer–Tropsch synthesis

    Energy Technology Data Exchange (ETDEWEB)

    Kangvansura, Praewpilin [Department of Materials Science, Faculty of Science, Kasetsart University, Bangkok 10900 (Thailand); Schulz, Hans, E-mail: hans.schulz@kit.edu [Karlsruhe Institute of Technology, Engler-Bunte Institute, 76131 Karlsruhe (Germany); Suramitr, Anwaraporn, E-mail: sfsciawn@src.ku.ac.th [Faculty of Science at Si Racha, Kasetsart University Si Racha Campus, Chonburi 20230 (Thailand); Poo-arporn, Yingyot, E-mail: yingyot@slri.or.th [Synchrotron Light Research Institute (Public Organization), Nakhon Ratchasima 30000 (Thailand); Viravathana, Pinsuda, E-mail: fscipvd@ku.ac.th [Department of Chemistry, Faculty of Science, Kasetsart University, Bangkok 10900 (Thailand); Worayingyong, Attera, E-mail: fscippl@ku.ac.th [Department of Materials Science, Faculty of Science, Kasetsart University, Bangkok 10900 (Thailand)

    2014-12-15

    Highlights: • Ru/ZrO{sub 2}, ZrO{sub 2} promoted Co/SiO{sub 2} for FTS were reduced by time resolved XANES. • Reduced catalysts resulted from XANES reduction showed the mixed phases of Co, CoO. • The highest percentages of CoO resulted from the high ZrO{sub 2} promoted Co/SiO{sub 2}. • Product distributions of 1-alkenes, iso-alkanes indicated sites for FTS and the 2° reaction. • Alkene readsorption were high corresponding to the high CoO forming branched alkanes. - Abstract: Co/SiO{sub 2} catalysts were promoted with 4% and 8% ZrO{sub 2}. Small amounts (0.07%) of Ru were impregnated onto 4%ZrO{sub 2}/Co/SiO{sub 2}. Catalysts resulting from time-resolved XANES reduction showed mixed phases of Co and CoO, with the highest percentages of Co resulting from Ru/4%ZrO{sub 2}/Co/SiO{sub 2} and the highest percentages of CoO resulting from 8%ZrO{sub 2}/Co/SiO{sub 2}. Product distributions of n-alkanes, iso-alkanes and alkenes during Fischer–Tropsch Synthesis (FTS) were used to investigate the catalyst performance of 4%ZrO{sub 2}/Co/SiO{sub 2} 8%ZrO{sub 2}/Co/SiO{sub 2} and Ru/4%ZrO{sub 2}/Co/SiO{sub 2}. FTS steady state was studied by growth probabilities of n-alkane products. No 1-alkene was produced from Ru/4%ZrO{sub 2}/Co/SiO{sub 2}, indicating high availability of Fischer–Tropsch sites for long chain hydrocarbon growth, despite high methanation. Branched alkanes produced from the secondary reaction were related to the high CoO percentages on 8%ZrO{sub 2}/Co/SiO{sub 2}. Alkene readsorption sites were high, corresponding to the high CoO percentages, causing a high probability of forming branched alkane products.

  19. Effective Liquid-phase Nitration of Benzene Catalyzed by a Stable Solid Acid Catalyst: Silica Supported Cs{sub 2.5}H{sub 0.5}PMo{sub 12}O{sub 40}

    Energy Technology Data Exchange (ETDEWEB)

    Gong, Shu-wen; Liu, Li-jun; Zhang, Qian; Wang, Liang-yin [Liaocheng University, Liaocheng (China)

    2012-04-15

    Silica supported Cs{sub 2.5}H{sub 0.5}PMo{sub 12}O{sub 40} catalyst was prepared through sol-gel method with ethyl silicate-40 as silicon resource and characterized by X-ray diffraction, infrared spectroscopy, scanning electron microscopy, nitrogen adsorption-desorption and potentiometric titration methods. The Cs{sub 2.5}H{sub 0.5}PMo{sub 12}O{sub 40} particles with Keggin-type structure well dispersed on the surface of silica, and the catalyst exhibited high surface area and acidity. The catalytic performance of the catalysts for benzene liquid-phase nitration was examined with 65% nitric acid as nitrating agent, and the effects of various parameters were tested, which including temperature, time and amount of catalyst, reactants ratio, especially the recycle of catalyst was emphasized. Benzene was effectively nitrated to mononitro-benzene with high conversion (95%) in optimized conditions. Most importantly, the supported catalyst was proved has excellent stability in the nitration progress, and there were no any other organic solvent and sulfuric acid were used in the reaction system, so the liquid-phase nitration of benzene that we developed was an eco-friendly and attractive alternative for the commercial technology

  20. Rapid experimental SAD phasing and hot-spot identification with halogenated fragments

    Directory of Open Access Journals (Sweden)

    Joseph D. Bauman

    2016-01-01

    Full Text Available Through X-ray crystallographic fragment screening, 4-bromopyrazole was discovered to be a `magic bullet' that is capable of binding at many of the ligand `hot spots' found in HIV-1 reverse transcriptase (RT. The binding locations can be in pockets that are `hidden' in the unliganded crystal form, allowing rapid identification of these sites for in silico screening. In addition to hot-spot identification, this ubiquitous yet specific binding provides an avenue for X-ray crystallographic phase determination, which can be a significant bottleneck in the determination of the structures of novel proteins. The anomalous signal from 4-bromopyrazole or 4-iodopyrazole was sufficient to determine the structures of three proteins (HIV-1 RT, influenza A endonuclease and proteinase K by single-wavelength anomalous dispersion (SAD from single crystals. Both compounds are inexpensive, readily available, safe and very soluble in DMSO or water, allowing efficient soaking into crystals.

  1. Effect of the preparation method of support on the aqueous phase reforming of ethylene glycol over 2 wt% Pt/Ce0.15Zr0.85O2 catalysts.

    Science.gov (United States)

    Kim, Jung-Hyun; Jeong, Kwang-Eun; Kim, Tae-Wan; Chae, Ho-Jeong; Jeong, Soon-Yong; Kim, Chul-Ung; Lee, Kwan-Young

    2013-08-01

    The effect of catalyst support on the aqueous phase reforming of ethylene glycol over supported 2 wt% Pt/Ce0.15Zr0.85O2 catalysts have been investigated. Various types of Ce0.15Zr0.85O2 mixed oxides were prepared by hydrothermal precipitation (CZH), modified precipitation (CZM), co-precipitation (CZC), sol-gel (CZS) methods, respectively. Catalysts were characterized by XRD, N2 sorption analysis, and cyclohexane dehydration for relative metal dispersion. The support effect on the activity of 2 wt% Pt/Ce0.15Zr0.85O2 catalysts with different preparation method was given as follows: CZH production rate and hydrogen yield increased in proportion to the reaction temperature and corresponding system pressure, whereas WHSV did not affect.

  2. Monomeric Cu(Ⅱ) Complex Containing Chiral Phase-transfer Catalyst as Ligand and Its Asymmetrically Catalytic Reaction

    Institute of Scientific and Technical Information of China (English)

    QU Zhi-Rong; XIONG Ren-Gen

    2008-01-01

    The thermal treatment of CuCl2 with N-(4'-vinylbenzyl)cinchonidinitim chloride(L1)afforded a monomeric discrete homochiral copper(Ⅱ)complex N-4'-(vinylbenzyl)cinchonidinium trichlorocoprate(Ⅱ)(1).Their applications to the enantioselectively catalytic alkylation reaction of N-(diphenylmethylidene)glycine tert-butyl ester(3)show that the higher ee value observed in catalyst 1 than that in the corresponding free ligand L1 is probably due to the rigidity enhancement after the coordination of N atom of quinoline ring to the copper ion.

  3. Homogeneous catalysts

    CERN Document Server

    Chadwick, John C; Freixa, Zoraida; van Leeuwen, Piet W N M

    2011-01-01

    This first book to illuminate this important aspect of chemical synthesis improves the lifetime of catalysts, thus reducing material and saving energy, costs and waste.The international panel of expert authors describes the studies that have been conducted concerning the way homogeneous catalysts decompose, and the differences between homogeneous and heterogeneous catalysts. The result is a ready reference for organic, catalytic, polymer and complex chemists, as well as those working in industry and with/on organometallics.

  4. Liquid phase hydrogenation of acethydrazone to N'-methyl acethydrazide over Pd/γ-Al2O3 catalyst

    Directory of Open Access Journals (Sweden)

    S. G. Pakdehi

    2010-03-01

    Full Text Available Catalytic hydrogenation of acethydrazide (AH is the main step in the production of N'-methyl acethydrazide (MAH. In this step, AH reacts with formaldehyde to produce acetylhydrazone (AOH. AOH is hydrogenated in the presence of 5% Pd/γ-Al2O3 catalyst to MAH. In this paper, the effects of hydrogen pressure, catalyst loading and initial concentration of AOH on the initial rate of hydrogenation were studied in a batch slurry reactor within a temperature range of 303-333K. The hydrogenation rate was first order with respect to hydrogen concentration at lower hydrogen pressures. However, at higher pressures, the rate became independent of both hydrogen and initial AOH concentrations. A single site Langmuir-Hinshelwood type formulation was found to describe adequately the kinetic data. A good correlation was observed between the predicted concentration vs. time profiles and those determined experimentally. The apparent activation energy was calculated from the initial rates as 40.6 kJ/mol.

  5. Identification of microfluidic two-phase flow patterns in lab-on-chip devices.

    Science.gov (United States)

    Yang, Zhaochu; Dong, Tao; Halvorsen, Einar

    2014-01-01

    This work describes a capacitive sensor for identification of microfluidic two-phase flow in lab-on-chip devices. With interdigital electrodes and thin insulation layer utilized, this sensor is capable of being integrated with the microsystems easily. Transducing principle and design considerations are presented with respect to the microfluidic gas/liquid flow patterns. Numerical simulation results verify the operational principle. And the factors affecting the performance of the sensor are discussed. Besides, a feasible process flow for the fabrication is also proposed.

  6. Novel Oxidative Desulfurization of a Model Fuel with H2O2 Catalyzed by AlPMo12O40 under Phase Transfer Catalyst-Free Conditions

    Directory of Open Access Journals (Sweden)

    Márcio José da Silva

    2013-01-01

    Full Text Available A novel process was developed for oxidative desulfurization (ODS in the absence of a phase transfer catalyst (PTC using only Keggin heteropolyacids and their aluminum salts as catalysts. Reactions were performed in biphasic mixtures of isooctane/acetonitrile, with dibenzothiophene (DBT as a model sulfur compound and hydrogen peroxide as the oxidant. Remarkably, only the AlPMo12O40-catalyzed reactions resulted in complete oxidation of DBT into DBT sulfone, which was totally extracted by acetonitrile, reducing the sulfur content of isooctane from the 1000 ppm to  H3PMo12O40 > AlPW12O40 > H3PW12O40. The absence of a PTC, acidic organic peroxides, and the use of hydrogen peroxide, an environmentally benign oxidant, make up the positive aspects of AlPMo12O40-catalyzed ODS reactions. In these reactions, high rates of DBT removal (ca. 100% were achieved within a short time (ca. 2 hours and under mild reaction conditions.

  7. Fast island phase identification for tearing mode feedback control on J-TEXT tokamak

    Science.gov (United States)

    Rao, B.; Li, D.; Hu, F. R.; Ding, Y. H.; Hu, Q. M.; Jin, H.

    2016-11-01

    A new method to control the tearing mode (TM) in tokamaks has been proposed [Q. Hu and Q. Yu, Nucl. Fusion 56, 034001 (5pp.) (2016)], according to which, the external resonant magnetic perturbation needs to be applied in certain magnetic island phase regions. Therefore, it is very important to identify the helical phase of magnetic islands in real time. The TM in tokamak plasmas is normally rotating and carries magnetic oscillations, which are known as Mirnov oscillations and can be detected by Mirnov probes. When the O-point or X-point of the magnetic island passes through the probe, the signal will experience a zero-crossing. A poloidal Mirnov probe array and a corresponding island phase identification method are presented. A field-programmable gate array is used to provide the magnetic island helical phase in real time by using multichannel zero crossing detection. This system has been developed on the J-TEXT tokamak and works well. This paper introduces the establishment of the fast magnetic island phase identifying system.

  8. Synthesis of TiO2 visible light catalysts with controllable crystalline phase and morphology from Ti-bearing electric arc furnace molten slag.

    Science.gov (United States)

    Li, Yang; Liu, Lulu; Guo, Min; Zhang, Mei

    2016-09-01

    TiO2 visible light catalysts with different crystalline phases and morphologies were synthesized from titanium-bearing electric arc furnace molten slag (Ti-bearing EAF slag) by using a simple acidolysis process. The effects of the pH of the HCl solution, liquid to solid ratio (RL/S, HCl solution to the residue ratio, mL/g) and acidolysis time on the micro-morphology and crystalline phase of as-prepared TiO2 photocatalysts were systematically investigated. The results indicated that with decreasing pH in the HCl solution and increasing RL/S, the crystalline phase and micro-morphology of the obtained TiO2 nanostructures tended to transform from anatase type TiO2 with spherical nanoparticle structures to rutile type TiO2 with needle-like nanorod structures. The acidolysis time had little influence on the crystalline phase but great impact on the size of the obtained TiO2. The growth mechanism of TiO2 from Ti-bearing EAF slag during the acidolysis process was also discussed. In addition, the influence of RL/S on the photocatalytic properties of the synthesized nanostructured TiO2 was studied. The results showed that the photodegradation efficiency for Rhodamine B solution could reach 91.00% in 120min when the RL/S was controlled at 50:1.

  9. 逆相转移催化合成葵花籽油蔗糖酯%Synthesis of sunflower oil sucrose ester catalyzed by inverse phase - transfer catalyst

    Institute of Scientific and Technical Information of China (English)

    樊国栋; 康丽; 林振宇

    2012-01-01

    Using water solvent method, sunflower oil sucrose ester was synthesized by inverse phase -transfer catalyst DMAP with sucrose and fatty acid methyl ester prepared by ester - exchange method in the presence of basic catalyst from sunflower oil and methanol. The effects of molar ratio of fatty acids methyl ester to sucrose, catalyst dosage, reaction temperature and reaction time were studied. The results showed that the optimal conditions were as follows; molar ratio of fatty acids methyl ester to sucrose 2.5:1, catalyst dosage 4% , reaction temperature 85 °C and reaction time 7 h. Under the optimal conditions, the conversion rate of sunflower oil fatty acid methyl ester could reach 65. 32%. The final product had good surface activity, the critical micelle concentration(CMC) was 6. 5 g/L, surface tension was 27.41 mN/ m, emulsifying power was 79s, water count was 7. 2 mL, HLB was 10. 1 and iodine value was 126. 9 gI/ 100 g.%先由食用葵花籽油和甲醇在碱性催化剂条件下酯交换反应制得脂肪酸甲酯,然后脂肪酸甲酯与蔗糖通过水溶剂法,以逆相转移催化剂DMAP催化制备蔗糖脂肪酸酯.通过对酯糖摩尔比、催化剂用量、反应温度、反应时间进行考察,确定最佳合成条件为:酯糖摩尔比2.5∶1,催化剂用量4%,反应温度 85℃,反应时间7h.在最佳合成条件下,葵花籽油脂肪酸甲酯的转化率高达65.32%,所得产品具有良好的表面活性,其临界胶束质量浓度(CMC)为6.5 g/L,表面张力为27.41 mN/m,乳化力为79 s,浊点指数为7.2 mL,HLB值为10.1,碘值(Ⅰ)为126.9 g/100 g.

  10. STUDY OF IDENTIFICATION OF TWO-PHASE FLOW PARAMETERS BY PRESSURE FLUCTUATION ANALYSIS

    Directory of Open Access Journals (Sweden)

    Ondrej Burian

    2016-12-01

    Full Text Available This paper deals with identification of parameters of simple pool boiling in a vertical rectangular channel by analysis of pressure fluctuation. In this work is introduced a small experimental facility about 9 kW power, which was used for simulation of pool boiling phenomena and creation of steam-water volume. Several pressure fluctuations measurements and differential pressure fluctuations measurements at warious were carried out. Main changed parameters were power of heaters and hydraulics resistance of channel internals. Measured pressure data was statistically analysed and compared with goal to find dependencies between parameters of two-phase flow and statistical properties of pressure fluctuation. At the end of this paper are summarized final results and applicability of this method for parameters determination of two phase flow for pool boiling conditions at ambient pressure.

  11. Efficient epoxidation of propene using molecular catalysts

    DEFF Research Database (Denmark)

    Markovits, Iulius I. E.; Anthofer, Michael H.; Kolding, Helene

    2014-01-01

    The epoxidation of propene is performed in homogeneous phase using various molecular catalysts and H2O2 or tert-butyl hydroperoxide as oxidants. A comparison between some molybdenum catalysts and methyltrioxorhenium (MTO) shows that the well known Re catalyst is the best among the examined...

  12. Identification of superficial defects in reconstructed 3D objects using phase-shifting fringe projection

    Science.gov (United States)

    Madrigal, Carlos A.; Restrepo, Alejandro; Branch, John W.

    2016-09-01

    3D reconstruction of small objects is used in applications of surface analysis, forensic analysis and tissue reconstruction in medicine. In this paper, we propose a strategy for the 3D reconstruction of small objects and the identification of some superficial defects. We applied a technique of projection of structured light patterns, specifically sinusoidal fringes and an algorithm of phase unwrapping. A CMOS camera was used to capture images and a DLP digital light projector for synchronous projection of the sinusoidal pattern onto the objects. We implemented a technique based on a 2D flat pattern as calibration process, so the intrinsic and extrinsic parameters of the camera and the DLP were defined. Experimental tests were performed in samples of artificial teeth, coal particles, welding defects and surfaces tested with Vickers indentation. Areas less than 5cm were studied. The objects were reconstructed in 3D with densities of about one million points per sample. In addition, the steps of 3D description, identification of primitive, training and classification were implemented to recognize defects, such as: holes, cracks, roughness textures and bumps. We found that pattern recognition strategies are useful, when quality supervision of surfaces has enough quantities of points to evaluate the defective region, because the identification of defects in small objects is a demanding activity of the visual inspection.

  13. Multiplex Solid-Phase PCR for Rapid Detection and Identification of Salmonella spp. at Sub-species

    DEFF Research Database (Denmark)

    Cao, Cuong; Høgberg, Jonas; Wolff, Anders

    -PCR gel electrophoresis. The method will be useful for development of point-of-care devices for rapid detection and identification of Salmonella spp. A solid-phase PCR for rapid detection and identification of S. enteritidis, S. typhimurium and S. dublin is developed. The method offers advantages......This study presents a solid-phase PCR (SP-PCR) for rapid detection, identification, and sub-typing of various Salmonella species, the major food-borne cause of salmonellosis. The target DNA is firstly amplified with PCR primers (one primer is labeled with fluorophores) in the liquid phase...... by the liquid phase primer thus generating new templates for the SP-PCR. After the reaction, PCR products labeled with fluorophores remain attached to the substrate and can be visualized directly by fluorescence readout devices. Using this method, S. enteritidis, S. typhimurium and S. dublin can be detected...

  14. {gamma} alumina- and HY zeolite-supported molybdenum catalysts: characterisation of the oxidic and sulfided phases; Catalyseurs a base de molybdene supporte sur alumine {gamma} et zeolithe HY: caracterisation des phases oxydes et sulfures

    Energy Technology Data Exchange (ETDEWEB)

    Plazenet, G.

    2001-10-01

    Oxidic precursors of hydro-treatment catalysts (Co)Mo/alumina or zeolite were characterised by Raman spectroscopy, NMR and EXAFS at the Mo and Co K-edges. The formation of an Anderson-type alumino-molybdate compound upon impregnation of the support with an ammonium hepta-molybdate solution was confirmed for alumina, and also observed for the HY zeolitic support, with consumption of the amorphous alumina of the zeolite. In absence of the latter, ammonium hepta-molybdate precipitates. The species are conserved upon drying; upon calcination, the alumino-molybdate evolves into a surface aluminium molybdate type phase, whereas the hepta-molybdate transforms into MoO{sub 3}. The species formed upon impregnation are located in the inter-granular porosity whereas MoO{sub 3} vapor-condensation leads to formation of dimers located inside the zeolitic structure. The study of the cobalt-promoted precursors showed that the evolution of the molybdenum is the same in the case of co-impregnation preparation. Impregnation with cobalt-molybdate prevents the formation of the alumino-molybdate anion and thus enables the preservation of the Mo-Co interaction but, whatever the precursor, the leveling effect of the calcination-re-hydration steps was demonstrated. An EXAFS study at different sulfur coverages of the MoS{sub 2} platelets in the alumina-supported sulfided catalysts showed the limitations of EXAFS for size determination of MoS{sub 2} crystallites, a parameter that can be reached by AWAXS, which also conveys information about sheet-stacking. The EXAFS study of sulfided (Co)Mo/HY systems revealed incomplete sulfidation of the samples and the very high dispersion of the active phase. The absence of an observable Mo-Co interaction whatever the preparation of the promoted catalysts is consistent with the absence of promoting effect in toluene hydrogenation. (author)

  15. Surfactant-coated Candida rugosa Lipase as Catalyst for Hydrolysis of Olive Oil in Solvent-Free Two-Phase System

    Institute of Scientific and Technical Information of China (English)

    宋宝东; 丁辉; 吴金川; HayashiY.; TalukderMMR; 王世昌

    2003-01-01

    The surfactant-coated Candida rugosa lipase was used as catalyst for hydrolysis of olive oil in two-phase system consisting of olive oil and phosphate buffer without organic solvent. For both the coated and native lipases,the optimal buffer/oil volume ratio of 1.0, aqueous pH 6.8 and reaction temperature 30℃ were determined. The maximum activity of the coated lipase was ca 1.3 times than that of the native lipase. The half-life of the coated lipase in olive oil and the native lipase in phosphate buffer was ca 9 h and 12 h, and the final residual activity was 27% and 20% of their initial values, respectively. The final substrate conversion by the coated lipase was ca 20% higher than that of the native lipase.

  16. Toward stable nickel catalysts for aqueous phase reforming of biomass-derived feedstock under reducing and alkaline conditions

    NARCIS (Netherlands)

    Haasterecht, van T.; Ludding, C.C.I.; Jong, de K.P.; Bitter, J.H.

    2014-01-01

    Nickel nanoparticles supported on carbon nanofibers (CNF) can be stabilized in aqueous phase processes at elevated temperatures and pressures by tuning the reaction conditions to control Ni oxidation and leaching. As a showcase, Ni/CNF was used for the production of hydrogen via aqueous phase

  17. 40 CFR 90.427 - Catalyst thermal stress resistance evaluation.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 20 2010-07-01 2010-07-01 false Catalyst thermal stress resistance... Gaseous Exhaust Test Procedures § 90.427 Catalyst thermal stress resistance evaluation. (a) The purpose of... catalyst conversion efficiency for Phase 1 engines. The thermal stress is imposed on the test catalyst...

  18. ANSID: A Solid-Phase Proteomic Approach for Identification and Relative Quantification of Aromatic Nitration Sites.

    Science.gov (United States)

    Nuriel, Tal; Whitehouse, Julia; Ma, Yuliang; Mercer, Emily J; Brown, Neil; Gross, Steven S

    2015-01-01

    Nitration of tyrosine and other aromatic amino acid residues in proteins occurs in the setting of inflammatory, neurodegenerative, and cardiovascular diseases-importantly, this modification has been implicated in the pathogenesis of diverse diseases and the physiological process of aging. To understand the biological consequences of aromatic nitration in both health and disease, it is critical to molecularly identify the proteins that undergo nitration, specify their cognate modification sites and quantify their extent of nitration. To date, unbiased identification of nitrated proteins has often involved painstaking 2D-gel electrophoresis followed by Western Blotting with an anti-nitrotyrosine antibody for detection. Apart from being relatively slow and laborious, this method suffers from limited coverage, the potential for false-positive identifications, and failure to reveal specific amino acid modification sites. To overcome these shortcomings, we have developed a solid-phase, chemical-capture approach for unbiased and high-throughput discovery of nitrotyrosine and nitrotryptophan sites in proteins. Utilizing this method, we have successfully identified several endogenously nitrated proteins in rat brain and a total of 244 nitrated peptides from 145 proteins following in vitro exposure of rat brain homogenates to the nitrating agent peroxynitrite (1 mM). As expected, Tyr residues constituted the great majority of peroxynitrite-mediated protein nitration sites; however, we were surprised to discover several brain proteins that contain nitrated Trp residues. By incorporating a stable-isotope labeling step, this new Aromatic Nitration Site IDentification (ANSID) method was also adapted for relative quantification of nitration site abundances in proteins. Application of the ANSID method offers great potential to advance our understanding of the role of protein nitration in disease pathogenesis and normal physiology.

  19. Rapid experimental SAD phasing and hot-spot identification with halogenated fragments

    Energy Technology Data Exchange (ETDEWEB)

    Bauman, Joseph D.; Harrison, Jerry Joe E. K.; Arnold, Eddy

    2016-01-01

    Through X-ray crystallographic fragment screening, 4-bromopyrazole was discovered to be a `magic bullet' that is capable of binding at many of the ligand `hot spots' found in HIV-1 reverse transcriptase (RT). The binding locations can be in pockets that are `hidden' in the unliganded crystal form, allowing rapid identification of these sites forin silicoscreening. In addition to hot-spot identification, this ubiquitous yet specific binding provides an avenue for X-ray crystallographic phase determination, which can be a significant bottleneck in the determination of the structures of novel proteins. The anomalous signal from 4-bromopyrazole or 4-iodopyrazole was sufficient to determine the structures of three proteins (HIV-1 RT, influenza A endonuclease and proteinase K) by single-wavelength anomalous dispersion (SAD) from single crystals. Both compounds are inexpensive, readily available, safe and very soluble in DMSO or water, allowing efficient soaking into crystals.

  20. Unbalance Identification of Speed-Variant Rotary Machinery without Phase Angle Measurement

    Directory of Open Access Journals (Sweden)

    Cong Yue

    2015-01-01

    Full Text Available As rotary mechanical structure becomes more complicated, difficulty arises in receiving prime correction mass and optimum balancing plane efficiently. An innovative modal balancing process for estimating the residual unbalance from different equilibrium plane of complex flexible rotor system is presented. The method is based on a numerical approach with modal ratio among measurement points (MRMP coefficient and triple phase method (TPM. The veracity of calculation result is verified by an academic rotor model. The latter study in this paper is subsequently put forward through a power turbine rotor modeled by finite element method. Simulation results show that proper equilibrium plane performs commendably in recognizing residual unbalance and reducing the vibration effect through the critical region. Moreover, the inherent unbalance recognized by experimental data from a turbine rotor with slender shaft is found to be in certain difference under different counterweight combination. Choosing suitable balancing planes will improve the accuracy of unbalance identification.

  1. Preparation of nanosize Cu-ZnO/Al{sub 2}O{sub 3} catalyst for methanol synthesis by phase transfer with metal surfactant. 2: Effect of additives and chain length of surfactant

    Energy Technology Data Exchange (ETDEWEB)

    Hu, Z.; Chen, S.; Peng, S. [Chinese Academy of Science, Taiyuan, Shanxi (China). Inst. of Coal Chemistry

    1996-09-25

    Nanosize Cu-ZnO/Al{sub 2}O{sub 3} catalysts for methanol synthesis were prepared by the metal surfactant phase transfer technique. The effects of chain length of surfactant and additives were studied. It was found that the longer the organic chain of surfactant, the more stable the sol particles and the larger the surface area of catalyst. The decomposition temperature of surfactants with longer chains was also higher. For the preparation of Cu-ZnO/Al{sub 2}O{sub 3} catalyst, the surfactant organic chain should not be longer than 11 carbon atoms. A synergist could be used to improve surfactant efficiency. A stabilizing agent was used to strength the stability of sol particles in water. The time needed for oil-water separation was reduced markedly by using a demulsifying agent. The optimal mole ratios of synergist, stabilizing agent, and demulsifying agent to surfactant were, respectively, 0.6, 0.6, and 1.

  2. Catalyst mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Masel, Richard I.; Rosen, Brian A.

    2017-02-14

    Catalysts that include at least one catalytically active element and one helper catalyst can be used to increase the rate or lower the overpotential of chemical reactions. The helper catalyst can simultaneously act as a director molecule, suppressing undesired reactions and thus increasing selectivity toward the desired reaction. These catalysts can be useful for a variety of chemical reactions including, in particular, the electrochemical conversion of CO.sub.2 or formic acid. The catalysts can also suppress H.sub.2 evolution, permitting electrochemical cell operation at potentials below RHE. Chemical processes and devices using the catalysts are also disclosed, including processes to produce CO, OH.sup.-, HCO.sup.-, H.sub.2CO, (HCO.sub.2).sup.-, H.sub.2CO.sub.2, CH.sub.3OH, CH.sub.4, C.sub.2H.sub.4, CH.sub.3CH.sub.2OH, CH.sub.3COO.sup.-, CH.sub.3COOH, C.sub.2H.sub.6, O.sub.2, H.sub.2, (COOH).sub.2, or (COO.sup.-).sub.2, and a specific device, namely, a CO.sub.2 sensor.

  3. Identification of liquid-phase decomposition species and reactions for guanidinium azotetrazolate

    Energy Technology Data Exchange (ETDEWEB)

    Kumbhakarna, Neeraj R.; Shah, Kaushal J.; Chowdhury, Arindrajit; Thynell, Stefan T., E-mail: thynell@psu.edu

    2014-08-20

    Highlights: • Guanidinium azotetrazolate (GzT) is a high-nitrogen energetic material. • FTIR spectroscopy and ToFMS spectrometry were used for species identification. • Quantum mechanics was used to identify transition states and decomposition pathways. • Important reactions in the GzT liquid-phase decomposition process were identified. • Initiation of decomposition occurs via ring opening, releasing N{sub 2}. - Abstract: The objective of this work is to analyze the decomposition of guanidinium azotetrazolate (GzT) in the liquid phase by using a combined experimental and computational approach. The experimental part involves the use of Fourier transform infrared (FTIR) spectroscopy to acquire the spectral transmittance of the evolved gas-phase species from rapid thermolysis, as well as to acquire spectral transmittance of the condensate and residue formed from the decomposition. Time-of-flight mass spectrometry (ToFMS) is also used to acquire mass spectra of the evolved gas-phase species. Sub-milligram samples of GzT were heated at rates of about 2000 K/s to a set temperature (553–573 K) where decomposition occurred under isothermal conditions. N{sub 2}, NH{sub 3}, HCN, guanidine and melamine were identified as products of decomposition. The computational approach is based on using quantum mechanics for confirming the identity of the species observed in experiments and for identifying elementary chemical reactions that formed these species. In these ab initio techniques, various levels of theory and basis sets were used. Based on the calculated enthalpy and free energy values of various molecular structures, important reaction pathways were identified. Initiation of decomposition of GzT occurs via ring opening to release N{sub 2}.

  4. Photo-oxidation catalysts

    Science.gov (United States)

    Pitts, J. Roland; Liu, Ping; Smith, R. Davis

    2009-07-14

    Photo-oxidation catalysts and methods for cleaning a metal-based catalyst are disclosed. An exemplary catalyst system implementing a photo-oxidation catalyst may comprise a metal-based catalyst, and a photo-oxidation catalyst for cleaning the metal-based catalyst in the presence of light. The exposure to light enables the photo-oxidation catalyst to substantially oxidize absorbed contaminants and reduce accumulation of the contaminants on the metal-based catalyst. Applications are also disclosed.

  5. Microscopic characterization of changes in the structure of KCo/CeO{sub 2} catalyst used in the steam reforming of ethanol

    Energy Technology Data Exchange (ETDEWEB)

    Słowik, Grzegorz, E-mail: Grzegorz.Slowik@poczta.umcs.lublin.pl; Greluk, Magdalena; Machocki, Andrzej

    2016-04-15

    The cobalt catalyst with a support of CeO{sub 2} and potassium promoted (KCo/CeO{sub 2}) was prepared by an impregnation method and used in the steam reforming of ethanol (SRE). The catalyst was characterized in its initial oxide form and after its work in the SRE by electron microscopy and EDS methods. Microscopic characterization of the catalyst allowed for identification of the active phase (in Co{sub 3}O{sub 4} form) and the CeO{sub 2} support phase (O-terminated), existing in the fresh catalyst, and also the active phase (at various forms, Co and CoO), support phase as well as various carbonaceous phases in the used catalyst. STEM-EDS studies allowed to determine the distribution of constituent elements in the catalyst before reaction and besides of them - also carbon deposit after the SRE. Microscopic studies of used catalyst proved that it was largely covered with carbonaceous deposit which was the main reason of deactivation of the catalyst. Carbon deposit growing during the reaction causes destruction of the support and the active phase into smaller particles which are sunked in the carbonaceous structures. - Highlights: • CeO{sub 2} and K promoter do not prevent cobalt catalyst from carbon formation in the SRE. • Carbon deposit was present in three forms: fibrous, encapsulates, partly surrounding. • Two types of carbon deposit structures: amorphous and hexagonal graphite were found. • Metallic cobalt and ceria support crystallites are present with K in fibrous carbon. • Cobalt active phase is present under SRE conditions as metallic Co and CoO.

  6. Asymmetric Volcano Trend in Oxygen Reduction Activity of Pt and Non-Pt Catalysts: In Situ Identification of the Site-Blocking Effect.

    Science.gov (United States)

    Li, Jingkun; Alsudairi, Amell; Ma, Zi-Feng; Mukerjee, Sanjeev; Jia, Qingying

    2017-02-01

    Proper understanding of the major limitations of current catalysts for oxygen reduction reaction (ORR) is essential for further advancement. Herein by studying representative Pt and non-Pt ORR catalysts with a wide range of redox potential (Eredox) via combined electrochemical, theoretical, and in situ spectroscopic methods, we demonstrate that the role of the site-blocking effect in limiting the ORR varies drastically depending on the Eredox of active sites; and the intrinsic activity of active sites with low Eredox have been markedly underestimated owing to the overlook of this effect. Accordingly, we establish a general asymmetric volcano trend in the ORR activity: the ORR of the catalysts on the overly high Eredox side of the volcano is limited by the intrinsic activity; whereas the ORR of the catalysts on the low Eredox side is limited by either the site-blocking effect and/or intrinsic activity depending on the Eredox.

  7. Triphasic liquid systems: generation and segregation of catalytically active Pd nanoparticles in an ammonium-based catalyst-philic phase.

    Science.gov (United States)

    Perosa, Alvise; Tundo, Pietro; Selva, Maurizio; Canton, Patrizia

    2006-11-21

    A triphasic liquid system fabricated from isooctane, aqueous base, and trioctylmethylammonium chloride/decanol promoted the formation of Pd-nanoparticles in the size range of 2-4 nm which remained immobilised in the onium phase, catalysed organic reactions, and could be recycled.

  8. Stability and activity of carbon nanofiber-supported catalysts in the aqueous phase reforming of ethylene glycol

    NARCIS (Netherlands)

    Haasterecht, van T.; Ludding, C.C.I.; Jong, de K.P.; Bitter, J.H.

    2013-01-01

    Nickel, cobalt, copper and platinum nanoparticles supported on carbon nano-fibers were evaluated with respect to their stability, catalytic activity and selectivity in the aqueous phase reforming of ethylene glycol (230 ¿, autogenous pressure, batch reactor). The initial surface-specific activities

  9. Ru decorated carbon nanotubes - a promising catalyst for reforming bio-based acetic acid in the aqueous phase

    NARCIS (Netherlands)

    Vlieger, de D.J.M.; Lefferts, L.; Seshan, K.

    2014-01-01

    Catalytic reforming of biomass derived waste streams in the aqueous phase is a promising process for the production of sustainable hydrogen. Acetic acid will be a major component (up to 20 wt%) in many anticipated gasification feed streams (e.g. the aqueous fraction of pyrolysis oil). Conventional s

  10. Stability and activity of carbon nanofiber-supported catalysts in the aqueous phase reforming of ethylene glycol

    NARCIS (Netherlands)

    van Haasterecht, T.|info:eu-repo/dai/nl/328206458; Ludding, C.C.I.; de Jong, K.P.|info:eu-repo/dai/nl/06885580X; Bitter, J.H.|info:eu-repo/dai/nl/160581435

    2013-01-01

    Nickel, cobalt, copper and platinum nanoparticles supported on carbon nano-fibers were evaluated with respect to their stability, catalytic activity and selectivity in the aqueous phase reforming of ethylene glycol (230 ◦C, autogenous pressure, batch reactor). The initial surface-specific activities

  11. Stability and activity of carbon nanofiber-supported catalysts in the aqueous phase reforming of ethylene glycol

    NARCIS (Netherlands)

    Haasterecht, van T.; Ludding, C.C.I.; Jong, de K.P.; Bitter, J.H.

    2013-01-01

    Nickel, cobalt, copper and platinum nanoparticles supported on carbon nano-fibers were evaluated with respect to their stability, catalytic activity and selectivity in the aqueous phase reforming of ethylene glycol (230 ¿, autogenous pressure, batch reactor). The initial surface-specific activities

  12. Ru decorated carbon nanotubes - a promising catalyst for reforming bio-based acetic acid in the aqueous phase

    NARCIS (Netherlands)

    de Vlieger, Dennis; Lefferts, Leonardus; Seshan, Kulathuiyer

    2014-01-01

    Catalytic reforming of biomass derived waste streams in the aqueous phase is a promising process for the production of sustainable hydrogen. Acetic acid will be a major component (up to 20 wt%) in many anticipated gasification feed streams (e.g. the aqueous fraction of pyrolysis oil). Conventional

  13. Stability and activity of carbon nanofiber-supported catalysts in the aqueous phase reforming of ethylene glycol

    NARCIS (Netherlands)

    van Haasterecht, T.; Ludding, C.C.I.; de Jong, K.P.; Bitter, J.H.

    2013-01-01

    Nickel, cobalt, copper and platinum nanoparticles supported on carbon nano-fibers were evaluated with respect to their stability, catalytic activity and selectivity in the aqueous phase reforming of ethylene glycol (230 ◦C, autogenous pressure, batch reactor). The initial surface-specific activities

  14. Development of monolith with a carbon-nanofiber-washcoat as a structured catalyst support in liquid phase

    NARCIS (Netherlands)

    Jarrah, Nabeel A.; Ommen, van J.G.; Lefferts, L.

    2003-01-01

    Washcoats with improved mass transfer properties are necessary to circumvent concentration gradients in case of fast reactions in liquid phase, e.g. nitrate hydrogenation. A highly porous, high surface area (180 m2/g) and thin washcoat of carbon fibers, was produced on a monolith support by methane

  15. 3D surface real-time measurement using phase-shifted interference fringe technique for craniofacial identification

    Science.gov (United States)

    Levin, Gennady G.; Vishnyakov, Gennady N.; Naumov, Alexey V.; Abramov, Sergey

    1998-03-01

    We offer to use the 3D surface profile real-time measurement using phase-shifted interference fringe projection technique for the cranioficial identification. Our system realizes the profile measurement by projecting interference fringe pattern on the object surface and by observing the deformed fringe pattern at the direction different from the projection. Fringes are formed by a Michelson interferometer with one mirror mounted on a piezoelectric translator. Four steps self- calibration phase-shift method was used.

  16. Near-infrared line identification in type Ia supernovae during the transitional phase

    CERN Document Server

    Friesen, Brian; Wisniewski, John P; Parrent, Jerod T; Thomas, R C; Miller, Timothy R; Marion, G H

    2014-01-01

    We present near-infrared synthetic spectra of a delayed-detonation hydrodynamical model and compare them to observed spectra of four normal type Ia supernovae ranging from day +56.5 to day +85. This is the epoch during which supernovae are believed to be undergoing the transition from the photospheric phase, where spectra are characterized by line scattering above an optically thick photosphere, to the nebular phase, where spectra consist of optically thin emission from forbidden lines. We find that most spectral features in the near-infrared can be accounted for by permitted lines of Fe II and Co II. In addition, we find that [Ni II] fits the emission feature near 1.98 {\\mu}m, suggesting that a substantial mass of 58Ni exists near the center of the ejecta in these objects, arising from nuclear burning at high density. A tentative identification of Mn II at 1.15 {\\mu}m may support this conclusion as well.

  17. Identification and initial assessment of candidate BWR late-phase in-vessel accident management strategies

    Energy Technology Data Exchange (ETDEWEB)

    Hodge, S.A.

    1991-04-15

    Work sponsored by the United States Nuclear Regulatory Commission (USNRC) to identify and perform preliminary assessments of candidate BWR (boiling water reactor) in-vessel accident management strategies was completed at Oak Ridge National Laboratory (ORNL) during fiscal year 1990. Mitigative strategies for containment events have been the subject of a companion study at Brookhaven National Laboratory. The focus of this Oak Ridge effort was the development of new strategies for mitigation of the late phase events, that is, the events that would occur in-vessel after the onset of significant core damage. The work began with an investigation of the current status of BWR in-vessel accident management procedures and proceeded through a preliminary evaluation of several candidate new strategies. The steps leading to the identification of the candidate strategies are described. The four new candidate late-phase (in-vessel) accident mitigation strategies identified by this study and discussed in the report are: (1) keep the reactor vessel depressurized; (2) restore injection in a controlled manner; (3) inject boron if control blade damage has occurred; and (4) containment flooding to maintain core and structural debris in-vessel. Additional assessments of these strategies are proposed.

  18. Production of renewable hydrogen from aqueous-phase reforming of glycerol overPt catalysts supported on different oxides

    OpenAIRE

    Menezes, André O; Rodrigues, Michelly T.; Fraga, Marco André; Zimmaro, Adriana

    2010-01-01

    Aqueous-phase reforming of oxygenated hydrocarbons for hydrogen production presents several advantages as feed molecules can be easily found in a wide range of biomass, there is no need for its vaporization and the process allows thorough exploitation of the environmental benefits of using hydrogen as an energy carrier. The use of glycerol in particular is motivated due to its availability as a consequence of increasing biodiesel production worldwide. In this contribution, the performance ...

  19. 辛醇气相加氢催化剂使用寿命影响因素浅析%Briefly Analyzing Affecting Factors on Service Life of Vapor Phase Hydrogenation Catalyst of Butanol

    Institute of Scientific and Technical Information of China (English)

    杨保利; 刘金辉; 付文敬; 郭玉峰

    2012-01-01

    介绍了辛醇装置辛烯醛气相加氢(VPH)工艺流程和气相加氢催化剂的物化性能;从催化剂的装填、还原、运行、钝化以及催化剂卸出的全过程,逐段分析了可能影响催化剂使用寿命的因素,并提出了延长催化剂使用寿命的操作要求。%Abstract:Author has introduced the vapor phase hydrogenation (VPH) process flow of the octylene aldehyde in the butanol plant and the physical/ chemical properties of vapor phase hydrogenation catalyst; has, step by step, analyzed the affecting factors of possibly influencing the service life of cata- lyst from the whole process of catalyst filling, reduction, running, passivating and removing catalyst out, and has presented the operating requirement e- longating the service life of the catalyst.

  20. Low-temperature (≤600 °C) growth of high-quality In x Ga1‑ x N (x ∼ 0.3) by metalorganic vapor phase epitaxy using NH3 decomposition catalyst

    Science.gov (United States)

    Yamamoto, Akio; Kodama, Kazuki; Matsuoka, Takashi; Kuzuhara, Masaaki

    2017-04-01

    In x Ga1‑ x N (x ∼ 0.3) films on GaN/sapphire templates were grown by NH3 decomposition catalyst-assisted metalorganic vapor phase epitaxy (CA-MOVPE). NiO-based pellets were used as a catalyst. Even at a temperature lower than 500 °C, single-crystal In0.3Ga0.7N films were grown without the incorporation of metallic components (In, Ga) or the cubic phase. In contrast with the case of InN growth using the same catalyst [A. Yamamoto et al., Jpn. J. Appl. Phys. 55, 05FD04 (2016)], no marked grain growth or hydrogen etching was observed in In0.3Ga0.7N. Samples grown at a temperature ≤500 °C showed a full-width at half-maximum of the (0002) X-ray rocking curve as small as 10 arcmin or smaller. The carrier concentration in nominally undoped In0.3Ga0.7N grown using the catalyst was higher by about 4 orders of magnitude than that in conventional MOVPE samples. Secondary ion mass spectroscopy analysis revealed that such a higher carrier concentration was due to the marked reduction in carbon contamination level in the films.

  1. Highly dispersed metal catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Xiao, Xin; West, William L.; Rhodes, William D.

    2016-11-08

    A supported catalyst having an atomic level single atom structure is provided such that substantially all the catalyst is available for catalytic function. A process of forming a single atom catalyst unto a porous catalyst support is also provided.

  2. Use of Hydrogen Chemisorption and Ethylene Hydrogenation as Predictors for Aqueous Phase Reforming of Lactose over Ni@Pt and Co@Pt Bimetallic Overlayer Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Lai, Qinghua; Skoglund, Michael D.; Zhang, Chen; Morris, Allen R.; Holles, Joseph H.

    2016-10-20

    Overlayer Pt on Ni (Ni@Pt) or Co (Co@Pt) were synthesized and tested for H2 generation from APR of lactose. H2 chemisorption descriptor showed that Ni@Pt and Co@Pt overlayer catalysts had reduced H2 adsorption strength compared to a Pt only catalyst, which agree with computational predictions. The overlayer catalysts also demonstrated lower activity for ethylene hydrogenation than the Pt only catalyst, which likely resulted from decreased H2 binding strength decreasing the surface coverage of H2. XAS results showed that overlayer catalysts exhibited higher white line intensity than the Pt catalyst, which indicates a negative d-band shift for the Pt overlayer, further providing evidence for overlayer formation. Lactose APR studies showed that lactose can be used as feedstock to produce H2 and CO under desirable reaction conditions. The Pt active sites of Ni@Pt and Co@Pt overlayer catalysts showed significantly enhanced H2 production selectivity and activity when compared with that of a Pt only catalyst. The single deposition overlayer with the largest d-band shift showed the highest H2 activity. The results suggest that overlayer formation using directed deposition technique could modify the behavior of the surface metal and ultimately modify the APR activity.

  3. Solution-free and catalyst-free synthesis of ZnO-based nanostructured TCOs by PED and vapor phase growth techniques.

    Science.gov (United States)

    Calestani, D; Pattini, F; Bissoli, F; Gilioli, E; Villani, M; Zappettini, A

    2012-05-17

    Zinc oxide (ZnO) is one of the most promising materials for realizing three-dimensional (3D) nanostructured transparent conducting oxides (TCOs) on large scale, because it is cheap, it can be modified with large concentrations of trivalent elements (such Al, Ga or In) and it is characterized by good electron mobility, wide bandgap and visible-range transparency. But, above all, it can be easily obtained in the form of different nanostructures with a large number of growth techniques. A solution-free and catalyst-free approach has been explored here by the vapor phase synthesis of vertically aligned ZnO nanorods on ZnO:Al (AZO) films grown by pulsed electron deposition (PED). The obtained nanostructured TCOs resulted to be homogeneous on large areas and easily patternable by means of mechanical masks. The morphology, crystalline structure, electrical and optical properties of the obtained samples have been characterized in depth. The possible use of such a nanostructured TCO in excitonic (e.g. DSSC) or low-reflectivity traditional solar cells is discussed.

  4. Multidisciplinary determination of the phase distribution for VOX–ZrO2–SO42−–sepiolite catalysts for NH3-SCR

    DEFF Research Database (Denmark)

    Rasmussen, S.B.; Due-Hansen, Johannes; Villarroel, M.

    2011-01-01

    by the electrophoretic migration technique. The samples were further characterised by nitrogen adsorption, NH3-TPD, XRD and scanning electron micrography techniques. The electrophoretic migration results showed that the addition of sepiolite to VSZ, by kneading in water, had a dramatic effect on the quantity of VOX–ZrO2......A series of V2O5–ZrO2–SO42−–sepiolite mixtures were extruded, calcined and characterised. NH3-SCR activity was found to be related to the content of the active VOX–ZrO2–SO42− phase (VSZ). The distribution of sepiolite and VSZ at the surface of the mechanical mixtures was studied...... results. Furthermore, it was verified by electrophoretic migration experiments that up until a composition of 75% VOX–ZrO2–SO42−, the sepiolite fibers coats the zirconia particles. This has a slightly negative influence on the overall SCR activity of fresh catalysts....

  5. Properties and reactions of manganese methylene complexes in the gas phase. The importance of strong metal: carbene bonds for effective olefin metathesis catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Stevens, A.E.; Beauchamp, J.L.

    1979-10-10

    In this communication the formation, properties and reactions of the gas phase carbenes MnCH/sub 2//sup +/, (CO)/sub 5/MnCH/sub 2//sup +/, and (CO)/sub 4/MnCH/sub 2//sup +/ are described. Reported results include observation of metathesis and abstraction reactions of the methylene ligand with olefins and the first experimental determination of metal-carbene bond dissociation energies. Important points are that: (a) metal-methylene bond energies are extremely strong; and (b) the Mn/sup +/-methylene bond energy is decreased substantially on addition of five carbonyls to the metal center. If the metal-carbene bond energy exceeds 100 kcal/mol, then transfer of the carbene to an olefin to give a cyclopropane or new olefin will be endothermic and thus will not compete with the metathesis reaction. In order to avoid low turnover numbers resulting from consumption of carbene intermediates, strong metal-carbene bonds are a desirable feature of practical metathesis catalysts. (DP)

  6. Nanoengineering Ni(x)Fe(1-x) catalysts for gas-phase, selective synthesis of semiconducting single-walled carbon nanotubes.

    Science.gov (United States)

    Chiang, Wei-Hung; Sakr, Mohammed; Gao, Xuan P A; Sankaran, R Mohan

    2009-12-22

    The inhomogeneity of as-grown single-walled carbon nanotubes (SWCNTs), in terms of chiral structure, is a major obstacle to integration of these novel materials in advanced electronics. While separation methods have circumvented this problem, current synthesis approaches must be refined for large-scale production of SWCNTs with uniform properties. In addition, it is highly desirable to alter the initial chirality distribution which constrains fundamental study and applications. Here, we demonstrate that semiconducting SWCNTs are selectively produced in the gas phase by engineering catalysts at the nanoscale with precise size and composition. The semiconducting content in as-grown mixtures of SWCNTs is assessed by UV-visible-NIR absorbance and micro-Raman spectroscopy and reaches a maximum purity of 90% for samples catalyzed by Ni(0.27)Fe(0.73) nanoparticles (2.0 nm mean diameter). Electrical studies are performed on thin film transistors (TFTs) fabricated from as-grown SWCNTs and reveal high on/off current ratios of 10(3).

  7. Ultrathin 1T-phase MoS2 nanosheets decorated hollow carbon microspheres as highly efficient catalysts for solar energy harvesting and storage

    Science.gov (United States)

    Hsiao, Min-Chien; Chang, Chin-Yu; Niu, Li-Juan; Bai, Feng; Li, Lain-Jong; Shen, Hsin-Hui; Lin, Jeng-Yu; Lin, Tsung-Wu

    2017-03-01

    The composite of MoS2 and hollow carbon sphere (MoS2@HCS) is prepared via a glucose-assisted one pot synthesis. The composite consists of hierarchical spheres with a diameter of 0.5-4 μm and these hollow spheres are decorated with a number of curled and interlaced MoS2 nanosheets. After the composite is subject to the lithium intercalation, the MoS2 is converted from 2H to 1T phase. In this current work, the activities of 1T-MoS2@HCS toward photocatalytic hydrogen evolution and the reduction of I3- in dye-sensitized solar cells (DSCs) are systemically investigated. When evaluated as the photocatalyst for hydrogen evolution, the amount of evolved hydrogen over 1T-MoS2@HCS can reach 143 μmol in 2 h, being 3.6 times higher than as-synthesized 2H-MoS2@HCS. Additionally, the 1T-MoS2@HCS can be employed as the counter electrode (CE) material in DSCs. The DSCs based on 1T-MoS2@HCS CE possesses the power conversion efficiency of 8.94%, being higher than that with 2H-MoS2@HCS CE (8.16%) and comparable to that with Pt CE (8.87%). Our study demonstrates that 1T-MoS2@HCS has a great potential as an inexpensive alternative to Pt catalysts.

  8. Identification of the arsenic resistance on MoO3 doped CeO2/TiO2 catalyst for selective catalytic reduction of NOx with ammonia.

    Science.gov (United States)

    Li, Xiang; Li, Xiansheng; Li, Junhua; Hao, Jiming

    2016-11-15

    Arsenic resistance on MoO3 doped CeO2/TiO2 catalysts for selective catalytic reduction of NOx with NH3 (NH3-SCR) is investigated. It is found that the activity loss of CeO2-MoO3/TiO2 caused by As oxide is obvious less than that of CeO2/TiO2 catalysts. The fresh and poisoned catalysts are compared and analyzed using XRD, Raman, XPS, H2-TPR and in situ DRIFTS. The results manifest that the introduction of arsenic oxide to CeO2/TiO2 catalyst not only weakens BET surface area, surface acid sites and adsorbed NOx species, but also destroy the redox circle of Ce(4+) to Ce(3+) because of interaction between Ce and As. When MoO3 is added into CeO2/TiO2 system, the main SCR reaction path are found to be changed from the reaction between coordinated NH3 and ad-NOx species to that between an amide and gaseous NO. Additionally, for CeO2-MoO3/TiO2 catalyst, As toxic effect on active sites CeO2 can be released because of stronger As-Mo interaction. Moreover, not only are the reactable Brønsted and Lewis acid sites partly restored, but the cycle of Ce(4+) to Ce(3+) can also be free to some extent.

  9. Catalyst Architecture

    DEFF Research Database (Denmark)

    Kiib, Hans; Marling, Gitte; Hansen, Peter Mandal

    2014-01-01

    How can architecture promote the enriching experiences of the tolerant, the democratic, and the learning city - a city worth living in, worth supporting and worth investing in? Catalyst Architecture comprises architectural projects, which, by virtue of their location, context and their combination...... of programs, have a role in mediating positive social and/or cultural development. In this sense, we talk about architecture as a catalyst for: sustainable adaptation of the city’s infrastructure appropriate renovation of dilapidated urban districts strengthening of social cohesiveness in the city development...

  10. Fischer-Tropsch Synthesis: Influence of CO Conversion on Selectivities H2/CO Usage Ratios and Catalyst Stability for a 0.27 percent Ru 25 percent Co/Al2O3 using a Slurry Phase Reactor

    Energy Technology Data Exchange (ETDEWEB)

    W Ma; G Jacobs; Y Ji; T Bhatelia; D Bukur; S Khalid; B Davis

    2011-12-31

    The effect of CO conversion on hydrocarbon selectivities (i.e., CH{sub 4}, C{sub 5+}, olefin and paraffin), H{sub 2}/CO usage ratios, CO{sub 2} selectivity, and catalyst stability over a wide range of CO conversion (12-94%) on 0.27%Ru-25%Co/Al{sub 2}O{sub 3} catalyst was studied under the conditions of 220 C, 1.5 MPa, H{sub 2}/CO feed ratio of 2.1 and gas space velocities of 0.3-15 NL/g-cat/h in a 1-L continuously stirred tank reactor (CSTR). Catalyst samples were withdrawn from the CSTR at different CO conversion levels, and Co phases (Co, CoO) in the slurry samples were characterized by XANES, and in the case of the fresh catalysts, EXAFS as well. Ru was responsible for increasing the extent of Co reduction, thus boosting the active site density. At 1%Ru loading, EXAFS indicates that coordination of Ru at the atomic level was virtually solely with Co. It was found that the selectivities to CH{sub 4}, C{sub 5+}, and CO{sub 2} on the Co catalyst are functions of CO conversion. At high CO conversions, i.e. above 80%, CH{sub 4} selectivity experienced a change in the trend, and began to increase, and CO{sub 2} selectivity experienced a rapid increase. H{sub 2}/CO usage ratio and olefin content were found to decrease with increasing CO conversion in the range of 12-94%. The observed results are consistent with water reoxidation of Co during FTS at high conversion. XANES spectroscopy of used catalyst samples displayed spectra consistent with the presence of more CoO at higher CO conversion levels.

  11. The development of aqueous transfer hydrogenation catalysts.

    Science.gov (United States)

    Robertson, Andrew; Matsumoto, Takahiro; Ogo, Seiji

    2011-10-28

    This review discusses the development of aqueous phase, homogeneous, transfer hydrogenation catalysis. Transfer hydrogenation catalysts, based on Ru, Ir and Rh, reduce organic substrates in water by assisting the transfer of hydrogen from simple donor species. These catalysts are expected to have significant benefits when compared with organic phase catalysts, including greater activity, greater selectivity and smaller environmental impact. They will therefore be expected to make a significant contribution to homogeneous catalysis and 'green chemistry'. Here, we comprehensively examine these catalysts, paying special attention to structural features.

  12. On the importance of the phase distribution and acidity of VOx-ZrO2-SO4-sepiolite catalysts for the NH3-SCR process in relation to biomass fueled power plants

    DEFF Research Database (Denmark)

    Due-Hansen, Johannes; Rasmussen, Søren Birk; Riisager, Anders

    A series of V2O5-ZrO2-SO42- - sepiolite mixtures were extruded, calcined and characterized. NH3-SCR activity was related to the phase distribution of the agglomerant and active VOX-ZrO2-SO42- phase, as well as the acidity of the composite material. Electrophoretic migration results showed...... that the addition of sepiolite to zirconia had effect on the quantity of zirconia present at the support’s surface, both strongly decreasing the molar fraction of zirconia at the surface, and altering the electrophoretic properties of the mixtures. Addition of extra ammonia sulfate eliminate both effects, and thus...... facilitate the production of a sepiolite-based conformed catalyst based on VOx-ZrO2-SO42-, which has been shown to be more resistant to the industrially implemented V2O5-WO3/TiO2 catalyst....

  13. 乙醇在新型Mo/C催化剂上的气相羰基化反应%Vapor Phase Carbonylation of Ethanol over Novel Mo/C Catalyst

    Institute of Scientific and Technical Information of China (English)

    何红运; 彭峰

    2000-01-01

    @@ The carbonylation of alcohol to acid or ester is an important process in the chemical industry. The Monsanto process for acetic acid via the homoge neous carbonylation of methanol is an example of the largest scale commercial application of this route[1].Recently, ethanol carbonylation for manufacturing propionic acid and ethyl propionate became an at tractive approach, and many research efforts were made for an appropriate catalyst to carry out the va por phase carbonylation under atmospheric pres sure[2~4]. Although an iodide-promoted Ni/C cata lyst is found to exhibit satisfactory activity and se lectivity for the vapor phase carbonylation of ethanol, it is affected by the disadvantages associat ed with a highly corrosive reaction medium and dif ficult product separation owing to the use of ethyl iodide as promoter. There has been little success in finding heterogeneous or homogeneous catalyst that can operate effectively without a halide promoter[5].

  14. Ni-Zn/C催化剂上乙醇气相羰基化动力学研究%Kinetics of Vapor-Phase Carbonylation of Ethanol on Ni-Zn/C Catalyst

    Institute of Scientific and Technical Information of China (English)

    彭峰

    2002-01-01

    A novel heterogeneous Ni-Zn/C catalyst was used for vapor-phase carbonylation of ethanol under atmospheric pressure. Experiments were designed with the elimination of mass-transfer resistances. The data of primary reactions in the carbonylation were collected with a differential tubular reactor. Power law rate models were employed to express the conversion of ethanol and the yields of ethyl propionate and diethyl ether. The results obtained with the models were in agreement with the experimental data.

  15. Heterogeneous Catalysts

    NARCIS (Netherlands)

    Dakka, J.; Sheldon, R.A.; Sanderson, W.A.

    1997-01-01

    Abstract of GB 2309655 (A) Heterogeneous catalysts comprising one or more metal compounds selected from the group consisting of tin, molybdenum, tungsten, zirconium and selenium compounds deposited on the surface of a silicalite are provided. Preferably Sn(IV) and/or Mo(VI) are employed. The cat

  16. Autothermal reforming catalyst having perovskite structure

    Science.gov (United States)

    Krumpel, Michael; Liu, Di-Jia

    2009-03-24

    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.

  17. Mechanistic Study of the Gas-Phase In-Source Hofmann Elimination of Doubly Quaternized Cinchona-Alkaloid Based Phase-Transfer Catalysts by (+)-Electrospray Ionization/Tandem Mass Spectrometry

    Science.gov (United States)

    Yang, Rong-Sheng; Sheng, Huaming; Lexa, Katrina W.; Sherer, Edward C.; Zhang, Li-Kang; Xiang, Bangping; Helmy, Roy; Mao, Bing

    2017-01-01

    An unusual in-source fragmentation pattern observed for 14 doubly quaternized cinchona alkaloid-based phase-transfer catalysts (PTC) was studied using (+)-ESI high resolution mass spectrometry. Loss of the substituted benzyl cation (R1 or R2) was found to be the major product ion [M2+ - R1 + or R2 +]+ in MS spectra of all PTC compounds. A Hofmann elimination product ion [M - H]+ was also observed. Only a small amount of the doubly charged M2+ ions were observed in the MS spectra, likely due to strong Columbic repulsion between the two quaternary ammonium cations in the gas phase. The positive voltage in the MS inlet but not the ESI probe was found to induce this extensive fragmentation for all PTC diboromo-salts. Compound 1 was used as an example to illustrate the proposed in-source fragmentation mechanism. The mechanism of formation of the Hofmann elimination product ion [M - H]+ was further investigated using HRMS/MS, H/D exchange, and DFT calculations. The proposed formation of 2b as the major Hofmann elimination product ion was supported both by HRMS/MS and DFT calculations. Formation of product ion 2b through a concerted unimolecular Ei elimination pathway is proposed rather than a bimolecular E2 elimination pathway for common solution Hofmann eliminations.

  18. Effects of pH and chelating agent on the NiWS phase formation in NiW/γ-Al{sub 2}O{sub 3} HDS catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Santolalla-Vargas, C.E.; Suárez Toriello, V.A. [Universidad A. Metropolitana-Iztapalapa, Área de Ingeniería Química, Av. FFCC R, Atlixco 186, Vicentina, 09340 Distrito Federal (Mexico); Reyes, J.A. dos, E-mail: jarh@xanum.uam.mx [Universidad A. Metropolitana-Iztapalapa, Área de Ingeniería Química, Av. FFCC R, Atlixco 186, Vicentina, 09340 Distrito Federal (Mexico); Cromwell, D.K. [University of New Hampshire, Department of Chemical Engineering, 207 Thompson Hall, Durham, NH 03824 (United States); Pawelec, B.; Fierro, J.L.G. [Instituto de Catálisis y Petroleoquímica, CSIC, Cantoblanco, E-28049, Madrid (Spain)

    2015-09-15

    In this article, NiW/γ-Al{sub 2}O{sub 3} samples were prepared by consecutive impregnations of a W/γ-Al{sub 2}O{sub 3}-based catalyst with aqueous solution of nickel salt. The structural control of the nickel ion precursor in the impregnation solution was achieved by the addition of 1,2-cyclohexanediamine-N,N,N′,N′-tetraacetic acid (CyDTA) as a chelating agent. The influence of pH of this aqueous solution on the NiWS phase formation in the sulfided catalysts was investigated. Coordination structures of the Ni–CyDTA complexes were evaluated by FT-IR and DRS UV–Vis spectroscopies. Sulfided catalysts were characterized by X-ray photoelectron spectroscopy (XPS) and high resolution transmission electron microscopy (HRTEM) and tested in hydrodesulfurization (HDS) of 4,6-dimethyldibenzothiophene (4,6-DMDBT) carried out in a batch reactor at 593 K and total H{sub 2} pressure of 55 bar. Spectroscopic characterization by DRS UV–Vis showed the predominance of the [Ni(CyDTA)]{sup 2−} species in solution. Following the impregnation and drying steps, the [Ni(CyDTA)]{sup 2−} complex showed no apparent changes of its structure, independent of the pH value of impregnation solution. The Ni/W/γ-Al{sub 2}O{sub 3} catalysts ex [Ni(CyDTA)]{sup 2−} complex exhibited high stability. The presence of CyDTA delayed the reduction of Ni and caused a remarkable decrease of the W-support interaction, thus increasing the formation of NiWS phase upon catalyst sulfiding. The catalyst activity–structure correlation demonstrated that the catalyst activity and selectivity is linked with formation of the most active NiWS phase having single or double WS{sub 2} slab structures. The catalyst prepared with [Ni(CyDTA)]{sup 2−} complex at pH of 4.0 exhibited the largest initial HDS activity, which was approximately triple compared with the CyDTA-free counterpart. For all catalysts, the HDS reaction proceeded via hydrogenation (HYD) and direct desulfurization (DDS) reaction routes

  19. 甘油气相脱水制备丙烯醛催化剂的研究进展%Progresses in catalysts for gas phase dehydration of glycerol to acrolein

    Institute of Scientific and Technical Information of China (English)

    黄亮; 徐华龙; 沈伟

    2016-01-01

    The catalytic dehydration of glycerol to acrolein is an important biomass conversion reaction for the sustainable production of acrolein from bio-based glycerol. This paper summarized the research progresses in catalysts for the gas phase dehydration of glycerol to acrolein. These catalysts were divided into three families,namely molecular sieves,metal oxides and mixed metal oxides, and heteropolyacids and phosphates. In addition, current main problems and challenges in the catalyst design were also discussed. The trend of development for high efficient catalysts was forecasted.%以生物质源甘油为原料,通过甘油催化脱水制备丙烯醛是一个非常重要的生物质转化反应。综述了近年来有关甘油气相脱水制备丙烯醛催化剂的研究进展,将催化剂分为分子筛、金属氧化物和复合金属氧化物、杂多酸和磷酸盐3大类进行介绍,指出了在该反应催化剂设计方面面临的问题和挑战,展望了未来的发展趋势。

  20. Oxidation catalysts on alkaline earth supports

    Science.gov (United States)

    Mohajeri, Nahid

    2017-03-21

    An oxidation catalyst includes a support including particles of an alkaline earth salt, and first particles including a palladium compound on the support. The oxidation catalyst can also include precious metal group (PMG) metal particles in addition to the first particles intermixed together on the support. A gas permeable polymer that provides a continuous phase can completely encapsulate the particles and the support. The oxidation catalyst may be used as a gas sensor, where the first particles are chemochromic particles.

  1. Oxidation catalysts on alkaline earth supports

    Energy Technology Data Exchange (ETDEWEB)

    Mohajeri, Nahid

    2017-03-21

    An oxidation catalyst includes a support including particles of an alkaline earth salt, and first particles including a palladium compound on the support. The oxidation catalyst can also include precious metal group (PMG) metal particles in addition to the first particles intermixed together on the support. A gas permeable polymer that provides a continuous phase can completely encapsulate the particles and the support. The oxidation catalyst may be used as a gas sensor, where the first particles are chemochromic particles.

  2. SiO2-Diphenic acid: An efficient and recyclable heterogeneous catalyst for one-pot synthesis of bis-(indolyl)methane derivatives in liquid phase

    Indian Academy of Sciences (India)

    R Vaid; M Gupta; O S Chambyal; R Gupta

    2015-06-01

    An eco-friendly and expedient procedure for one-pot synthesis of is-(indolyl)methane derivatives via electrophilic substitution reaction at C-3 position of indole with various aldehydes has been developed by using silica-diphenic acid as a novel heterogeneous catalyst. This method has various promising features such as short reaction time, easy work-up procedure, good yield of products and remarkable activity and selectivity of the catalyst.

  3. Ultrathin 1T-phase MoS2 nanosheets decorated hollow carbon microspheres as highly efficient catalysts for solar energy harvesting and storage

    KAUST Repository

    Hsiao, Min-Chien

    2017-02-08

    The composite of MoS2 and hollow carbon sphere (MoS2@HCS) is prepared via a glucose-assisted one pot synthesis. The composite consists of hierarchical spheres with a diameter of 0.5–4 μm and these hollow spheres are decorated with a number of curled and interlaced MoS2 nanosheets. After the composite is subject to the lithium intercalation, the MoS2 is converted from 2H to 1T phase. In this current work, the activities of 1T-MoS2@HCS toward photocatalytic hydrogen evolution and the reduction of I3− in dye-sensitized solar cells (DSCs) are systemically investigated. When evaluated as the photocatalyst for hydrogen evolution, the amount of evolved hydrogen over 1T-MoS2@HCS can reach 143 μmol in 2 h, being 3.6 times higher than as-synthesized 2H-MoS2@HCS. Additionally, the 1T-MoS2@HCS can be employed as the counter electrode (CE) material in DSCs. The DSCs based on 1T-MoS2@HCS CE possesses the power conversion efficiency of 8.94%, being higher than that with 2H-MoS2@HCS CE (8.16%) and comparable to that with Pt CE (8.87%). Our study demonstrates that 1T-MoS2@HCS has a great potential as an inexpensive alternative to Pt catalysts.

  4. Slurry phase Fischer-Tropsch synthesis: Cobalt plus a water-gas shift catalyst. [Quarterly] report, July 1, 1990--September 30, 1990

    Energy Technology Data Exchange (ETDEWEB)

    Chanenchuk, C.A.; Yates, I.C.; Satterfield, C.N.

    1990-12-31

    A Co/MgO/SiO{sub 2} Fischer-Tropsch catalyst was operated simultaneously with a Cu/ZnO/Al{sub 2}O{sub 3} water-gas-shift catalyst in a slurry reactor for over 400 hours. The process conditions were held constant at a temperature of 240{degrees}C, a pressure of 0.79 MPa, and a 1.1 H{sub 2}/CO feed of 0.065 Nl/min-g.cat. The Fischer-Tropsch activity remained constant at the level predicted by the operation of the Co/MgO/SiO{sub 2} catalyst alone. The water-gas-shift reaction was near equilibrium. The hydrocarbon product distribution of the combined catalyst system was stable and matched that of the CO/MgO/SiO{sub 2} operating alone under similar conditions. The combined catalyst system exhibited a high selectivity to n-alkanes. Neither catalysts`s operation appeared to have a detrimental effect on that of the other, showing promise for future option.

  5. Phase identification of quasi-periodic flow measured by particle image velocimetry with a low sampling rate

    Science.gov (United States)

    Pan, Chong; Wang, Hongping; Wang, Jinjun

    2013-05-01

    This work mainly deals with the proper orthogonal decomposition (POD) time coefficient method used for extracting phase information from quasi-periodic flow. The mathematical equivalence between this method and the traditional cross-correlation method is firstly proved. A two-dimensional circular cylinder wake flow measured by time-resolved particle image velocimetry within a range of Reynolds numbers is then used to evaluate the reliability of this method. The effect of both the sampling rate and Reynolds number on the identification accuracy is finally discussed. It is found that the POD time coefficient method provides a convenient alternative for phase identification, whose feasibility in low-sampling-rate measurement has additional advantages for experimentalists.

  6. High level waste storage tank farms/242-A evaporator standards/requirements identification document phase 1 assessment report

    Energy Technology Data Exchange (ETDEWEB)

    Biebesheimer, E., Westinghouse Hanford Co.

    1996-09-30

    This document, the Standards/Requirements Identification Document (S/RID) Phase I Assessment Report for the subject facility, represents the results of an Administrative Assessment to determine whether S/RID requirements are fully addressed by existing policies, plans or procedures. It contains; compliance status, remedial actions, and an implementing manuals report linking S/RID elements to requirement source to implementing manual and section.

  7. Phase identification and internal stress analysis of steamside oxides on superheater tubes by means of X-ray diffraction

    DEFF Research Database (Denmark)

    Pantleon, Karen; Montgomery, Melanie

    Steamside oxides formed on plant exposed superheated tubes were investigated using X-ray diffraction. Phase identification and stress analysis revealed that on ferritic X20CrMoV12-1 pure Hematite and pure Magnetite formed and both phases are under tensile stress. IN contrast, on austenitic TP347H...... Mn-, Cr- and/or Ni-containing oxides are observed, instead of pure Magnetite, underneath a pure Hematite surface layer. Oxides on the austenitic steel are under compressive stress or even stress-free....

  8. Bio-solid-phase extraction/tandem mass spectrometry for identification of bioactive compounds in mixtures.

    Science.gov (United States)

    Forsberg, Erica M; Brennan, John D

    2014-08-19

    We describe a two-step column-based bioassay method with tandem mass spectrometric detection for rapid identification of bioactive species in mixtures. The first step uses an immobilized enzyme reactor (IMER) column interfaced to an electrospray ionization mass spectrometer (ESI-MS) to identify mixtures containing bioactive compounds (i.e., enzyme inhibitors), while the second step uses bioselective solid-phase extraction (bioSPE) columns to isolate compounds from "hit" mixtures, which are then identified online by data-dependent ESI-MS. IMER columns were prepared by entrapment of adenosine deaminase (ADA) into sol-gel derived monolithic silica columns, and used to perform a primary IMER screen of mixtures prepared from a bioactive library, which resulted in four apparent hit compounds. Such columns did not provide sufficient binding site density to allow bioSPE, and thus a new column format was developed using ADA that was covalently immobilized to monolithic silica capillary columns, providing ∼500-fold more protein binding sites than were present in columns containing entrapped proteins. Using the covalently linked ADA columns, bioactive mixtures identified by IMER were infused until a maximum total ion current was achieved, followed by washing with a buffer to remove unbound compounds. A harsh wash with 3% acetic acid eluted the strongly bound ligands and the resulting peak triggered data dependent MS/MS to identify the ligand, showing that two of the apparent hits were true ADA inhibitors and demonstrating the ability of this method to rapidly identify bioactive compounds in mixtures.

  9. Fuel spill identification using solid-phase extraction and solid-phase microextraction. 1. Aviation turbine fuels.

    Science.gov (United States)

    Lavine, B K; Brzozowski, D M; Ritter, J; Moores, A J; Mayfield, H T

    2001-12-01

    The water-soluble fraction of aviation jet fuels is examined using solid-phase extraction and solid-phase microextraction. Gas chromatographic profiles of solid-phase extracts and solid-phase microextracts of the water-soluble fraction of kerosene- and nonkerosene-based jet fuels reveal that each jet fuel possesses a unique profile. Pattern recognition analysis reveals fingerprint patterns within the data characteristic of fuel type. By using a novel genetic algorithm (GA) that emulates human pattern recognition through machine learning, it is possible to identify features characteristic of the chromatographic profile of each fuel class. The pattern recognition GA identifies a set of features that optimize the separation of the fuel classes in a plot of the two largest principal components of the data. Because principal components maximize variance, the bulk of the information encoded by the selected features is primarily about the differences between the fuel classes.

  10. Phase composition and catalytic performance of Mo/VPO catalysts with different P/V molar ratios%不同P与V比的Mo/VPO催化剂物相组成及其催化性能

    Institute of Scientific and Technical Information of China (English)

    曾炜; 顾龙勤; 徐俊峰; 陈亮

    2014-01-01

    A series of Mo doped VOHPO4·0.5H2O precursors with different P/ V molar ratios was prepared by organic method. Mo / VPO catalysts were obtained by calcining the precursors and then activating in the mixed gas atmosphere 50% air-40% N2-10% steam( volume fraction). The catalytic performance of the catalysts for the oxidation of n-butane to maleic anhydride was investigated in a fixed bed reactor. The results showed that the activity of Mo / VPO catalyst was weakened with the increase of P/ V molar ratios, and the selectivity to maleic anhydride had no linear relationship with P/ V molar ratios. Mo / VPO catalyst with P/ V molar ratio 0. 9 exhibited the best catalytic performance. The results of XRD characterization indicated that the main active phases of Mo / VPO catalyst for the oxidation of n-butane to maleic anhydride were(VO)2 P2 O7 and V/ P mica phases,the formation of which were depended on the calcina-tion conditions. A small amount of V2 O5 in Mo/ VPO catalyst with low P/ V molar ratio was benefitial to the enhancement of catalyst activity and the selectivity to maleic anhydride. Excess V2 O5 ,however,lowered the selectivity to maleic anhydride because of deep oxidation. V/ P mica phase existed in the catalyst had a great effect on shortening activation time and improving the selectivity to maleic anhydride according to the activation tests.%采用有机相法制备了不同 P 与 V 物质的量比的 Mo 掺杂 VOHPO4·0.5H2 O 前驱体,并通过体积分数为50%空气-40%氮气-10%水蒸汽混合气氛活化得到 Mo / VPO 催化剂,采用固定床反应器评价其催化正丁烷氧化制顺酐的性能。结果表明,Mo / VPO 催化剂催化活性随 P 与 V 物质的量比的增大而降低,但顺酐选择性与 P 与 V 物质的量比并不呈线性关系,P 与 V 物质的量比为0.9的 Mo / VPO 催化剂具有最佳的催化性能。XRD 分析表明,Mo / VPO 催化剂催化正丁烷氧化制顺酐的主要活性物相为(VO)2 P

  11. Catalyst Architecture

    DEFF Research Database (Denmark)

    Kiib, Hans; Marling, Gitte; Hansen, Peter Mandal

    2014-01-01

    of programs, have a role in mediating positive social and/or cultural development. In this sense, we talk about architecture as a catalyst for: sustainable adaptation of the city’s infrastructure appropriate renovation of dilapidated urban districts strengthening of social cohesiveness in the city development...... meaningful for everyone. The exhibited works are designed by SANAA, Diller Scofidio + Renfro, James Corner Field Operation, JBMC Arquitetura e Urbanismo, Atelier Bow-Wow, Ateliers Jean Nouvel, COBE, Transform, BIG, Topotek1, Superflex, and by visual artist Jane Maria Petersen....

  12. Context based mixture model for cell phase identification in automated fluorescence microscopy

    Directory of Open Access Journals (Sweden)

    Zhou Xiaobo

    2007-01-01

    Full Text Available Abstract Background Automated identification of cell cycle phases of individual live cells in a large population captured via automated fluorescence microscopy technique is important for cancer drug discovery and cell cycle studies. Time-lapse fluorescence microscopy images provide an important method to study the cell cycle process under different conditions of perturbation. Existing methods are limited in dealing with such time-lapse data sets while manual analysis is not feasible. This paper presents statistical data analysis and statistical pattern recognition to perform this task. Results The data is generated from Hela H2B GFP cells imaged during a 2-day period with images acquired 15 minutes apart using an automated time-lapse fluorescence microscopy. The patterns are described with four kinds of features, including twelve general features, Haralick texture features, Zernike moment features, and wavelet features. To generate a new set of features with more discriminate power, the commonly used feature reduction techniques are used, which include Principle Component Analysis (PCA, Linear Discriminant Analysis (LDA, Maximum Margin Criterion (MMC, Stepwise Discriminate Analysis based Feature Selection (SDAFS, and Genetic Algorithm based Feature Selection (GAFS. Then, we propose a Context Based Mixture Model (CBMM for dealing with the time-series cell sequence information and compare it to other traditional classifiers: Support Vector Machine (SVM, Neural Network (NN, and K-Nearest Neighbor (KNN. Being a standard practice in machine learning, we systematically compare the performance of a number of common feature reduction techniques and classifiers to select an optimal combination of a feature reduction technique and a classifier. A cellular database containing 100 manually labelled subsequence is built for evaluating the performance of the classifiers. The generalization error is estimated using the cross validation technique. The

  13. Automated Identification of the Heart Wall Throughout the Entire Cardiac Cycle Using Optimal Cardiac Phase for Extracted Features

    Science.gov (United States)

    Takahashi, Hiroki; Hasegawa, Hideyuki; Kanai, Hiroshi

    2011-07-01

    In most methods for evaluation of cardiac function based on echocardiography, the heart wall is currently identified manually by an operator. However, this task is very time-consuming and suffers from inter- and intraobserver variability. The present paper proposes a method that uses multiple features of ultrasonic echo signals for automated identification of the heart wall region throughout an entire cardiac cycle. In addition, the optimal cardiac phase to select a frame of interest, i.e., the frame for the initiation of tracking, was determined. The heart wall region at the frame of interest in this cardiac phase was identified by the expectation-maximization (EM) algorithm, and heart wall regions in the following frames were identified by tracking each point classified in the initial frame as the heart wall region using the phased tracking method. The results for two subjects indicate the feasibility of the proposed method in the longitudinal axis view of the heart.

  14. ViriChip: a solid phase assay for detection and identification of viruses by atomic force microscopy

    Science.gov (United States)

    Nettikadan, Saju R.; Johnson, James C.; Vengasandra, Srikanth G.; Muys, James; Henderson, Eric

    2004-03-01

    Bionanotechnology can be viewed as the integration of tools and concepts in nanotechnology with the attributes of biomolecules. We report here on an atomic force microscopy-immunosensor assay (AFMIA) that couples AFM with solid phase affinity capture of biological entities for the rapid detection and identification of group B coxsackievirus particles. Virus identification is based on type-specific immunocapture and the morphological properties of the captured viruses as obtained by the AFM. Representatives of the six group B coxsackieviruses have been specifically captured from 1 µl volumes of clarified cell lysates, body fluids and environmental samples. Concentration and kinetic profiles for capture indicate that detection is possible at 103 TCID50 µl-1 and the dynamic range of the assay spans three logs. The results demonstrate that the melding of a nanotechnological tool (AFM) with biotechnology (solid phase immunocapture of virus particles) can create a clinically relevant platform, useful for the detection and identification of enterovirus particles in a variety of samples.

  15. Identification and quantification of Sn-based species in trimetallic Pt-Sn-In/Al2O3-Cl naphtha-reforming catalysts

    Science.gov (United States)

    Jumas, Jean-Claude; Sougrati, Moulay Tahar; Olivier-Fourcade, Josette; Jahel, Ali; Avenier, Priscilla; Lacombe, Sylvie

    2013-04-01

    Trimetallic Pt/Al2O3SnIn-Cl naphtha-reforming catalysts were prepared via co-precipitation route. Platinum and chlorine were introduced by the incipient wetness technique on the alumina support already doped with about 0.3 %wt of Sn to obtain about 0.3 %wt of Pt and 1.5 %wt of Cl. For the same Pt, Sn and Cl composition, indium loading ranged from 0.06 to 0.6 wt.%. The obtained catalysts were investigated by 119Sn Mössbauer spectroscopy between 95 and 300 K. Two Sn(IV), Sn(II) and Sn(0) environments have been identified and well characterized by their hyperfine parameters. The Lamb-Mössbauer factors have been determined for each environment and found to be 0.53, 0.27 and 0.31 for Sn(IV), Sn(II) and Sn(0) respectively. The addition of indium has been found to favour the formation of PtxSn alloys. 119Sn Mössbauer spectroscopy results show that addition of even small amount of In (0.06 wt.%) leads to the formation of a Pt3Sn alloy. At higher indium loadings, higher amounts of PtxSn alloys of almost equal Pt and Sn atomic concentrations were detected. The increasing formation of PtxSn alloys with higher indium loading is in good correlation with a decrease of catalyst's overall conversion and selectivity to C1 and C3-C4 paraffins and increase of isomerization selectivity.

  16. Mechanochemistry, catalysis, and catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Butyagin, P.Yu.

    1987-07-01

    The physical basis of mechanochemistry and the reasons for the initiation and acceleration of chemical reactions upon the mechanical treatment of solids have been considered. The phenomenon of mechanical catalysis has been described in the example case of the oxidation of CO on oxide surfaces, and the nature of the active sites and the laws governing the mechanically activated chemisorption of gases on cleavage and friction surfaces of solids have been examined. The possibilities of the use of the methods of mechanochemistry in processes used to prepare catalysts have been analyzed in examples of decomposition reactions of inorganic compounds and solid-phase synthesis.

  17. Highly Durable Catalysts for Ignition of Advanced Monopropellants Project

    Data.gov (United States)

    National Aeronautics and Space Administration — This proposed SBIR Phase I addresses the development of catalysts and technology for the ignition of advanced monopropellants consisting of mixtures of...

  18. Molecular metal catalysts on supports: organometallic chemistry meets surface science.

    Science.gov (United States)

    Serna, Pedro; Gates, Bruce C

    2014-08-19

    -support bonding and structure, which identify the supports as ligands with electron-donor properties that influence reactivity and catalysis. Each of the catalyst design variables has been varied independently, illustrated by mononuclear and tetranuclear iridium on zeolite HY and on MgO and by isostructural rhodium and iridium (diethylene or dicarbonyl) complexes on these supports. The data provide examples resolving the roles of the catalyst design variables and place the catalysis science on a firm foundation of organometallic chemistry linked with surface science. Supported molecular catalysts offer the advantages of characterization in the absence of solvents and with surface-science methods that do not require ultrahigh vacuum. Families of supported metal complexes have been made by replacement of ligands with others from the gas phase. Spectroscopically identified catalytic reaction intermediates help to elucidate catalyst performance and guide design. The methods are illustrated for supported complexes and clusters of rhodium, iridium, osmium, and gold used to catalyze reactions of small molecules that facilitate identification of the ligands present during catalysis: alkene dimerization and hydrogenation, H-D exchange in the reaction of H2 with D2, and CO oxidation. The approach is illustrated with the discovery of a highly active and selective MgO-supported rhodium carbonyl dimer catalyst for hydrogenation of 1,3-butadiene to give butenes.

  19. Mass spectrometric evaluation of mephedrone in vivo human metabolism: identification of phase I and phase II metabolites, including a novel succinyl conjugate.

    Science.gov (United States)

    Pozo, Óscar J; Ibáñez, María; Sancho, Juan V; Lahoz-Beneytez, Julio; Farré, Magí; Papaseit, Esther; de la Torre, Rafael; Hernández, Félix

    2015-02-01

    In recent years, many new designer drugs have emerged, including the group of cathinone derivatives. One frequently occurring drug is mephedrone; although mephedrone was originally considered as a "legal high" product, it is currently banned in most Western countries. Despite the banning, abuse of the drug and seizures are continuously reported. Although the metabolism of mephedrone has been studied in rats or in vitro using human liver microsomes, to the best of our knowledge, no dedicated study with human volunteers has been performed for studying the in vivo metabolism of mephedrone in humans. Therefore, the aim of this study was to establish the actual human metabolism of mephedrone and to compare it with other models. For this purpose, urine samples of two healthy volunteers, who ingested 200 mg mephedrone orally, were taken before administration and 4 hours after substance intake. The discovery and identification of the phase I and phase II metabolites of mephedrone were based on ultra-high-performance liquid chromatography coupled to hybrid quadrupole time-of-flight mass spectrometry, operating in the so-called MS(E) mode. Six phase I metabolites and four phase II metabolites were identified, four of them not previously reported in the literature. The structure of four of the detected metabolites was confirmed by synthesis of the suggested compounds. Remarkably, a mephedrone metabolite conjugated with succinic acid has been identified and confirmed by synthesis. According to the reviewed literature, this is the first time that this type of conjugate is reported for human metabolism.

  20. TiO2负载催化剂在液相选择性加氢中的研究进展%Research Advances in Liquid-Phase Selective Hydrogenation over Titania-Supported Catalysts

    Institute of Scientific and Technical Information of China (English)

    阚愈; 王继元; 林陵; 曾崇余

    2011-01-01

    Research advances in the titania-supported monometallic and bimetallic catalysts, which exhibited high catalytic activity and selectivity in liquid-phase selective hydrogenations of the reactants containing C =C and N =O or C =O simultaneously, were summarized in this paper. Mechanisms of the selective hydrogenations and influences of the preparation factors on the catalytic properties, such as preparation methods, temperature, titania crystal phases and active components, were discussed.Some opinions on how to prepare titania-supported catalysts used in the industrial liquid-phase selective hydrogenation were proposed.%对近年来具有高活性、高选择性的TiO2负载单金属和双金属催化剂(钛载催化剂)在同时含有C=C和N=O或C=O键的不饱和化合物的液相选择性加氢中的应用进行了述评;探讨了选择性加氢的机理和催化剂制备涉及的因素(如制备方法、温度、TiO2载体晶型和活性组分等)对催化性能的影响;对如何制备工业上适用于液相选择性加氢反应的钛载催化剂提出了建议.

  1. Prediction of retention time in reversed-phase liquid chromatography as a tool for steroid identification

    Energy Technology Data Exchange (ETDEWEB)

    Randazzo, Giuseppe Marco [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Tonoli, David [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Swiss Centre for Applied Human Toxicology (SCAHT), Universities of Basel and Geneva, Basel (Switzerland); Human Protein Sciences Department, University of Geneva, Geneva (Switzerland); Hambye, Stephanie; Guillarme, Davy [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Jeanneret, Fabienne [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Swiss Centre for Applied Human Toxicology (SCAHT), Universities of Basel and Geneva, Basel (Switzerland); Human Protein Sciences Department, University of Geneva, Geneva (Switzerland); Nurisso, Alessandra [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Goracci, Laura [Department of Chemistry, Biology and Biotechnology, University of Perugia, Perugia (Italy); Boccard, Julien [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Rudaz, Serge, E-mail: serge.rudaz@unige.ch [School of Pharmaceutical Sciences, University of Geneva and University of Lausanne, Geneva (Switzerland); Swiss Centre for Applied Human Toxicology (SCAHT), Universities of Basel and Geneva, Basel (Switzerland)

    2016-04-15

    The untargeted profiling of steroids constitutes a growing research field because of their importance as biomarkers of endocrine disruption. New technologies in analytical chemistry, such as ultra high-pressure liquid chromatography coupled with mass spectrometry (MS), offer the possibility of a fast and sensitive analysis. Nevertheless, difficulties regarding steroid identification are encountered when considering isotopomeric steroids. Thus, the use of retention times is of great help for the unambiguous identification of steroids. In this context, starting from the linear solvent strength (LSS) theory, quantitative structure retention relationship (QSRR) models, based on a dataset composed of 91 endogenous steroids and VolSurf + descriptors combined with a new dedicated molecular fingerprint, were developed to predict retention times of steroid structures in any gradient mode conditions. Satisfactory performance was obtained during nested cross-validation with a predictive ability (Q{sup 2}) of 0.92. The generalisation ability of the model was further confirmed by an average error of 4.4% in external prediction. This allowed the list of candidates associated with identical monoisotopic masses to be strongly reduced, facilitating definitive steroid identification. - Highlights: • Difficulties regarding steroid identification are encountered when considering isotopomeric steroids. • Quantitative structure retention relationship (QSRR) models were developed from the linear solvent strength theory. • A dataset composed of 91 steroids and VolSurf + descriptors combined with a new dedicated molecular fingerprint, were used. • The list of candidates associated with identical monoisotopic masses was reduced, facilitating steroid identification.

  2. 催化剂制备方法对甘油液相重整制氢反应的影响%Influence of preparation methods of the catalyst on hydrogen production from aqueous-phase reforming of glycerol

    Institute of Scientific and Technical Information of China (English)

    江涛; 韩林芯; 于恺; 董朝辉; 王轲; 李涛; 曹发海

    2012-01-01

    Great attention to the shortage of energy resources and environmental problems has been paid. Seeking and utilizing renewable and sustainable green energy resources are focused on by human society. It is a technical process of ecological resource utilization to employ glycerol derived from biomass as the raw materials to generate hydrogen by aqueous-phase reforming. For this purpose, NiCoAl complex oxide catalysts were prepared by using co-precipitation and impregnation methods, and the influence of calcination temperature was also investigated. The structural properties of catalysts were characterized by XRD, TG-DTG and BET. The results showed that compared with impregnation method, NiCoAl complex oxide catalyst prepared by co-precipitation method exhibited higher activities for hydrogen production, and the optimum calcination temperature of the catalyst was 550℃.%能源紧缺和环境问题已成为全世界关注的话题,开发利用可再生的清洁能源备受关注,甘油水溶液催化重整制氢是一条资源利用生态化的工艺路线.分别采用共沉淀法和浸渍法制备了NiCoAl复合氧化物催化剂,并采用XRD、比表面积及热分析等对催化剂进行结构表征,结合甘油液相重整制氢中催化剂活性测试结果表明,共沉淀法制得的NiCoAl复合氧化物催化剂的活性较好,较适宜的焙烧温度为550℃.

  3. Easy solid-phase synthesis of pH-insensitive heterogeneous CNTs/FeS Fenton-like catalyst for the removal of antibiotics from aqueous solution.

    Science.gov (United States)

    Ma, Jie; Yang, Mingxuan; Yu, Fei; Chen, Junhong

    2015-04-15

    We report a facile solid method to synthesize efficient carbon-based Fenton-like catalyst (CNTs/FeS) using as-prepared carbon nanotubes (APCNTs), which makes full use of the iron nanoparticles in APCNTs without needless purification. Furthermore, the CNTs/FeS was characterized by transmission electron microscopy (TEM), X-ray diffraction (XRD), thermogravimetric (TG) and other analysis techniques, and then the CNTs/FeS was used as a Fenton-like catalyst for removing ciprofloxacin from aqueous solution. Response Surface Methodology (RSM) was applied to find the effect of the reaction parameter and the optimum operating condition. Results shows the catalytic reaction had better suitability than previous studies in a wide range of pH values (pH 3-8) and the Fenton-like catalyst CNTs/FeS exhibits good catalytic activity for removing of antibiotic, which be attributed to the synergistic effect of adsorption-advanced oxidation and significantly improves efficiency of advanced oxidation. More importantly, the CNTs/FeS catalyst exhibit good regeneration performance and retains a high catalytic capacity (>75%) even after four reaction cycles. The catalytic mechanism were also studied further, the removal mechanism of ciprofloxacin by a CNTs/FeS heterogeneous Fenton-like process primarily involves three removal pathways occurring simultaneously: (a) adsorption removal by CNTs, (b) Fenton-like degradation catalyzed by FeS, (c) catalytic degradation by CNTs catalyst. And these actions also have synergistic effects for ciprofloxacin removal. Copyright © 2014 Elsevier Inc. All rights reserved.

  4. Identification of sigma and OMEGA phases in AA2009/SiC composites

    Energy Technology Data Exchange (ETDEWEB)

    Rodrigo, P., E-mail: pilar.rodrigo@urjc.e [Departamento de Ciencia e Ingenieria de Materiales, Escuela Superior de Ciencias Experimentales y Tecnologia, Universidad Rey Juan Carlos, c/Tulipan s/n, 28933 Mostoles, Madrid (Spain); Poza, P.; Utrilla, M.V.; Urena, A. [Departamento de Ciencia e Ingenieria de Materiales, Escuela Superior de Ciencias Experimentales y Tecnologia, Universidad Rey Juan Carlos, c/Tulipan s/n, 28933 Mostoles, Madrid (Spain)

    2009-08-12

    The microstructure evolution during ageing treatment at 170 and 190 deg. C of AA2009/SiC composites, reinforced with 15 vol.% particulates and whiskers, was studied by transmission electron microscopy. Besides theta' and S' phases, the typical hardening precipitates on Al-Cu-Mg alloys, it was found the presence of OMEGA and sigma (Al{sub 5}Cu{sub 6}Mg{sub 2}) phases in the matrix. sigma phase was only found in the matrix of particulate composite, while OMEGA phase appeared in both. This phase has not been previously observed in Al matrix composites based on conventional Al-Cu-Mg alloys.

  5. Catalyst Architecture

    DEFF Research Database (Denmark)

    the projects as case studies, which contribute with strategic knowledge rather than generalizing from average considerations. These are ‘strategic projects’ where we have looked for the specific and the particular (Flyvbjerg 1991). According to the case studies, we use the case study method developed by Bent......’ interpretations and architectural strategies are included in the analyses. This implies that there is a large variation of empirical knowledge about the selected problems. That is the reason why we give a short introduction to the exact use of approaches and methods in the beginning of each case study. Based...... in experience? Which design qualities do the best examples of architecture as urban catalysts have, and how can we as citizens, politicians and professionals use knowledge about this in the development of our cities as good places to live? We wish to throw light on these key questions through case studies...

  6. Acoustic source identification in an enclosed space using the inverse phased beam tracing at medium frequencies

    DEFF Research Database (Denmark)

    Ih, Jeong-Guon; Jeong, Cheol-Ho

    2008-01-01

    When the source is enclosed by room surfaces, it is not easy, though not totally impossible, to apply conventional modal methods for source identification. This is because there are too many complicated wave interferences and effects of wall impedance, in particular at medium frequencies. The pha...

  7. Electrochemical catalyst recovery method

    Science.gov (United States)

    Silva, Laura J.; Bray, Lane A.

    1995-01-01

    A method of recovering catalyst material from latent catalyst material solids includes: a) combining latent catalyst material solids with a liquid acid anolyte solution and a redox material which is soluble in the acid anolyte solution to form a mixture; b) electrochemically oxidizing the redox material within the mixture into a dissolved oxidant, the oxidant having a potential for oxidation which is effectively higher than that of the latent catalyst material; c) reacting the oxidant with the latent catalyst material to oxidize the latent catalyst material into at least one oxidized catalyst species which is soluble within the mixture and to reduce the oxidant back into dissolved redox material; and d) recovering catalyst material from the oxidized catalyst species of the mixture. The invention is expected to be particularly useful in recovering spent catalyst material from petroleum hydroprocessing reaction waste products having adhered sulfides, carbon, hydrocarbons, and undesired metals, and as well as in other industrial applications.

  8. Phase Identification of Nanometric Precipitates in Al-Si-Cu Aluminum Alloy by Hr-Stem Investigations

    Directory of Open Access Journals (Sweden)

    Pawlyta M.

    2016-09-01

    Full Text Available Aluminium recycling is cost-effective and beneficial for the environment. It is expected that this trend will continue in the future, and even will steadily increase. The consequence of the use of recycled materials is variable and difficult to predict chemical composition. This causes a significant reduction in the production process, since the properties of produced alloy are determined by the microstructure and the presence of precipitates of other phases. For this reason, the type and order of formation of precipitates were systematically investigated in recent decades. These studies involved, however, only the main systems (Al-Cu, Al-Mg-Si, Al-Cu-Mg, Al-Mg-Si-Cu, while more complex systems were not analysed. Even trace amounts of additional elements can significantly affect the alloy microstructure and composition of precipitates formed. This fact is particularly important in the case of new technologies such as laser surface treatment. As a result of extremely high temperature and temperature changes after the laser remelting large amount of precipitates are observed. Precipitates are nanometric in size and have different morphology and chemical composition. A full understanding of the processes that occur during the laser remelting requires their precise but also time effectively phase identification, which due to the diversity and nanometric size, is a major research challenge. This work presents the methodology of identification of nanometer phase precipitates in the alloy AlSi9Cu, based on the simultaneous TEM imaging and chemical composition analysis using the dispersion spectroscopy using the characteristic X-ray. Verification is performed by comparing the simulation unit cell of the identified phase with the experimental high-resolution image.

  9. Slurry phase Fischer-Tropsch synthesis: Cobalt plus a water-gas shift catalyst. [Quarterly] report, October 1, 1989--December 31, 1989

    Energy Technology Data Exchange (ETDEWEB)

    Yates, I.C.; Satterfield, C.N.

    1989-12-31

    The rate of synthesis gas consumption over a cobalt FischerTropsch catalyst was measured in a well-mixed, continuous-flow, slurry reactor at 220 to 240{degrees}C, 0.5 to 1.5 MPa, H{sub 2}/CO feed ratios of 1.5 to 3.5 and conversions of 7 to 68% of hydrogen and 11 to 73% of carbon monoxide. The inhibiting effect of carbon monoxide was determined quantitatively and a Langmuir-Hinshelwood-type equation of the following form was found to best represent the results: -R{sub H{sub 2+Co}} = (a P{sub CO}P{sub H{sub 2}})/(1 + b P{sub CO}){sup 2}. The apparent activation energy was 93 to 95 kJ/mol. Data from previous studies on cobalt-based Fischer-Tropsch catalysts are also well correlated with this rate expression.

  10. Formation, phase composition, texture and catalytic properties of Co-MgO-alumino-calcium catalysts in synthesis of hydrocarbons from CO and H/sub 2/

    Energy Technology Data Exchange (ETDEWEB)

    Lapidus, A.L.; Bruk, I.A.; Mal' tsev, V.V.; Iem, K.C.; Yakerson, V.I.; Golosman, Y.Z.; Mamayeva, I.A.; Kalacheva, N.B.; Danyushevskii, V.Y.; Nissenbaum, V.D.

    1981-01-01

    A study was made of the mechanism of formation of catalysts; a special feature of this mechanism is the interaction of components (calcium aluminates and basic carbonates of cobalt and magnesium); the carrier with a developed surface and the active component distributed on this surface are formed during this process. Catalysts show maximum selectivity in synthesis of liquid hydrocarbons from CO and H/sub 2/ with a degree of reduction of the metal of 65-84% and a dispersion (according to chemisorption of CO) of 6 x 10/sup -3/ - 10 x 10/sup -3/. Maximum yield of liquid hydrocarbons (114.1 g/nm/sup 3/) was obtained in the pressure of a system of 33Co-3MgO-64 talum treated with hydrogen at 550/sup 0/C.

  11. Formation of acetic acid by aqueous-phase oxidation of ethanol with air in the presence of a heterogeneous gold catalyst

    DEFF Research Database (Denmark)

    Christensen, Claus H.; Jørgensen, Betina; Hansen, Jeppe Rass

    2006-01-01

    Wine into vinegar: It is possible to selectively oxidize ethanol into acetic acid in aqueous solution with air as the oxidant and a heterogeneous gold catalyst (see TEM image of supported gold particles) at temperatures of about 423 K and O2 pressures of 0.6 MPa. This reaction proceeds readily...... in aqueous acidic media with yields of up to 90 % and CO2 as the only major by-product....

  12. Effect of reduction temperature on Mo-based catalyst phase and its activity in hydrodeoxygenation reaction%还原温度对Mo基催化剂物相及其加氢脱氧性能的影响

    Institute of Scientific and Technical Information of China (English)

    梁俊梅; 陈宇; 丁冉冉; 孟永强; 王要武; 杨明德; 吴玉龙

    2016-01-01

    A series of Mo-based catalysts supported over CNTs were successfully prepared by controlling the reduction temperature during the catalyst synthesis. The properties of the obtained catalysts were systematically characterized by XRD,TEM,N2 adsorption,XPS and NH3/H2-TPD techniques,and the catalytic reactivity for the hydrodeoxygenation of stearic acid was evaluated. The results showed that Mo species on the surface of catalysts were reduced with the increase of reduction temperature,and the reduction process was as followed: MoO3→MoO2→Mo→Mo2C. The active phase was MoO2when reduction temperature was below 550℃. Further elevating the reduction temperature to 600℃,we found a mixed phase of MoO2/Mo/β-Mo2C existed.β-Mo2C was the main active phase when reduction temperature was over 650℃,and it exhibited higher activity of hydrodeoxygenation than the active phase of MoO2. In addition,the MoO2/Mo/β-Mo2C mixed phase catalyst at 600℃ showed the highest catalytic reactivity in hydrodeoxygenation of stearic acid due to its large specific surface area,more acid sites and stronger H2 adsorption ability.%以碳纳米管(CNTs)为载体,通过控制催化剂合成的还原温度制备了一系列负载型 Mo 基催化剂。采用XRD、TEM、N2物理吸附、XPS以及NH3/H2-TPD等技术对催化剂进行了表征,并研究了Mo基催化剂对硬脂酸催化加氢脱氧性能的影响。结果表明:随着还原温度的升高,催化剂表面的Mo物种逐渐被还原,还原过程为:MoO3→MoO2→Mo→Mo2C。还原温度为450℃和550℃时,催化剂的活性相为MoO2;还原温度为600℃时,催化剂的活性相为MoO2/Mo/β-Mo2C的混合相;还原温度为650℃和700℃时,催化剂的活性相全部转化为β-Mo2C。与活性相 MoO2催化剂相比,β-Mo2C 催化剂具有更高的加氢脱氧活性。此外,还原温度为600℃的MoO2/Mo/β-Mo2C混合相催化剂因具有较大的比表面积、较多的

  13. [MALDI-TOF mass spectrometry: Evaluation of the preanalytical phase for identification of molds].

    Science.gov (United States)

    Maldonado, Ivana; García Ramírez, Dolores; Striebeck, Pablo; Lafage, Marcelo; Fernández Canigia, Liliana

    In order to optimize the identification of molds with MALDI-TOF MS, three protein extraction-methodologies were evaluated against 44 isolates: water extraction (WE), zirconium extraction (ZE) and the provider's recommended method (PRM). Two data bases were compared, Bruker (BK) and Bruker+National Institutes of Health. Considering both databases, results were respectively as follows: correct identification (CI) at gender level, 10 and 16 by WE; 27 and 32 by ZE and 18 and 23 by PRM; CI at species level, 5 and 7 by WE; 17 and 20 by ZE and 11 and 14 by PRM; non-reliable identification, 18 and 12 by WE; 9 and 4 by ZE and by PRM. No peaks were observed in 16 by WE, 8 by ZE and 17 by PRM. ZE showed the best perfomance (p<0.05). Copyright © 2016 Asociación Argentina de Microbiología. Publicado por Elsevier España, S.L.U. All rights reserved.

  14. Current Methodologies and Implications of Phase Identification of the Vertical Jump: A Systematic Review and Meta-analysis.

    Science.gov (United States)

    Eagles, Alexander Neale; Sayers, Mark Gregory Leigh; Bousson, Matthew; Lovell, Dale Ingham

    2015-09-01

    The vertical jump (VJ) is considered a key indicator of lower limb explosive strength. Previous research has established that rate of force development and time to peak force are linked closely to athletic ability and hence the ability to extract these accurately is of significance. The objectives of this study were to (1) review the literature to ascertain what methods are currently used to extract jump phases from the force platform data and (2) compare identified methods on neutral data. In Part 1, an electronic search was conducted using PubMed, Central, and EBSCO host (January 1965 to April 2014). Articles were included if they (1) detailed how VJ phases from the force platform data were identified and (2) used only force platform data in the analysis. Additionally, study design and quality was independently examined. In Part 2, the three common methodologies identified were used to analyze a neutral pool of data to determine if any variance existed. For Part 1, a total of 19 studies met the inclusion criteria. Meta-analysis determined three methods of phase identification used in the literature from which to extract force-time variables. In Part 2, a one-way analysis of variance and Scheffe's post-hoc tests showed significant differences (p < 0.01) for force-time variables (eccentric phase time, concentric phase time, time to peak force, rate of force development) between methods. The results demonstrate that three common methods exist for determination of the VJ phases from force platform data. Consequently, each produce different values for force-time variables when used on a neutral data pool. There is a clear need for a robust agreed method for VJ analysis.

  15. Identification of the vortex glass phase by harmonics of the AC magnetic susceptibility

    OpenAIRE

    Adesso, M G; Polichetti, M.; Pace, S.

    2005-01-01

    We compared the AC magnetic susceptibility behaviour for the vortex glass phase and for the creep phenomena with an inhomogeneous pinning potential. The temperature dependence of the harmonics of the susceptibility have been numerically simulated with these two models, and we studied them as a function of the frequency, in terms of Cole-Cole plots. From our analysis we show that it is possible to distinguish between the two different phases, because of their clear differences in the Cole-Cole...

  16. HPLC WITH SOLID PHASE EXTRACTION FOR IDENTIFICATION AND DIAGNOSIS OF ORGANOPHOSPHOROUS POISONING IN GOATS

    Directory of Open Access Journals (Sweden)

    S. Manna

    2014-12-01

    Full Text Available High performance liquid chromatographic determination of organophosphorous compound has been done by reverse phase chromatography in goats. The goats were dying showing the symptoms of organophosphorous poisoning. The viscera and stomach contents sample were received from Project Co-Ordinator, Animal Disease Research Institute, Phulnakhara, Cuttack, Orissa. The analysis of samples by HPLC with UV detector after cleaning up in Solid Phase Extraction (SPE revealed presence of malathion that was later quantified.

  17. Microscopic identification of Chinese medicinal materials based on X-ray phase contrast imaging: from qualitative to quantitative

    Science.gov (United States)

    Xue, Y.; Liang, Z.; Tan, H.; Ni, L.; Zhao, Z.; Xiao, T.; Xu, H.

    2016-07-01

    Although a variety of methods, ranging from simple morphological examination to physical and chemical analysis, and DNA molecular biology, exist for authenticating Chinese medicinal materials(CMMs), no methods can achieve both the source species identification and quality evaluation of CMMs simultaneously. Furthermore, the methods that are currently available for the identification of CMMs, including both optical and electronic microscopy, usually entail strict requirements for sample preparation or testing environment, such as the slicing of super-thin sections, or processing with specific chemical reagents. These treatments not only damage the CMMs but may also cause some of the original microstructures to be missed. Additionally, they may even yield false results. Owing to the unique penetrating character of X-rays, X-ray phase contrast imaging(XPCI) can be used to realize the inner microstructures of CMMs through nondestructive imaging. With the higher flux and luminance of the third generation of synchrotron radiation facility, XPCI can provides clearer and finer microstructures of CMMs, which are mainly composed of C, H, O, and N elements, with better spatial and density resolutions. For more than ten years, the X-ray imaging group at the Shanghai Institute of Applied Physics has investigated the microstructures of CMMs by XPCI and they have established and developed a quantitative X-ray phase contrast micro-CT for investigating the characteristic microstructures of CMMs. During this period, a variety of typical CMMs have been investigated, from two-dimensional (2D) radiography to three-dimensional (3D) micro-CT, from qualitative to quantitative. Taken together, these results verify that quantitative X-ray phase contrast micro-CT is a practical tool for the microscopic investigation of CMMs. Additionally, further efforts are being made to find the relationship between the microstructures' quantitative factors and active chemical components. At present

  18. Identification of successive flowering phases highlights a new genetic control of the flowering pattern in strawberry

    Science.gov (United States)

    Perrotte, Justine; Guédon, Yann; Gaston, Amèlia; Denoyes, Béatrice

    2016-01-01

    The genetic control of the switch between seasonal and perpetual flowering has been deciphered in various perennial species. However, little is known about the genetic control of the dynamics of perpetual flowering, which changes abruptly at well-defined time instants during the growing season. Here, we characterize the perpetual flowering pattern and identify new genetic controls of this pattern in the cultivated strawberry. Twenty-one perpetual flowering strawberry genotypes were phenotyped at the macroscopic scale for their course of emergence of inflorescences and stolons during the growing season. A longitudinal analysis based on the segmentation of flowering rate profiles using multiple change-point models was conducted. The flowering pattern of perpetual flowering genotypes takes the form of three or four successive phases: an autumn-initiated flowering phase, a flowering pause, and a single stationary perpetual flowering phase or two perpetual flowering phases, the second one being more intense. The genetic control of flowering was analysed by quantitative trait locus mapping of flowering traits based on these flowering phases. We showed that the occurrence of a fourth phase of intense flowering is controlled by a newly identified locus, different from the locus FaPFRU, controlling the switch between seasonal and perpetual flowering behaviour. The role of this locus was validated by the analysis of data obtained previously during six consecutive years. PMID:27664957

  19. Application of phase stretch transform to plate license identification under blur and noise conditions (Conference Presentation)

    Science.gov (United States)

    Asghari, Hossein; Hadar, Ofer; Jalali, Bahram

    2016-09-01

    This paper deals with implementing a new algorithm for edge detection based on the Phase Stretch Transform (PST) for purposes of car plate license recognition. In PST edge detection algorithm, the image is first filtered with a spatial kernel followed by application of a nonlinear frequency-dependent phase. The output of the transform is the phase in the spatial domain. The main step is the 2-D phase function which is typically applied in the frequency domain. The amount of phase applied to the image is frequency dependent with higher amount of phase applied to higher frequency features of the image. Since sharp transitions, such as edges and corners, contain higher frequencies, PST emphasizes the edge information. Features can be further enhanced by applying thresholding and morphological operations. Here we investigate the influence of noise and blur on the ability to recognize the characters in the plate license, by comparison of our suggested algorithm with the well known Canny algorithm. We use several types of noise distributions among them, Gaussian noise, salt and paper noise and uniform distributed noise, with several levels of noise variances. The simulated blur is related to the car velocity and we applied several filters representing different velocities of the car. Another interesting degradation that we intend to investigate is the cases that Laser shield license plate cover is used to distort the image taken by the authorities. Our comparison results are presented in terms of True positive, False positive and False negative probabilities.

  20. Identification of successive flowering phases highlights a new genetic control of the flowering pattern in strawberry.

    Science.gov (United States)

    Perrotte, Justine; Guédon, Yann; Gaston, Amèlia; Denoyes, Béatrice

    2016-10-01

    The genetic control of the switch between seasonal and perpetual flowering has been deciphered in various perennial species. However, little is known about the genetic control of the dynamics of perpetual flowering, which changes abruptly at well-defined time instants during the growing season. Here, we characterize the perpetual flowering pattern and identify new genetic controls of this pattern in the cultivated strawberry. Twenty-one perpetual flowering strawberry genotypes were phenotyped at the macroscopic scale for their course of emergence of inflorescences and stolons during the growing season. A longitudinal analysis based on the segmentation of flowering rate profiles using multiple change-point models was conducted. The flowering pattern of perpetual flowering genotypes takes the form of three or four successive phases: an autumn-initiated flowering phase, a flowering pause, and a single stationary perpetual flowering phase or two perpetual flowering phases, the second one being more intense. The genetic control of flowering was analysed by quantitative trait locus mapping of flowering traits based on these flowering phases. We showed that the occurrence of a fourth phase of intense flowering is controlled by a newly identified locus, different from the locus FaPFRU, controlling the switch between seasonal and perpetual flowering behaviour. The role of this locus was validated by the analysis of data obtained previously during six consecutive years.

  1. Foundation Flash Catalyst

    CERN Document Server

    Goralski, Greg

    2010-01-01

    This book offers an introduction to Flash Catalyst for designers with intermediate to advanced skills. It discusses where Catalyst sits within the production process and how it communicates with other programs. It covers all of the features of the Flash Catalyst workspace, teaching you how to create designs from scratch, how to build application designs and add functionality, and how to master the Catalyst/Flex workflow. * Introduces Flash Catalyst * Focuses on production process * Covers the interrelation between Flash Catalyst and Photoshop/Illustrator/Flex/Flash What you'll learn Starting f

  2. 4-Amino-l,2,4-triazole Resin-supported Palladium Complex as Phosphine-free Catalyst for Suzuki Reaction in Aqueous Phase

    Institute of Scientific and Technical Information of China (English)

    WU Xiang-mei; WANG Yan; GUO Sheng-rong

    2010-01-01

    @@ 1 Introduction The Suzuki cross-coupling reaction is a powerful and versatile method for the generation of unsymme-trical biaryls from arylboronic acids and aryl halides in a single step~([1-3]).However,the reaction is usually performed in the presence of Pd catalyst along with phosphine ligand,which sometimes creates practical problems because organophosphines tend to be expensive,poisonous,and air sensitive.Recently,phosphine-free ligands,such as nitrogen or sulfur-containing ligands~([4-6]) and N-heterocyclic car-benes~([7-12]) have been applied in Suzuki reaction effectively.

  3. Identification and determination of phase II nabumetone metabolites by high-performance liquid chromatography with photodiode array and mass spectrometric detection.

    Science.gov (United States)

    Nobilis, M; Holcapek, M; Kolárová, L; Kopecký, J; Kunes, M; Svoboda, Z; Kvetina, J

    2004-03-26

    Chromatographic analyses play an important role in the identification and determination of phase I and phase II drug metabolites. While the chemical standards of phase I metabolites are usually available from commercial sources or by various synthetic, degradation or isolation methods, the phase II drug metabolites have usually more complicated structures, their standards are in general inaccessible and their identification and determination require a comprehensive analytical approach involving the use of xenobiochemical methods and the employment of hyphenated analytical techniques. In this work, various high-performance liquid chromatography (HPLC) methods were employed in the evaluation of xenobiochemical experiments leading to the identification and determination of phase II nabumetone metabolites. Optimal conditions for the quantitative enzymatic deconjugation of phase II metabolites were found for the samples of minipig bile, small intestine contents and urine. Comparative HPLC analyses of the samples of above-mentioned biomatrices and of the same biomatrices after their enzymatic treatment using beta-glucuronidase and arylsulfatase afforded the qualitative and quantitative information about phase II nabumetone metabolites. Hereby, three principal phase II nabumetone metabolites (ether glucuronides) were discovered in minipig's body fluids and their structures were confirmed using liquid chromatography (LC)-electrospray ionization mass spectrometric (MS) analyses.

  4. A Novel Family of Catalysts Comprising a Supported Metal and a Supported Aqueous-Phase Catalyst%新型复合负载金属-支撑水相催化剂

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    @@ The interface between homogeneous catalysis and heterogeneous catalysis has great scope for the development of new catalytic materials[1~4]. Supported aqueous-phase (SAP) catalysis has been employed for the hydroformylation of olefins under mild conditions with high efficiency and convenient separation from the products[5,6].

  5. Catalysts by Design: The Power of Theory

    Energy Technology Data Exchange (ETDEWEB)

    Hammes-Schiffer, Sharon

    2017-03-21

    Theoretical design of effective catalysts, in conjunction with the identification of guiding design principles and strategies, is a Holy Grail in Chemistry. Although further progress will benefit from additional computational advances, theoretical studies have already enhanced the design of molecular electrocatalysts, photocatalysts, and enzymes.

  6. TECHNOLOGY DEVELOPMENT FOR IRON FISCHER-TROPSCH CATALYSTS

    Energy Technology Data Exchange (ETDEWEB)

    Davis, B.H.

    1998-07-22

    The goal of the proposed work described in this Final Report was the development of iron-based Fischer-Tropsch catalysts that combined high activity, selectivity and life with physical robustness for slurry phase reactors that will produce either low-alpha or high-alpha products. The work described here has optimized the catalyst composition and pretreatment operation for a low-alpha catalyst. In parallel, work has been conducted to design a high-alpha iron catalyst that is suitable for slurry phase synthesis. Studies have been conducted to define the chemical phases present at various stages of the pretreatment and synthesis stages and to define the course of these changes. The oxidation/reduction cycles that are anticipated to occur in large, commercial reactors have been studied at the laboratory scale. Catalyst performance has been determined for catalysts synthesized in this program for activity, selectivity and aging characteristics.

  7. Microstructural and Morphological Properties of Nanocrystalline Cu2ZnSnSe4 Thin Films: Identification New Phase on Structure

    Science.gov (United States)

    Quiroz, Heiddy P.; Seña, N. J.; Dussan, A.

    2014-04-01

    This paper presents a study of the structural and morphological properties of thin films of compound Cu2ZnSnSe4. Mass (MX) and temperature of the substrate (TS(Cu)) of compound copper (Cu), were varied. All samples were deposited by co-evaporation method in three stages. From measurements of X-ray diffraction it was possible to establish with TS increasing the presence of associated binary phases quaternary compound during the growth process of the material. It was found that the main peak around, 2θ= 27.1°, predominate binary phases Cu1.8Se and ZnSe. Measurements of X-ray diffraction were performed to pure binary compounds, showing a peak corresponding to the main peak found around the compound. Raman shifts showed associated binary compounds with the observed by XRD. In this work, we report for the first time the binary phase identification Cu1.8Se and ZnSe as part of the structure of the stannite CZTSe. Since the Scherrer equation was found that the crystallite sizes ranged between 30 and 40 nm. A correlation between structure and topography superficial is presented.

  8. Latent catalyst; Senzaisei shokubai

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2000-03-01

    Epoxy resin, an important function material to support such main industries as electric and electronic devices, automobiles, civil engineering, and building construction, is demanded of development of single liquid type resin having excellent quick hardening performance and storage stability. This requirement comes from environmental problems with an intention of saving energies and reducing resin wastes. The Company, using freely its independent phase separation technology that controls molecular structure of catalysts, developed a latent catalyst having excellent storage stability and high-temperature quick hardening performance. Its major features may be summarized as follows: (1) excellent storage stability at room temperature keeping the product stable for 2.5 months or longer (2 days in conventional products); (2) quick hardening performance hardening the resin in seven seconds at 150 degrees C (equivalent to conventional products); and (3) excellent insulation performance of hardened resin at 140 degrees C of 7 times 10 {sup 13} (ohm) (center dot) cm (2 times 10 {sup 12} (ohm) (center dot) cm in conventional products) (translated by NEDO)

  9. Superconductivity in the high-Tc Bi-Ca-Sr-Cu-O system - Phase identification

    Science.gov (United States)

    Hazen, R. M.; Prewitt, C. T.; Angel, R. J.; Ross, N. L.; Finger, L. W.

    1988-01-01

    Four phases are observed in superconducting Bi-Ca-Sr-Cu-O samples. The superconducting phase, with onset temperature near 120 K, is a 15.4-A-layered compound with composition near Bi2Ca1Sr2Cu2O9 and an A-centered orthorhombic unit subcell 5.41 x 5.44 x 30.78 A. X-ray diffraction and electron microscopy data are consistent with a structure of alternating perovskite and Bi2O2 layers. High-resolution transmission electron microscopy images reveal a b-axis superstructure of 27.2 A, numerous (001) stacking faults, and other defects.

  10. Dehalogenation of Aryl Halides Catalyzed by Montmorillonite Immobilized Bimetal Catalyst in Aqueous System

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    A novel bisupported bimetal catalyst PVP-PdCl2-FeSO4/Al-Mont-PEG600 was prepared by immobilization of PVP (poly (N-vinyl-2-pyrrolidone)) supported bimetallic catalyst using alumina pillared inartificial montmorillonite as the carrier. This catalyst has good dehalogenation activity and selectivity to aryl halides-o-chlorotoluene in aqueous system in the presence of phase transfer catalyst (PEG) and sodium formate as hydrogen source. The catalyst also shows good reusability.

  11. Influence of Preparation Condition on the PdHx Phase of Pd/C Catalyst%制备条件对Pd/C催化剂活性相PdHx的影响

    Institute of Scientific and Technical Information of China (English)

    郇昌永; 马磊; 季来军; 郑遗凡; 李小年

    2013-01-01

    PdHx phase is an important reactive species in the Pd/C catalyst. The Pd/C catalyst with high content of PdHx phase was controllably prepared by the impregnation-hydrazine hydrate reduction method, and the influences of reduction methods, reduction conditions and the pretreatment conditions of the activated carbon on the PdHx content were investigated by XRD, XPS and TEM. By using the amination of 2,6-dimethyl phenol in the absence of hydrogen as a probe reaction, the relationship between PdHx content and catalytic activity was also studied. The results show that the Pd/C catalyst with high amount of PdHx can be obtained by using activated carbon support pretreated with 2.5%(wt) HNO3 and reducing the catalyst with hydrazine hydrate as reductor at 40℃. And over this catalyst the conversion of 2,6-dimethylphenol and the selectivity for 2,6-dimethylaniline are as high as 59.8%and 87.3%, respectively. It shows that the PdHx is the reactive phase of amiation reaction and its content is closely related to the concentration of HNO3 in the pretreatment process.%PdHx相是Pd/C催化剂中一种重要的活性物种。研究以浸渍-水合肼还原法制备出PdHx含量较高的Pd/C催化剂,通过XRD、XPS和TEM等表征方法研究了还原方式和条件及载体活性炭的预处理条件对催化剂中PdHx含量的影响,以无氢条件下的2,6-二甲基苯酚胺化法合成2,6-二甲基苯胺作为探针反应,验证了PdHx含量与催化活性的相关性。结果表明:以2.5%(wt)硝酸预处理的活性炭为载体,水合肼为还原剂,在40℃还原制得的催化剂具有较高的PdHx含量,以其为催化剂时原料的转化率和产品的选择性分别高达59.8%和87.3%。说明PdHx是该反应的活性相,其含量与载体预处理时的硝酸浓度密切相关。

  12. Oxide catalysts for oxidation of xylene

    Directory of Open Access Journals (Sweden)

    Kusman Dossumov

    2013-09-01

    Full Text Available Polioxide granulated catalysts based on transition and rare earth metals for oxidative conversion of xylene by oxygen have been investigated. It was defined the effect of the composition and concentration of the active phase of oxide catalysts: Cu-Mn-Ln; Cu-Mn-Ce and Cu-Mn-Nd on the o-xylene oxidation. It was found that the Cu-Mn-Ce catalyst has the highest activity at the concentrations of metals: copper – 3.0%; manganese – 3.0%; cerium – 1.0%.

  13. A versatile elevated-pressure reactor combined with an ultrahigh vacuum surface setup for efficient testing of model and powder catalysts under clean gas-phase conditions

    Energy Technology Data Exchange (ETDEWEB)

    Morfin, Franck; Piccolo, Laurent [Institut de recherches sur la catalyse et l' environnement de Lyon (IRCELYON), UMR 5256 CNRS and Université Lyon 1, 2 avenue Albert Einstein, F-69626 Villeurbanne (France)

    2013-09-15

    A small-volume reaction cell for catalytic or photocatalytic testing of solid materials at pressures up to 1000 Torr has been coupled to a surface-science setup used for standard sample preparation and characterization under ultrahigh vacuum (UHV). The reactor and sample holder designs allow easy sample transfer from/to the UHV chamber, and investigation of both planar and small amounts of powder catalysts under the same conditions. The sample is heated with an infrared laser beam and its temperature is measured with a compact pyrometer. Combined in a regulation loop, this system ensures fast and accurate temperature control as well as clean heating. The reaction products are automatically sampled and analyzed by mass spectrometry and/or gas chromatography (GC). Unlike previous systems, our GC apparatus does not use a recirculation loop and allows working in clean conditions at pressures as low as 1 Torr while detecting partial pressures smaller than 10{sup −4} Torr. The efficiency and versatility of the reactor are demonstrated in the study of two catalytic systems: butadiene hydrogenation on Pd(100) and CO oxidation over an AuRh/TiO{sub 2} powder catalyst.

  14. Preparation and activity evaluation of NiMoB/γ-Al2O3 catalyst by liquid-phase furfural hydrogenation

    Institute of Scientific and Technical Information of China (English)

    Shuqin Wei; Hongyou Cui; Jinghua Wang; Shuping Zhuo; Weiming Yi; Lihong Wang; Zhihe Li

    2011-01-01

    Amorphous MoNiB/γ-Al2O3 alloy catalysts were prepared by reducing NiCl2-6H2O and genation of furfural (FFR) as a probe reaction,the activity of MoNiB/γ-Al2O3 was examined. Compared to NiB and NiMoB,NiMoB/γ-Al2O3 exhibited excellent activity and selectivity towards furfuryl alcohol (FFA). After reaction for 3.0 h at 80 °C and 5.0 MPa in methanol,FFR conversion reached 99% with FFA yield of 91%. The effects of doping amount of Mo and calcination temperature before NaBH4 reduction on hydrogenation activity were also investigated. The optimum Mo/Ni atom ratio and calcination temperature were found to be 1:7 and 300 C,respectively. XRD patterns and SEM images indicated that NiMoB over the surface of γ-Al2O3 was amorphous and highly dispersed,which was responsible for the high thermal stability of the title catalyst.

  15. A Latent Consolidation Phase in Auditory Identification Learning: Time in the Awake State Is Sufficient

    Science.gov (United States)

    Roth, Daphne Ari-Even; Kishon-Rabin, Liat; Hildesheimer, Minka; Karni, Avi

    2005-01-01

    Large gains in performance, evolving hours after practice has terminated, were reported in a number of visual and some motor learning tasks, as well as recently in an auditory nonverbal discrimination task. It was proposed that these gains reflect a latent phase of experience-triggered memory consolidation in human skill learning. It is not clear,…

  16. Identification of Acute Phase Proteins and Assays Applicable in Nondomesticated Mammals

    DEFF Research Database (Denmark)

    Bertelsen, M. F.; Kjelgaard-Hansen, M.; Grøndahl, C.

    2009-01-01

    The serum concentration of acute phase proteins (APPs) increases dramatically in response to inflammation and tissue injury. APPs are clinically useful in a range of domesticated mammals; however, knowledge is limited in nondomesticated mammals. The detective ability of two assays for each of thr...

  17. Identification of Children at Risk of Dyslexia: The Validity of Teacher Judgements Using "Phonic Phases"

    Science.gov (United States)

    Snowling, Margaret J.; Duff, Fiona; Petrou, Alex; Schiffeldrin, Josie; Bailey, Alison M.

    2011-01-01

    We report an investigation of the validity of teachers' ratings of children's progress in "phonics" as a screener for dyslexia. Seventy-three 6-year-olds from a whole school population were identified as "at risk" of dyslexia according to teacher judgements of slow progression through phonic phases. Six months later, children's attainments in…

  18. Phase identification of iron nitrides and iron oxy-nitrides with Mossbauer spectroscopy

    NARCIS (Netherlands)

    Borsa, DM; Boerma, DO

    2003-01-01

    The Mossbauer spectroscopy of all known Fe nitrides is the topic of this paper. Most of the data were accumulated during a study of the growth of the various Fe nitride phases using molecular beam epitaxy of Fe in the presence of a flux of atomic N, or by post-nitriding freshly grown Fe layers also

  19. Identification of Abnormal Phase and its Formation Mechanism in Synthesizing Chalcogenide Films

    Science.gov (United States)

    Liu, Kegao; Ji, Nianjing; Xu, Yong; Liu, Hong

    2016-09-01

    Chalcogenide films can be used in thin-film solar cells due to their high photoelectric conversion efficiencies. It was difficult to identify one abnormal phase with high X-ray diffraction (XRD) intensity and preferred orientation in the samples for preparing chalcogenide films by spin-coating and co-reduction on soda-lime glass (Na2OṡCaOṡ6SiO2) substrates. The raw materials and reductant are metal chlorides and hydrazine hydrate respectively. In order to identify this phase, a series of experiments were done under different conditions. The phases of obtained products were analyzed by XRD and the size and morphology were characterized by scanning electron microscope (SEM) and atomic force microscopy (AFM). From the experimental results, first it was proved that the abnormal phase was water-soluble by water immersion experiment, then it was identified as NaCl crystal through XRD, energy dispersive spectrometer (EDS) and SEM. The cubic NaCl crystals have high crystallinity with size lengths of about 0.5-2μm and show a preferred orientation. The reaction mechanism of NaCl crystal was proposed as follows: The NaCl crystal was formed by reaction of Na2O and HCl in a certain experimental conditions.

  20. A Systematical Analysis of Tryptic Peptide Identification with Reverse Phase Liquid Chromatography and Electrospray Ion Trap Mass Spectrometry

    Institute of Scientific and Technical Information of China (English)

    Wei Sun; Shuzhen Wu; Xiaorong Wang; Dexian Zheng; Youhe Gao

    2004-01-01

    In this study we systematically analyzed the elution condition of tryptic peptides and the characteristics of identified peptides in reverse phase liquid chromatography and electrospray tandem mass spectrometry (RPLC-MS/MS) analysis. Following protein digestion with trypsin, the peptide mixture was analyzed by on-line RPLC-MS/MS. Bovine serum albumin (BSA) was used to optimize acetonitrile (ACN) elution gradient for tryptic peptides, and Cytochrome C was used to retest the gradient and the sensitivity of LC-MS/MS. The characteristics of identified peptides were also analyzed. In our experiments, the suitable ACN gradient is 5%to 30% for tryptic peptide elution and the sensitivity of LC-MS/MS is 50 fmol.Analysis of the tryptic peptides demonstrated that longer (more than 10 amino acids) and multi-charge state (+2,+3) peptides are likely to be identified, and the hydropathicity of the peptides might not be related to whether it is more likely to be identified or not. The number of identified peptides for a protein might be used to estimate its loading amount under the same sample background. Moreover, in this study the identified peptides present three types of redundancy, namely identification, charge, and sequence redundancy, which may repress low abundance protein identification.

  1. Using a Fractal Analysis and Polarization Method for Phase Identification in Three-Component Seismograms

    Directory of Open Access Journals (Sweden)

    Boi-Yee Liao

    2010-01-01

    Full Text Available This study presents the automatic P-wave and S-wave arrivals picking algorithm which is essentially based on the fractal dimension and polarized method. With an estimate of the spectral exponent £^ in a 1/f process, an interval that indicates the preferred intersection containing both noise and the P-wave is well-detected by corresponding to the minimum absolute spectral exponent £^ value along the trace. Based on the different properties of background noise and deterministic signal, the fractal dimension technique can detect the position of the P-wave. The place where the fractal dimension value changes suddenly within the intersection interval indicates the location of arrival of the P-wave. Testing that adds various levels of noise to the seismic signal shows the method can prove able to tolerate noise to a signal-to-noise (S/N ratio 1.5. Based on the P-wave arrival, the polarized P-wave could be detected by a genetic algorithm (GA with the strength of polarization and phase difference between the vertical and horizontal components as constraints. Using the first arrival phase as the basis phase, this study combines a polarization filter including rectilinearity functions, linear polarization, phase difference and directionality with GA to detect polarized S-wave of seismograms. Finally, the technique was applied to teleseismic data and near-field motion to verify the accuracy and wide applicability of this method. To conclude, this proposed method, an efficient and brand-new method of associating signal processing technique with physical wave motion properties, may be of importance in finding P-wave and S-wave phase arrivals accurately using three-component seismograms.

  2. Virtual Sensor for Failure Detection, Identification and Recovery in the Transition Phase of a Morphing Aircraft

    Directory of Open Access Journals (Sweden)

    Guillermo Heredia

    2010-03-01

    Full Text Available The Helicopter Adaptive Aircraft (HADA is a morphing aircraft which is able to take-off as a helicopter and, when in forward flight, unfold the wings that are hidden under the fuselage, and transfer the power from the main rotor to a propeller, thus morphing from a helicopter to an airplane. In this process, the reliable folding and unfolding of the wings is critical, since a failure may determine the ability to perform a mission, and may even be catastrophic. This paper proposes a virtual sensor based Fault Detection, Identification and Recovery (FDIR system to increase the reliability of the HADA aircraft. The virtual sensor is able to capture the nonlinear interaction between the folding/unfolding wings aerodynamics and the HADA airframe using the navigation sensor measurements. The proposed FDIR system has been validated using a simulation model of the HADA aircraft, which includes real phenomena as sensor noise and sampling characteristics and turbulence and wind perturbations.

  3. Design of heterogeneous catalysts

    DEFF Research Database (Denmark)

    Frey, Anne Mette

    was inspired by a computational screening, suggesting that alloys such as Ni-Fe, Co-Ni, and Co-Fe should show superior activity to the industrially used nickel catalyst. Especially the Ni-Fe system was considered to be interesting, since such alloy catalysts should be both more active and cheaper than the Ni...... well, and the best catalyst prepared had a C5+ yield almost a factor of two higher than a standard air calcined Co catalyst. In the NH3-SCR reaction it is desirable to develop an active and stable catalyst for NOx removal in automotive applications, since the traditionally used vanadium-based catalyst...... pose an environmental risk. The focus was put on iron-containing zeolite catalysts, since these recently have shown great potential as catalysts for the process. A number of different zeolites were compared. BEA was found to be the most active, thus focus was put on this material. Different preparation...

  4. Application of ultrasonic and phase transfer catalyst in saponification of palm oil%超声波和相转移催化剂在棕榈油皂化反应中的应用研究

    Institute of Scientific and Technical Information of China (English)

    胡爱军; 刘雪; 郑捷; 孙连立; 李洪艳

    2012-01-01

    The heterogeneous saponification reaction of palm oil was studied. Catalysts and saponification treatment means were investigated first, then the temperature, ultrasonic power, reaction time, dosage of catalyst and dosage of KOH were optimized by single factor experiments. The results showed that phase transfer catalyst of CTAB was the best and the best treatment means was ultrasonic combined with agitation. The optimal saponification parameters were obtained as follows; temperature 70°C , ultrasonic power 320 W, reaction time 80 min, dosage of CTAB 0. 5 g per gram of oil, and dosage of KOH 1. 75 g per gram of oil. Under the optimal conditions, the saponification rate was 89. 32% , which was 4. 7 times higher than that under conventional conditions(without catalyst and ultrasonic) .%以棕榈油为原料,对其非均相皂化反应进行了研究.对催化剂及皂化处理方式进行考察,并在此基础上选择反应温度、超声波功率、反应时间、催化剂添加量、KOH添加量进行了单因素优化实验.结果表明:相转移催化剂CTAB催化效果最好,超声波辅助搅拌处理方式最佳;单因素优化的最优皂化条件为反应温度70℃,超声波功率320 W,反应时间80 min,催化剂CTAB添加量0.5g(以每克油计),KOH添加量1.75 g(以每克油计).在最优条件下皂化率达到89.32%,是常规搅拌(无催化剂,无超声波作用)下皂化率的4.7倍,大大提高了效率.

  5. Coupled reversed-phase and ion chromatographic system for the simultaneous identification of inorganic and organic explosives.

    Science.gov (United States)

    Tyrrell, Eadaoin; Dicinoski, Greg W; Hilder, Emily F; Shellie, Robert A; Breadmore, Michael C; Pohl, Christopher A; Haddad, Paul R

    2011-05-20

    There are many methods available to detect and positively identify either organic or inorganic explosives separately, however no one method has been developed which can detect both types of explosive species simultaneously from a single sample. In this work, a unique coupled-chromatographic system is reported for the simultaneous determination of both organic and inorganic explosive species and is used for pre-blast analysis/identification purposes. This novel approach is based on the combination of reversed-phase high performance liquid chromatography and ion chromatography which allows trace levels of organic and inorganic explosives to be determined simultaneously from a single sample. Using this procedure, a 20 min reversed-phase separation of organic explosives is coupled to a 16 min ion-exchange separation of anions present in inorganic explosives, providing a complete pre-blast analysis/identification system for the separation and detection of a complex mixture containing organic and/or inorganic explosive species. The total analysis time, including sufficient column re-equilibration between runs, was <25 min using the coupled system. By this method, the minimum resolution for the organic separation was 1.16 between nitroglycerin and tetryl and the detection limits ranged from 0.31 mg L(-1) for cyclotetramethylene tetranitramine (HMX) and 1.54 mg L(-1) for pentaerythrite tetranitrate (PETN), while the minimum resolution for the inorganic separation was 0.99 between azide and nitrate, and the detection limits ranged from 7.70 μg L(-1) for fluoride and 159.50 μg L(-1) for benzoate. Crown Copyright © 2011. Published by Elsevier B.V. All rights reserved.

  6. Technical Considerations on Phase Mapping for Identification of Atrial Reentrant Activity in Direct- and Inverse-Computed Electrograms.

    Science.gov (United States)

    Rodrigo, Miguel; Climent, Andreu M; Liberos, Alejandro; Fernández-Avilés, Francisco; Berenfeld, Omer; Atienza, Felipe; Guillem, Maria S

    2017-09-01

    Phase mapping has become a broadly used technique to identify atrial reentrant circuits for ablative therapy guidance. This work studies the phase mapping process and how the signal nature and its filtering affect the reentrant pattern characterization in electrogram (EGM), body surface potential mapping, and electrocardiographic imaging signals. EGM, body surface potential mapping, and electrocardiographic imaging phase maps were obtained from 17 simulations of atrial fibrillation, atrial flutter, and focal atrial tachycardia. Reentrant activity was identified by singularity point recognition in raw signals and in signals after narrow band-pass filtering at the highest dominant frequency (HDF). Reentrant activity was dominantly present in the EGM recordings only for atrial fibrillation and some atrial flutter propagations patterns, and HDF filtering allowed increasing the reentrant activity detection from 60% to 70% of time in atrial fibrillation in unipolar recordings and from 0% to 62% in bipolar. In body surface potential mapping maps, HDF filtering increased from 10% to 90% the sensitivity, although provoked a residual false reentrant activity ≈30% of time. In electrocardiographic imaging, HDF filtering allowed to increase ≤100% the time with detected rotors, although provoked the apparition of false rotors during 100% of time. Nevertheless, raw electrocardiographic imaging phase maps presented reentrant activity just in atrial fibrillation recordings accounting for ≈80% of time. Rotor identification is accurate and sensitive and does not require additional signal processing in measured or noninvasively computed unipolar EGMs. Bipolar EGMs and body surface potential mapping do require HDF filtering to detect rotors at the expense of a decreased specificity. © 2017 American Heart Association, Inc.

  7. Phase Identification and Internal Stress Analysis of Steamside Oxides on Plant Exposed Superheater Tubes

    DEFF Research Database (Denmark)

    Pantleon, Karen; Montgomery, Melanie

    2012-01-01

    During long-term, high-temperature exposure of superheater tubes in thermal power plants, various oxides are formed on the inner side (steamside) of the tubes, and oxide spallation is a serious problem for the power plant industry. Most often, oxidation in a steam atmosphere is investigated in la...... typically applied for superheaters, ferritic-martensitic X20CrMoV12-1 and lean austenitic stainless steel TP347H, respectively, are revealed by X-ray diffraction.......-exposed superheater tubes was proven in the current work; the challenges for depth-resolved phase analysis and phase-specific residual stress analysis at the inner side of the tubes with concave surface curvature are discussed. Essential differences between the steamside oxides formed on two different steels...

  8. Near-infrared line identification in type Ia supernovae during the transitional phase

    Energy Technology Data Exchange (ETDEWEB)

    Friesen, Brian; Baron, E.; Wisniewski, John P.; Miller, Timothy R. [Homer L. Dodge Department of Physics and Astronomy, 440 West Brooks Street, Room 100, Norman, OK 73019 (United States); Parrent, Jerod T. [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Thomas, R. C. [Computational Cosmology Center, Computational Research Division, Lawrence Berkeley National Laboratory, 1 Cyclotron Road MS 50B-4206, Berkeley, CA 94720 (United States); Marion, G. H. [University of Texas at Austin, 1 University Station C1400, Austin, TX 78712-0259 (United States)

    2014-09-10

    We present near-infrared synthetic spectra of a delayed-detonation hydrodynamical model and compare them to observed spectra of four normal Type Ia supernovae ranging from day +56.5 to day +85. This is the epoch during which supernovae are believed to be undergoing the transition from the photospheric phase, where spectra are characterized by line scattering above an optically thick photosphere, to the nebular phase, where spectra consist of optically thin emission from forbidden lines. We find that most spectral features in the near-infrared can be accounted for by permitted lines of Fe II and Co II. In addition, we find that [Ni II] fits the emission feature near 1.98 μm, suggesting that a substantial mass of {sup 58}Ni exists near the center of the ejecta in these objects, arising from nuclear burning at high density.

  9. Icelandic women's identifications of stressors and social support during the diagnostic phase of breast cancer.

    Science.gov (United States)

    Fridfinnsdottir, E B

    1997-03-01

    The purpose of this descriptive exploratory study was to describe the nature of stressors Icelandic women identify during the diagnostic phase of breast cancer, what sources of social support they draw upon, and their satisfaction with the social support they receive. Lazarus and Folkman's theory of stress, appraisal and coping was used as a theoretical framework for the study. Semi-structured interviews were conducted with 12 women in the diagnostic phase of breast cancer. Women experience the possibility of having cancer as an enormous threat. Social support was identified as a fundamental coping resource, where emotional support from husbands, family and close friends was of utmost importance. Health care professionals were not only the most important source of informational support but also a valuable source of emotional support.

  10. Identification of Mine-Shaped Objects based on an Efficient Phase Stepped-Frequency Radar Approach

    DEFF Research Database (Denmark)

    Sørensen, Helge Bjarup Dissing; Jakobsen, Kaj Bjarne; Nymann, Ole

    1997-01-01

    A computational efficient approach to identify very small mine-shaped plastic objects, e.g. M56 Anti-Personnel (AP) mines buried in the ground, is presented. The size of the objects equals the smallest AP-mines in use today, i.e., the most difficult mines to detect with respect to humanitarian mine...... a radar probe is moved automatically to measure in each grid point a set of reflection coefficients from which phase and amplitude information are extracted. Based on a simple processing of the phase information, quarternary image and template cross-correlation a successful detection of metal- and non......-metal mine-shaped objects is possible. Measurements have been performed on loamy soil containing different mine-shaped objects...

  11. Identification of the hydrate gel phases present in phosphate-modified calcium aluminate binders

    Energy Technology Data Exchange (ETDEWEB)

    Chavda, Mehul A.; Bernal, Susan A. [Department of Materials Science and Engineering, The University of Sheffield, Sheffield S1 3JD (United Kingdom); Apperley, David C. [Solid-State NMR Group, Department of Chemistry, Durham University, Durham DH1 3LE (United Kingdom); Kinoshita, Hajime [Department of Materials Science and Engineering, The University of Sheffield, Sheffield S1 3JD (United Kingdom); Provis, John L., E-mail: j.provis@sheffield.ac.uk [Department of Materials Science and Engineering, The University of Sheffield, Sheffield S1 3JD (United Kingdom)

    2015-04-15

    The conversion of hexagonal calcium aluminate hydrates to cubic phases in hydrated calcium aluminate cements (CAC) can involve undesirable porosity changes and loss of strength. Modification of CAC by phosphate addition avoids conversion, by altering the nature of the reaction products, yielding a stable amorphous gel instead of the usual crystalline hydrate products. Here, details of the environments of aluminium and phosphorus in this gel were elucidated using solid-state NMR and complementary techniques. Aluminium is identified in both octahedral and tetrahedral coordination states, and phosphorus is present in hydrous environments with varying, but mostly low, degrees of crosslinking. A {sup 31}P/{sup 27}Al rotational echo adiabatic passage double resonance (REAPDOR) experiment showed the existence of aluminium–phosphorus interactions, confirming the formation of a hydrated calcium aluminophosphate gel as a key component of the binding phase. This resolves previous disagreements in the literature regarding the nature of the disordered products forming in this system.

  12. Catalysts for the Selective Oxidation of Methanol

    Directory of Open Access Journals (Sweden)

    Catherine Brookes

    2016-06-01

    Full Text Available In industry, one of the main catalysts typically employed for the selective oxidation of methanol to formaldehyde is a multi-component oxide containing both bulk Fe2(MoO43 and excess MoO3. It is thought that the excess MoO3 primarily acts to replace any molybdenum lost through sublimation at elevated temperatures, therefore preventing the formation of an unselective Fe2O3 phase. With both oxide phases present however, debate has arisen regarding the active component of the catalyst. Work here highlights how catalyst surfaces are significantly different from bulk structures, a difference crucial for catalyst performance. Specifically, Mo has been isolated at the surface as the active surface species. This leaves the role of the Fe in the catalyst enigmatic, with many theories postulated for its requirement. It has been suggested that the supporting Fe molybdate phase enables lattice oxygen transfer to the surface, to help prevent the selectivity loss which would occur in the resulting oxygen deficit environment. To assess this phenomenon in further detail, anaerobic reaction with methanol has been adopted to evaluate the performance of the catalyst under reducing conditions.

  13. Identification method of seismic phase in three-component seismograms on the basis of wavelet transform

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    This paper puts forward wavelet transform method to identify P and S phases in three component seismograms using polarization information contained in the wavelet transform coefficients of signal. The P and S wave locator functions are constructed by using eigenvalue analysis method to wavelet transform coefficient across several scales. Locator functions formed by wavelet transform have stated noise resistance capability, and is proved to be very effective in identifying the P and S arrivals of the test data and actual earthquake data.

  14. Identification of two-phase flow regimes under variable gravity conditions

    Energy Technology Data Exchange (ETDEWEB)

    Kamiel S Gabriel [University of Ontario Institute of Technology 2000 Simcoe Street North, Oshawa, ON L1H 7K4 (Canada); Huawei Han [Mechanical Engineering Department, University of Saskatchewan 57 Campus Dr., Saskatoon, Saskatchewan, S7N 5A9 (Canada)

    2005-07-01

    Full text of publication follows: Two-phase flow is becoming increasingly important as we move into new and more aggressive technologies in the twenty-first century. Some of its many applications include the design of efficient heat transport systems, the transfer and storage of cryogenic fluids, and condensation and flow boiling processes in heat exchangers and energy transport systems. Two-phase flow has many applications in reduced gravity environments experienced in orbiting spacecraft and earth observation satellites. Examples are heat transport systems, the transfer and storage of cryogenic fluids, and condensation and flow boiling processes in heat exchangers. A concave parallel plate capacitance sensor has been developed to measure void fraction for the purpose of objectively identifying flow regimes. The sensor has been used to collect void-fraction data at microgravity conditions aboard the NASA and ESA zero-gravity aircraft. It is shown that the flow regimes can be objectively determined from the probability density functions of the void fraction signals. It was shown that under microgravity conditions four flow regimes exist: bubbly flow, characterized by discrete gas bubbles flowing in the liquid; slug flow, consisting of Taylor bubbles separated by liquid slugs which may or may not contain several small gas bubbles; transitional flow, characterized by the liquid flowing as a film at the tube wall, and the gas phase flowing in the center with the frequent appearance of chaotic, unstable slugs; and annular flow in which the liquid flows as a film along the tube wall and the gas flows uninterrupted through the center. Since many two-phase flow models are flow regime dependent, a method that can accurately and objectively determine flow regimes is required. (authors)

  15. Detailed electrochemical studies of the tetraruthenium polyoxometalate water oxidation catalyst in acidic media: identification of an extended oxidation series using Fourier transformed alternating current voltammetry.

    Science.gov (United States)

    Lee, Chong-Yong; Guo, Si-Xuan; Murphy, Aidan F; McCormac, Timothy; Zhang, Jie; Bond, Alan M; Zhu, Guibo; Hill, Craig L; Geletii, Yurii V

    2012-11-05

    The electrochemistry of the water oxidation catalyst, Rb(8)K(2)[{Ru(4)O(4)(OH)(2)(H(2)O)(4)}(γ-SiW(10)O(36))(2)] (Rb(8)K(2)-1(0)) has been studied in the presence and absence of potassium cations in both hydrochloric and sulfuric acid solutions by transient direct current (dc) cyclic voltammetry, a steady state dc method in the rotating disk configuration and the kinetically sensitive technique of Fourier transformed large-amplitude alternating current (ac) voltammetry. In acidic media, the presence of potassium ions affects the kinetics (apparent rate of electron transfer) and thermodynamics (reversible potentials) of the eight processes (A'/A to H/H') that are readily detected under dc voltammetric conditions. The six most positive processes (A'/A to F/F'), each involve a one electron ruthenium based charge transfer step (A'/A, B'/B are Ru(IV/V) oxidation and C/C' to F/F' are Ru(IV/III) reduction). The apparent rate of electron transfer of the ruthenium centers in sulfuric acid is higher than in hydrochloric acid. The addition of potassium cations increases the apparent rates and gives rise to a small shift of reversible potential. Simulations of the Fourier transformed ac voltammetry method show that the B'/B, E/E', and F/F' processes are quasi-reversible, while the others are close to reversible. A third Ru(IV/V) oxidation process is observed just prior to the positive potential limit via dc methods. Importantly, the ability of the higher harmonic components of the ac method to discriminate against the irreversible background solvent process allows this (process I) as well as an additional fourth reversible ruthenium based process (J) to be readily identified. The steady-state rotating disk electrode (RDE) method confirmed that all four Ru-centers in Rb(8)K(2)-1(0) are in oxidation state IV. The dc and ac data indicate that reversible potentials of the four ruthenium centers are evenly spaced, which may be relevant to understanding of the water oxidation

  16. Genetic analysis and marker assisted identification of life phases of red alga Gracilaria corticata (J. Agardh).

    Science.gov (United States)

    Baghel, Ravi S; Kumari, Puja; Bijo, A J; Gupta, Vishal; Reddy, C R K; Jha, B

    2011-08-01

    The present study firstly reports the cytological and molecular marker assisted differentiation of isomorphic population of Gracilaria corticata (J. Agardh) with inter and intra-phasic genetic diversity analysis using ISSR markers. The genetic diversity of inbreeding population of G. corticata as determined in terms of percentage of polymorphic loci (PPL), average heterozygosity (He) and Shannon's Weaver index (I) were 59.80, 0.59 and 1.21, respectively. The inter-phasic pair-wise average polymorphism were found to be 31.6% between male and female, 24.0% in male and tetrasporophyte and 25.3% in female and tetrasporophyte. The intra-phasic average polymorphisms were calculated as a maximum of 5.5% between females, 4.2% between males and the lowest 2.4% between tetrasporophytes. The primer 10 generated a marker of 800 bp specific to male and 650 bp to female gametophyte, while the primer 17 generated a marker of 2,500 bp specific to tetrasporophyte. Both the UPGMA based dendrogram and PCA analysis clustered all the three life phases differentially as distinct identity. Cytological analysis by chromosome count revealed 24 chromosomes in both haploid male and female gametophytes (N) and 48 for diploid (2 N) tetrasporophyte further confirming their genetic distinctness. The life phase specific markers reported in this study could be of help in breeding programmes where differentiation of life phases at the early developmental stages is crucial.

  17. CO oxidation over ruthenium: identification of the catalytically active phases at near-atmospheric pressures

    Energy Technology Data Exchange (ETDEWEB)

    Gao, Feng; Goodman, Wayne D.

    2012-05-21

    CO oxidation was carried out over Ru(0001) and RuO2(110) thin film grown on Ru(0001) at various O2/CO ratios near atmospheric pressures. Reaction kinetics, coupled with in situ polarization modulation infrared reflection absorption spectroscopy (PM-IRAS) and post-reaction Auger electron spectroscopy (AES) measurements were used to identify the catalytically relevant phases at different reaction conditions. Under stoichiometric and reducing conditions at all reaction temperatures, as well as net-oxidizing reaction conditions below {approx}475 K, a reduced metallic phase with chemisorbed oxygen is the thermodynamically stable and catalytically active phase. On this surface CO oxidation occurs at surface defect sites, for example step edges. Only at net-oxidizing reaction conditions and above {approx}475 K is the RuO2 thin film grown on metallic Ru stable and active. However, RuO2 is not active itself without the existence of the metal substrate, suggesting the importance of a strong metal-substrate interaction (SMSI).

  18. A solid-phase extraction approach for the identification of pharmaceutical-sludge adsorption mechanisms

    Institute of Scientific and Technical Information of China (English)

    Laurence Berthod; Gary Roberts; Graham A. Mills

    2014-01-01

    It is important to understand the adsorption mechanism of chemicals and active pharmaceu-tical ingredients (API) on sewage sludge since wastewater treatment plants are the last barrier before the release of these compounds to the environment. Adsorption models were developed considering mostly hydrophobic API-sludge interaction. They have poor predictive ability, especially with ionisable compounds. This work proposes a solid-phase extraction (SPE) approach to estimate rapidly the API-sludge interaction. Sludge-filled SPE cartridges could not be percolated with API spiked mobile phases so different powders were tested as SPE sludge supports. Polytetrafluoroethylene (PTFE) was selected and tested at different PTFE/sludge ratios under eight different adsorption conditions with three API ionisable compounds. The PTFE/sludge mixtures with 50% or less sludge could be used in SPE mode for API sorption studies with methanol/water liquid phases. The results gave insights into API-sludge interactions. It was found that π-π, hydrogen-bonding and charge-charge interactions were as important as hydrophobicity in the adsorption mechanism of charged APIs on sludge.

  19. Identification, size classification and evolution of Laves phase precipitates in high chromium, fully ferritic steels.

    Science.gov (United States)

    Lopez Barrilao, Jennifer; Kuhn, Bernd; Wessel, Egbert

    2017-10-01

    To fulfil the new challenges of the German "Energiewende" more efficient, sustainable, flexible and cost-effective energy technologies are strongly needed. For a reduction of consumed primary resources higher efficiency steam cycles with increased operating parameters, pressure and temperature, are mandatory. Therefore advanced materials are needed. The present study focuses on a new concept of high chromium, fully ferritic steels. These steels, originally designed for solid oxide fuel cell applications, provide favourable steam oxidation resistance, creep and thermomechanical fatigue behaviour in comparison to conventional ferritic-martensitic steels. The strength of this type of steel is achieved by a combination of solid-solution hardening and precipitation strengthening by intermetallic Laves phase particles. The effect of alloy composition on particle composition was measured by energy dispersive X-ray spectroscopy and partly verified by thermodynamic modelling results. Generally the Laves phase particles demonstrated high thermodynamic stability during long-term annealing up to 40,000h at 600°C. Variations in chemical alloy composition influence Laves phase particle formation and consequently lead to significant changes in creep behaviour. For this reason particle size distribution evolution was analysed in detail and associated with the creep performance of several trial alloys. Copyright © 2017 Elsevier Ltd. All rights reserved.

  20. System identification and structural control on the JPL Phase B testbed

    Science.gov (United States)

    Chu, Cheng-Chih; Obrien, John F.; Lurie, Boris J.

    1993-02-01

    The primary objective of NASA's CSI program at JPL is to develop and demonstrate the CSI technology required to achieve high precision structural stability on large complex optical class spacecraft. The focus mission for this work is an orbiting interferometer telescope. Toward the realization of such a mission, a series of evolutionary testbed structures are being constructed. The JPL's CSI Phase B testbed is the second structure constructed in this series which is designed to study the pathlength control problem of the optical train of a stellar interferometer telescope mounted on a large flexible structure. A detailed description of this testbed can be found. This paper describes our efforts in the first phase of active structural control experiments of Phase B testbed using the active control approach where a single piezoelectric active member is used as an actuation device and the measurements include both colocated and noncolocated sensors. Our goal for this experiment is to demonstrate the feasibility of active structural control using both colocated and noncolocated measurements by means of successive control design and loop closing. More specifically, the colocated control loop was designed and closed first to provide good damping improvement over the frequency range of interest. The noncolocated controller was then designed with respect to a partially controlled structure to further improve the performance. Based on our approach, experimental closed-loop results have demonstrated significant performance improvement with excellent stability margins.

  1. Best-Quality Vessel Identification Using Vessel Quality Measure in Multiple-Phase Coronary CT Angiography

    Science.gov (United States)

    Liu, Jordan; Chan, Heang-Ping; Zhou, Chuan; Wei, Jun; Chughtai, Aamer; Kuriakose, Jean; Agarwal, Prachi; Kazerooni, Ella

    2016-01-01

    The detection of stenotic plaques strongly depends on the quality of the coronary arterial tree imaged with coronary CT angiography (cCTA). However, it is time consuming for the radiologist to select the best-quality vessels from the multiple-phase cCTA for interpretation in clinical practice. We are developing an automated method for selection of the best-quality vessels from coronary arterial trees in multiple-phase cCTA to facilitate radiologist's reading or computerized analysis. Our automated method consists of vessel segmentation, vessel registration, corresponding vessel branch matching, vessel quality measure (VQM) estimation, and automatic selection of best branches based on VQM. For every branch, the VQM was calculated as the average radial gradient. An observer preference study was conducted to visually compare the quality of the selected vessels. 167 corresponding branch pairs were evaluated by two radiologists. The agreement between the first radiologist and the automated selection was 76% with kappa of 0.49. The agreement between the second radiologist and the automated selection was also 76% with kappa of 0.45. The agreement between the two radiologists was 81% with kappa of 0.57. The observer preference study demonstrated the feasibility of the proposed automated method for the selection of the best-quality vessels from multiple cCTA phases.

  2. Pd Close Coupled Catalyst

    Institute of Scientific and Technical Information of China (English)

    Zhong Hua SHI; Mao Chu GONG; Yao Qiang CHEN

    2006-01-01

    A catalyst comprised novel high surface area alumina support was prepared to control emission of automobiles. The results showed that prepared catalyst could satisfy the requirements of a high performance close coupled catalyst for its good catalytic activity at low temperature and good stability at high temperature.

  3. Large Scale Manufacture of Catalyst for Making DME Developed by Southwest Chemical Research and Design Institute

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    @@ The Southwest Chemical Research and Design Institute (SCRDI) after tackling the key technology related with the catalyst for manufacture of DME through gas phase dehydration of methanol has made great breakthroughs in large scale preparation of catalyst for DME production.

  4. Au catalyst assisted growth of ZnO nanowires by vapour phase transport method on p-Si and fabrication of p-Si/n-ZnO heterojunction diode

    Energy Technology Data Exchange (ETDEWEB)

    Bhat, Shashidhara; V, Shrisha B.; Naik, K Gopalakrishna, E-mail: gopal-mng@yahoo.com [Department of Physics, Mangalore University, Mangalagangotri – 574199 (India)

    2015-06-24

    In this work ZnO nanowires were grown on p type silicon (p-Si) substrate using Vapor-Liquid-Solid (VLS) approach using Au as catalyst by vapor phase transport growth method. Surface morphology and structural properties of the grown ZnO nanowires were examined by Scanning electron microscope (SEM) and X-ray diffraction (XRD), respectively. Using the n-ZnO nanowires (NW) grown on p-type silicon, n-ZnO NW/p-Si heterojunction diode was fabricated. The rectification property of the fabricated diode was studied by room temperature as well as high temperature (up to 370 K) current-voltage (I-V) measurements.

  5. Lacunary Keggin Polyoxotungstate as Reaction-controlled Phasetransfer Catalyst for Catalytic Epoxidation of Olefins

    Institute of Scientific and Technical Information of China (English)

    LI,Ming-Qiang(李明强); JIAN,Xi-Gao(蹇锡高); YANG,Yong-Qiang(杨永强)

    2004-01-01

    A new reaction-controlled phase-transfer catalyst system, lacunary Keggin polyoxotungstate [C7H7N(CH3)3]9PW9O34 has been synthesized and used for catalytic epoxidation of olefins with H2O2 as the oxidant.Infrared spectra were used to analyze the behavior of the phase transfer of catalyst. In this system, the catalyst not only can act as homogeneous catalyst but also as heterogeneous catalyst to be easily filtered and reused. The epoxidation reaction is clean and exhibits high conversion and selectivity as well as excellent catalyst stability.

  6. The effects of Te on the performance of Mo-V catalysts prepared by hydrothermal synthesis

    Institute of Scientific and Technical Information of China (English)

    Hua Chang Jiang; Ling Zeng; Bin Long Yin

    2007-01-01

    Some Mo-V-Te-La catalysts with varied component were prepared by hydrothermal synthesis and dried with microwave method. The component of the catalyst were greatly affected the crystal structure and Raman spectrum. The phase in the catalysts was different when the Mo, V, and Te content varied. When the catalyst containing the same Mo, V content, due to the effect of dopant of Te element (V0.07 Mo0.93)5O14 became the main phase in the catalyst. The catalyst also showed good activity for the reaction of selective oxidation propane to acrolein and acrylic acid.

  7. Phase Composition of Ni/Mg1−xNixO as a Catalyst Prepared for Selective Methanation of CO in H2-Rich Gas

    OpenAIRE

    Mengmeng Zhang; Hongwei Ma; Zhiming Gao

    2015-01-01

    Supported Ni catalysts Ni/Mg1−xNixO were prepared by reducing samples NiO-MgO in H2/N2 mixture gas at 500°C~800°C for selective methanation of CO in H2-rich gas (CO-SMET). The samples NiO-MgO were obtained by heating water slurry of MgO and Ni(NO3)2 in a rotary evaporator at 80°C and a final calcination in air at 400°C~800°C. X-ray diffraction (XRD) and temperature programmed reduction (TPR) measurements demonstrate that the samples NiO-MgO were composed of solid solution Mg1−yNiyO as the mai...

  8. Ruthenium Modification on Mn and Zr-Modified Co/SiO2 Catalysts for Slurry-Phase Fischer-Tropsch Synthesis

    Directory of Open Access Journals (Sweden)

    Tomohisa Miyazawa

    2015-01-01

    Full Text Available The addition of Ru to Mn and Zr-modified Co/SiO2 catalysts, while applying different preparation orders and loading amounts, was investigated as a means of enhancing the Fischer-Tropsch synthesis reaction. The coimpregnation of Zr/SiO2 with Co, Mn and Ru gave the most attractive catalytic properties. This can be attributed to the higher dispersion of Co metal resulting from the coimpregnation of Co and Mn as well as enhanced reducibility due to the presence of Ru. The addition of a moderate amount of Ru together with the appropriate order of addition affected both the Co reducibility and the catalytic activity, primarily because of increased reducibility. The addition of even 0.1 wt.% Ru resulted in an obvious enhancement of Fischer-Tropsch synthesis activity.

  9. Identifying active surface phases for metal oxide electrocatalysts: a study of manganese oxide bi-functional catalysts for oxygen reduction and water oxidation catalysis

    DEFF Research Database (Denmark)

    Su, Hai-Yan; Gorlin, Yelena; Man, Isabela Costinela

    2012-01-01

    Progress in the field of electrocatalysis is often hampered by the difficulty in identifying the active site on an electrode surface. Herein we combine theoretical analysis and electrochemical methods to identify the active surfaces in a manganese oxide bi-functional catalyst for the oxygen...... and that its overpotential is highly dependent on the stabilization of intermediates through hydrogen bonds with water molecules. We also determine that OER occurs through direct recombination mechanism and that its major source of overpotential is the scaling relationship between HOO* and HO* surface...... intermediates. Using a previously developed Sabatier model we show that the theoretical predictions of catalytic activities match the experimentally determined onset potentials for the ORR and the OER, both qualitatively and quantitatively. Consequently, the combination of first-principles theoretical analysis...

  10. Functionalized SBA-15 supported nickel (II)-oxime-imine catalysts for liquid phase oxidation of olefins under solvent-free conditions

    Science.gov (United States)

    Paul, Luna; Banerjee, Biplab; Bhaumik, Asim; Ali, Mahammad

    2016-05-01

    A new oxime-imine functionalized highly ordered mesoporous SBA-15 (SBA-15-NH2-DAMO) has been synthesized via post-synthesis functionalization of SBA-15 with 3-aminopropyl-triethoxysilane followed by the Schiff base condensation with diacetylmonooxime, which was further reacted with Ni(ClO4)2 to yield the functionalized nickel catalyst SBA-15-NH2-DAMO-Ni. All the synthesized materials were thoroughly characterized using different characterization techniques. It was found that SBA-15-NH2-DAMO-Ni catalyzes the one-pot oxidation of olefins like styrene, cyclohexene, cyclooctene, 1-hexene and 1-octene to the corresponding benzaldehyde, cyclohexene-1-ol and cyclooctene-oxide, respectively under solvent-free conditions by using tert-butylhydroperoxide as oxidant.

  11. The Synthesis of 4-Bromobenzoic Acid with Phase Transfer Catalyst%相转移催化合成对溴苯甲酸的研究

    Institute of Scientific and Technical Information of China (English)

    刘荣; 戚小露; 支三军

    2011-01-01

    Research on synthesis of 4-bromobenzoic acid was investigated with 4-bromotoluene as raw material,potassium permanganate as the oxidant,TEBA as catalyst,in acid or alkali conditions.A series of experiments were inspected to study the influence on the reaction.Optimization: with water as solvent,TEBA(5%) as catalyst,n(4-bromotoluene)∶n(KMnO4)∶n(Na2CO3)=1.0∶2.5∶1.0,at 95℃ for 2.5 h,4-bromobenzoic acid was obtained in the yield of 82.4%.%研究了以水为溶剂,三乙基苄基氯化胺(TEBA)为催化剂,对溴甲苯为原料,高锰酸钾为氧化剂,在酸性和碱性条件下合成对溴苯甲酸的反应.考察了催化剂用量、反应物摩尔比、反应温度、反应时间等对反应的影响.最优条件为:以水为溶剂,n(对溴甲苯)∶n(KMnO4)∶n(Na2CO3)为1.0∶2.5∶1.0,TEBA(5%)为催化剂,反应温度95℃,反应时间2.5 h,对溴苯甲酸的产率可达82.44%.

  12. Spectroscopic study on the active site of a SiO2 supported niobia catalyst used for the gas-phase Beckmann rearrangement of cyclohexanone oxime to ε-caprolactam.

    Science.gov (United States)

    Maronna, M M; Kruissink, E C; Parton, R F; Soulimani, F; Weckhuysen, B M; Hoelderich, W F

    2016-08-10

    NbOx/SiO2 with a very high catalytic activity for the gas-phase Beckmann rearrangement of cyclohexanone oxime to ε-caprolactam, was investigated by different spectroscopic methods in order to obtain new insights in the formation and nature of the active sites. FT-IR spectroscopy in combination with pyridine adsorption measurements revealed that the catalyst material contains Lewis-acidic sites, most probably related to the Nb[double bond, length as m-dash]O groups of isolated tetrahedral NbO4 surface species, whereas no Brønsted-acidic sites were observed. Results from in situ Raman and complementary FT-IR measurements strongly suggest that Brønsted-acidic Nb-OH sites can be generated from Nb[double bond, length as m-dash]O groups by reaction with ethanol. This is in agreement with the observation that ethanol is essential for obtaining a very good catalyst performance. However, the Brønsted-acidic sites can be detected in significant amounts in particular in the presence of a Lewis-base, e.g. pyridine, most probably because the formation and/or the stability of these Brønsted-acidic sites are enhanced by a basic molecule. Assuming that cyclohexanone oxime, being a base, can play a similar role as pyridine, we propose on the basis of the spectroscopic findings obtained in this work and our kinetic results published recently, a reaction scheme for the formation of the active site at the Nb[double bond, length as m-dash]O group as well as for the recovery of the Nb[double bond, length as m-dash]O site during the final stage of the gas-phase Beckmann rearrangement.

  13. Data-driven risk identification in phase III clinical trials using central statistical monitoring.

    Science.gov (United States)

    Timmermans, Catherine; Venet, David; Burzykowski, Tomasz

    2016-02-01

    Our interest lies in quality control for clinical trials, in the context of risk-based monitoring (RBM). We specifically study the use of central statistical monitoring (CSM) to support RBM. Under an RBM paradigm, we claim that CSM has a key role to play in identifying the "risks to the most critical data elements and processes" that will drive targeted oversight. In order to support this claim, we first see how to characterize the risks that may affect clinical trials. We then discuss how CSM can be understood as a tool for providing a set of data-driven key risk indicators (KRIs), which help to organize adaptive targeted monitoring. Several case studies are provided where issues in a clinical trial have been identified thanks to targeted investigation after the identification of a risk using CSM. Using CSM to build data-driven KRIs helps to identify different kinds of issues in clinical trials. This ability is directly linked with the exhaustiveness of the CSM approach and its flexibility in the definition of the risks that are searched for when identifying the KRIs. In practice, a CSM assessment of the clinical database seems essential to ensure data quality. The atypical data patterns found in some centers and variables are seen as KRIs under a RBM approach. Targeted monitoring or data management queries can be used to confirm whether the KRIs point to an actual issue or not.

  14. Study of two-phase flow regime identification in horizontal tube bundles under vertical upward cross-flow condition using wavelet transform

    Institute of Scientific and Technical Information of China (English)

    Xinghua HUANG; Li WANG; Feng JIA

    2008-01-01

    A wavelet-transform based approach for flow regime identification in horizontal tube bundles under vertical upward cross-flow condition was presented. Tests on two-phase flow pattern of R 134a were conducted under low mass velocity and flow boiling conditions over Time series of differential pressure fluctuations were mea-sured and analyzed with discrete wavelet transform. Different time-scale characteristics in bubbly flow, churn flow and annular flow were analyzed. The wavelet energy distributions over scales were found to be appropriate for flow regime identification. Based on the wavelet energy distribution over characteristic scales, a criterion of flow regime identification was proposed. The comparison with experiment results show that it is feasible to use the dis-crete wavelet transform as the tool of flow regime iden-tification in horizontal tube bundles under vertical upward cross-flow condition.

  15. Identification of differentially expressed genes in parasitic phase Miamiensis avidus (Ciliophora: Scuticociliatia) using suppression subtractive hybridization.

    Science.gov (United States)

    Lee, Eun Hye; Kim, Ki Hong

    2011-04-06

    Miamiensis avidus, a causative agent of scuticociliatosis in cultured marine fish, can live not only in seawater as a free-living organism but also in fish as a parasite. In this study, a cDNA library of representative mRNAs more specific to parasitic phase M. avidus was generated using suppression subtractive hybridization (SSH), and 520 clones selected from the SSH library were single-run sequenced. The differential gene expression patterns were confirmed by semi-quantitative reverse-transcription PCR. Of the 510 SSH clones, 21 clones of 6 putative genes did not match sequences in the public database. The expectation values (E-values) of 117 clones encoding 9 putative genes were greater than 1 x 10(-5). The other 372 clones that met the criterion of E value <1 x 10-5 were matched to 26 known sequences in the database. Genes associated with signal transduction, cell proliferation, membrane transportation, protein translocation, and transcription regulation were preferentially expressed in parasitic phase M. avidus. The differential gene expression may be needed for the ciliates to survive in the host fish, and the corresponding proteins might be used as antigen candidates for development of scuticociliatosis vaccines.

  16. Magnetic properties, microstructure and mineralogical phases of technogenic magnetic particles (TMPs) in urban soils: Their source identification and environmental implications.

    Science.gov (United States)

    Lu, Shenggao; Yu, Xiuling; Chen, Yuyin

    2016-02-01

    Magnetic measurement is an effective method to determine spatial distribution and the degree of heavy metal pollution and to identify various anthropogenic sources of heavy metals. The objectives of this investigation are to characterize the magnetic properties, microstructure and mineralogical phases of technogenic magnetic particles (TMPs) in urban soils and to discuss their potential environmental implications. The TMPs are separated from the urban topsoils of Luoyang city, China. The magnetic properties, morphology, and mineral phase of TMPs are studied using mineral magnetic measurement, scanning electron microscopy equipped with energy-dispersive X-ray spectroscopy (SEM/EDS), X-ray diffraction, and synchrotron-radiation-based microprobe. The content of TMPs in urban topsoils ranges from 0.05 to 1.95% (on average 0.32%). The magnetic susceptibility of TMPs ranges from 4559×10(-8) to 23,661×10(-8) m(3) kg(-1) (on average 13,637×10(-8) m(3) kg(-1)). Thermomagnetic and bulk X-ray diffraction analyses indicate that main magnetic minerals of TMPs are magnetite (Fe3O4) and hematite (α-Fe2O3). The morphology of TMPs observed by SEM includes three shape types: spherule, irregular-shaped, and aggregate particles. The size of spherical TMPs ranges from 30 to about 200 μm, with the largest percentage of 30-50 μm. Synchrotron-radiation-based microprobe (μ-XRF and μ-XRD) indicates that TMPs are enriched with heavy metals Pb, Cd, Zn, Cu, and Cr, which are incorporated into lattice or adsorbed on the surface of magnetite/hematite. The content of TMPs significantly relates with the Tomlinson Pollution Load Index (PLI) (R(2)=0.467), suggesting that it can be used as proxy indicator of degree of heavy metal contamination in urban soils. The magnetic properties, microstructure and mineralogical phases of TMPs can serve as the identification of pollution sources in urban soils.

  17. Cloud phase identification of Arctic boundary-layer clouds from airborne spectral reflection measurements: test of three approaches

    Directory of Open Access Journals (Sweden)

    A. Ehrlich

    2008-12-01

    Full Text Available Arctic boundary-layer clouds were investigated with remote sensing and in situ instruments during the Arctic Study of Tropospheric Aerosol, Clouds and Radiation (ASTAR campaign in March and April 2007. The clouds formed in a cold air outbreak over the open Greenland Sea. Beside the predominant mixed-phase clouds pure liquid water and ice clouds were observed. Utilizing measurements of solar radiation reflected by the clouds three methods to retrieve the thermodynamic phase of the cloud are introduced and compared. Two ice indices IS and IP were obtained by analyzing the spectral pattern of the cloud top reflectance in the near infrared (1500–1800 nm wavelength spectral range which is characterized by ice and water absorption. While IS analyzes the spectral slope of the reflectance in this wavelength range, IS utilizes a principle component analysis (PCA of the spectral reflectance. A third ice index IA is based on the different side scattering of spherical liquid water particles and nonspherical ice crystals which was recorded in simultaneous measurements of spectral cloud albedo and reflectance.

    Radiative transfer simulations show that IS, IP and IA range between 5 to 80, 0 to 8 and 1 to 1.25 respectively with lowest values indicating pure liquid water clouds and highest values pure ice clouds. The spectral slope ice index IS and the PCA ice index IP are found to be strongly sensitive to the effective diameter of the ice crystals present in the cloud. Therefore, the identification of mixed-phase clouds requires a priori knowledge of the ice crystal dimension. The reflectance-albedo ice index IA is mainly dominated by the uppermost cloud layer (τ<1.5. Therefore, typical boundary-layer mixed-phase clouds with a liquid cloud top layer will

  18. Identification of Phase and Sex-related ISSR Markers of Red Alga Gracilaria lemaneiformis

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Six ISSR primers are employed to display the polymorphism of different phases and sexes of red alga Gracilaria lemaneiformis, and two of them, P1 and P3, amplified distinct band patterns. The ISSR pattern amplified by primer P1 of the female gametophyte is identical to that of tetrasporophyte, but distinct from that of male gametophyte. Of the bands produced by primer P3, one is specific to female gametophyte. Three morphologically similar fronds can be easily identified using ISSR technique. Two specific markers, SM1 and SF3,related to male gametophyte and female gametophyte, are cloned and sequenced. The homologous sequences of SM1 are found to encode a hypothetical protein. There is no homologous sequence of SF3 that can be found in GenBank.

  19. Identification of hazards in non-nuclear power plants. Volume II. Phase II

    Energy Technology Data Exchange (ETDEWEB)

    Fell, R.W.

    1979-08-01

    This study extends the Phase I study to also include a hazards evaluation for two new emerging coal power plant technologies: coal fired atmospheric fluidized bed and pressurized fluidized bed power generating systems. The study also considers the sensitivity of the hazards ranking for all the non-nuclear power plants to the effects of population density, mode of plant operation, technical changes, location and environmental (temperature) effects. Information is provided under the following section headings: background; environmental and public health concerns associated with fluidized-bed combustion power plants; description of a conceptual atmospheric fluidized-bed power plant; pressurized fluidized-bed combustion combined cycle (PFBCC) power plant; hazard ranking and risk assessment for non-nuclear power plants; and, hazards sensitivity analysis.

  20. Identification of the dimethylamine-trimethylamine complex in the gas phase.

    Science.gov (United States)

    Du, Lin; Lane, Joseph R; Kjaergaard, Henrik G

    2012-05-14

    We have identified the dimethylamine-trimethylamine complex (DMA-TMA) at room temperature in the gas phase. The Fourier transform infrared (FTIR) spectrum of DMA-TMA in the NH-stretching fundamental region was obtained by spectral subtraction of spectra of each monomer. Explicitly correlated coupled cluster calculations were used to determine the minimum energy structure and interaction energy of DMA-TMA. Frequencies and intensities of NH-stretching transitions were also calculated at this level of theory with an anharmonic oscillator local mode model. The fundamental NH-stretching intensity in DMA-TMA is calculated to be approximately 700 times larger than that of the DMA monomer. The measured and calculated intensity is used to determine a room temperature equilibrium constant of DMA-TMA of 1.7 × 10(-3) atm(-1) at 298 K.

  1. Identification of phase and sex-related ISSR markers of red alga Gracilaria lemaneiformis

    Science.gov (United States)

    Xue, Sun; Xuecheng, Zhang; Yunxiang, Mao; Zhenghong, Sui; Song, Qin

    2006-01-01

    Six ISSR primers are employed to display the polymorphism of different phases and sexes of red alga Gracilaria lemaneiformis, and two of them, P1 and P3, amplified distinct band patterns. The ISSR pattern amplified by primer P1 of the female gametophyte is identical to that of tetrasporophyte, but distinct from that of male gametophyte. Of the bands produced by primer P3, one is specific to female gametophyte. Three morphologically similar fronds can be easily identified using ISSR technique. Two specific markers, SM1 and SF3, related to male gametophyte and female gametophyte, are cloned and sequenced. The homologous sequences of SM1 are found to encode a hypothetical protein. There is no homologous sequence of SF3 that can be found in GenBank.

  2. Raman signal processing software for automated identification of mineral phases and biosignatures on Mars.

    Science.gov (United States)

    Sobron, Pablo; Sobron, Francisco; Sanz, Aurelio; Rull, Fernando

    2008-04-01

    Data from the ESA ExoMars Rover Mission will provide invaluable input for further studies in astro/exobiology. The search for mineral products as indicators of present and/or past biogenetic activities in Mars' surface and subsurface samples is the main objective of the compact Raman-laser-induced breakdown spectroscopy (LIBS) instrument. The inherent features of Raman spectroscopy and LIBS make the combined instrument a unique and very powerful tool in the search for biomarkers and hence it is regarded as the highest priority instrument for mineral analysis within the mission. We have developed a software package for the on-board processing of the instrument's data outputs, including spectral conditioning and search-match characterization of mineral phases and biomarkers. In this paper we show the mathematical and physical basis of the software package.

  3. Method for filling a reactor with a catalyst

    DEFF Research Database (Denmark)

    2013-01-01

    The invention relates to a method for filling a reactor with a catalyst for the carbonylation of carbonylated compounds in the gas phase. According to said method, a SILP catalyst is covered with a filling agent which is liquid under normal conditions and is volatile under carbonylation reaction...... conditions, and a thus-treated catalyst is introduced into the reactor and the reactor is sealed....

  4. Supported cobalt catalysts - preparation, characterization and reaction studies

    OpenAIRE

    Backman, Leif

    2009-01-01

    The aim of this work was to understand on the effect of thermal treatments, precursor and support on the interaction between the support and cobalt species, and further how the interaction affects the reducibility and dispersion of the catalyst. Silica and alumina supported cobalt catalysts were prepared, characterised and tested for catalytic activity. The catalysts were prepared by gas phase deposition techniques from cobalt acetylacetonate and cobalt carbonyl and by incipient wetness impre...

  5. Characterization of Fe-Co-Mn catalysts after carbon monoxide hydrogenation

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez C, S.L.; Serbia, M.A.; Baechler, R.; Orozco, J. [Laboratorio de Cinetica y Catalisis, Departamento de Quimica, Facultad de Ciencias, Universidad de Los Andes, Merida 5101A (Venezuela); e-mail: goncor@ula.ve

    2003-07-01

    An Fe-Co-Mn catalysts series after hydrogenation of carbon monoxide has been characterized. The XRD analysis shows the magnetite as main crystalline phase after reaction, in addition of carbon and carbide phases. All these phases lead to hydrogen consumption and oxidation rate changes on Fe-Co-Mn catalysts. A phase transformation superficial diagram is analysed. (Author)

  6. Ni Catalysts Supported on Modified Alumina for Diesel Steam Reforming

    Directory of Open Access Journals (Sweden)

    Antonios Tribalis

    2016-01-01

    Full Text Available Nickel catalysts are the most popular for steam reforming, however, they have a number of drawbacks, such as high propensity toward coke formation and intolerance to sulfur. In an effort to improve their behavior, a series of Ni-catalysts supported on pure and La-, Ba-, (La+Ba- and Ce-doped γ-alumina has been prepared. The doped supports and the catalysts have been extensively characterized. The catalysts performance was evaluated for steam reforming of n-hexadecane pure or doped with dibenzothiophene as surrogate for sulphur-free or commercial diesel, respectively. The undoped catalyst lost its activity after 1.5 h on stream. Doping of the support with La improved the initial catalyst activity. However, this catalyst was completely deactivated after 2 h on stream. Doping with Ba or La+Ba improved the stability of the catalysts. This improvement is attributed to the increase of the dispersion of the nickel phase, the decrease of the support acidity and the increase of Ni-phase reducibility. The best catalyst of the series doped with La+Ba proved to be sulphur tolerant and stable for more than 160 h on stream. Doping of the support with Ce also improved the catalytic performance of the corresponding catalyst, but more work is needed to explain this behavior.

  7. Functionalized SBA-15 supported nickel (II)–oxime–imine catalysts for liquid phase oxidation of olefins under solvent-free conditions

    Energy Technology Data Exchange (ETDEWEB)

    Paul, Luna [Department of Chemistry, Jadavpur University, Kolkata 700 032 (India); Banerjee, Biplab [Department of Materials Science, Indian Association for the Cultivation of Science, Jadavpur, Kolkata 700 032 (India); Bhaumik, Asim, E-mail: msab@iacs.res.in [Department of Materials Science, Indian Association for the Cultivation of Science, Jadavpur, Kolkata 700 032 (India); Ali, Mahammad, E-mail: m_ali2062@yahoo.com [Department of Chemistry, Jadavpur University, Kolkata 700 032 (India)

    2016-05-15

    A new oxime–imine functionalized highly ordered mesoporous SBA-15 (SBA-15-NH{sub 2}-DAMO) has been synthesized via post-synthesis functionalization of SBA-15 with 3-aminopropyl-triethoxysilane followed by the Schiff base condensation with diacetylmonooxime, which was further reacted with Ni(ClO{sub 4}){sub 2} to yield the functionalized nickel catalyst SBA-15-NH{sub 2}-DAMO-Ni. All the synthesized materials were thoroughly characterized using different characterization techniques. It was found that SBA-15-NH{sub 2}-DAMO-Ni catalyzes the one-pot oxidation of olefins like styrene, cyclohexene, cyclooctene, 1-hexene and 1-octene to the corresponding benzaldehyde, cyclohexene-1-ol and cyclooctene-oxide, respectively under solvent-free conditions by using tert-butylhydroperoxide as oxidant. - Graphical abstract: A new well characterized oxime–imine functionalized highly ordered mesoporous SBA-15-NH{sub 2}-DAMO-Ni complex catalyzes the one-pot oxidation of olefins under solvent free mild conditions.

  8. The capacity of modified nickel catalysts derived from discharged catalyst of fertilizer plants for NOx treatment

    Science.gov (United States)

    Ha, T. M. P.; Luong, N. T.; Le, P. N.

    2016-11-01

    In Vietnam for recent years, a large amount of hazardous waste containing nickel (Ni) derived from discharged catalyst of fertilizer plants has caused environmental problems in landfill overloading and the risk of soil or surface water sources pollution. Taking advantage of discharged catalyst, recycling Ni components and then synthesizing new catalysts apply for mono-nitrogen oxides (NOx) treatments is an approach to bring about both economic and environmental benefits. This study was carried out with the main objective: Evaluate the performance of modified catalysts (using recovered Ni from the discharged RKS-2-7H catalyst of Phu My Fertilizer Plant) on NOx treatment. The catalysts was synthesized and modified with active phases consist of recovered Ni and commercial Barium oxide (BaO), Manganese dioxide (MnO2) / Cerium (IV) oxide (CeO2) on the support Aluminium oxide (γ-Al2O3). The results show that the modified catalysts with Ni, Ba, Ce was not more beneficial for NOx removal than which with Ni, Ba, Mn. 98% NOx removal at 350°C with the start temperature at 115°C and the T60 value at 307°C can be obtained with 10Ni10Ba10Mn/Al catalyst.

  9. Identification of a Secondary Crystallized Phase formed during Nuclear Glasses Leaching - Effect of the Leached Glass Composition

    Science.gov (United States)

    Thien, Bruno; Godon, Nicole; Frugier, Pierre; Gin, Stéphane; Ayral, André

    2010-05-01

    Silicate glass leaching in a unrenewed aqueous solution leads to gel formation at the glass water interface. This amorphous hydrated layer sometimes behaves like a diffusion barrier: the glass alteration rate decreases according to an inverse square root of time equation. In the case of Mg-containing glasses, the alteration rate usually remains quasi constant and seems to be controlled by the growth of secondary crystallized phases. These phases consume elements from solution. They can sustain gel dissolution inducing a decrease of its passivating properties. Long-term behaviour modelling of Mg-containing glasses designed for the confinement of fission products (AVM glasses, Atelier de vitrification de Marcoule, France) first requires a precise identification of these Mg-rich phases. Experimental investigations were performed on several glass samples using X-ray diffraction (XRD), 27Al and 29Si MAS NMR and elemental chemical analysis. Aluminous hectorite Na0.45(Mg2.28Li0.11Al0.39Fe0.06M0.16)(Si3.21Al0.79)O10(OH)2, with M being a divalent cation, was identified. 25 glasses were required for a full representation in term variations of AVM glasses composition range. Their residual alteration rates were proved to significantly depend on glass composition since a one order of magnitude difference was measured between the less and the most altered glasses. Nevertheless, the same crystallized phase was evidenced whatever the glass composition and whatever the initial composition of the solution (pure water or Mg-rich groundwater). Only a shift of the (060) peak between 1.521 and 1.530 Å was evidenced. It can be attributed to slight composition variations. Relations between the glass magnesium fraction, the amount of precipitated hectorite, the residual rate, and the measured pH are not obvious. However, hectorite precipitation was proved to depend on pH, being favoured between pH50°C 9 and 9.5. Moreover, the higher the amount of precipitated hectorite, the lower the

  10. Identification of transcription factors potentially involved in the juvenile to adult phase transition in Citrus.

    Science.gov (United States)

    Castillo, Mari-Cruz; Forment, Javier; Gadea, José; Carrasco, Jose Luis; Juarez, José; Navarro, Luís; Ancillo, Gema

    2013-11-01

    The juvenile to adult transition (JAT) in higher plants is required for them to reach reproductive competence. However, it is a poorly understood process in woody plants, where only a few genes have been definitely identified as being involved in this transition. This work aims at increasing our understanding of the mechanisms regulating the JAT in citrus. Juvenile and adult plants from Pineapple sweet orange (Citrus sinensis) and Rough lemon (C. jambhiri) were used to screen for differentially expressed transcription factors (TFs) using a 1·15K microarray developed on the basis of the CitrusTF database. Murcott tangor (C. reticulata × C. sinensis) and Duncan grapefruit (C. paradisi) were incorporated into the quantitative real-time reverse transcription-PCR validation in order to select those genes whose phase-specific regulation was common to the four species. A browsable web database has been created with information about the structural and functional annotation related to 1152 unigenes of putative citrus TFs (CTFs). This database constitutes a valuable resource for research on transcriptional regulation and comparative genomics. Moreover, a microarray has been developed and used that contains these putative CTFs, in order to identify eight genes that showed differential expression in juvenile and adult meristems of four different species of citrus. Those genes have been characterized, and their expression pattern in vegetative and reproductive tissues has been analysed. Four of them are MADS-box genes, a family of TFs involved in developmental processes, whereas another one resembles MADS-box genes but lacks the MADS box itself. The other three showed high partial sequence similarity restricted to specific Arabidopsis protein domains but negligible outside those domains. The work presented here indicates that the JAT in citrus could be controlled by mechanisms that are in part common to those of Arabidopsis, but also somehow different, since specific factors

  11. IDENTIFICATION OF THE MASS DISTRIBUTIONS OF THE MILK FAT PHASE USING UNIVERSAL PEARSON DISTRIBUTIONS

    Directory of Open Access Journals (Sweden)

    A. A. Khvostov

    2015-01-01

    Full Text Available In this paper we consider the problem of approximating the experimental values of the coefficient of attenuation of ultrasonic oscillations and the mass distribution of the fat globules in the milk and milk products. The analysis of experimental data in terms of the choice of the method of approximation was done. A approximating dependence is based on the solution of Pearson differential equations. The advantages of the proposed method for the type of approximation of the experimental data obtained. An algorithm for constructing a mathematical model describing the relaxation spectrum and mass distribution of the fat globules in the milk and milk products was implemented. As a result, a family of Pearson approximation curves of the experimental data shows the ability to qualitatively correctly describe the change in the distribution of the fat phase in the process of homogenization. It estimates the error of approximating dependence, which amounted to 18 %. It is shown that during of the process of homogenization of dairy products changes shape of the curve describing the distribution of the fat globules, in view of the fact that there is a local extremum, caused by the presence of the non-homogenized fat globules. The accuracy of the selected mathematical model is significantly reduced. At the same time, it loses its physical meaning and its parameters. To address the identified deviations in the proposed mass distribution of fat globules as a function with two modes. It is proved that the complexity of the model is not only doubles the number of its parameters, but also complicates the interpretation of measurement results in a control system, and makes it difficult to analyze the obtained parameters of approximation by decision-maker. As a result of approximation of experimental data suggested to use statistical moments of the distribution for problem decision.

  12. Catalyst Alloys Processing

    Science.gov (United States)

    Tan, Xincai

    2014-10-01

    Catalysts are one of the key materials used for diamond formation at high pressures. Several such catalyst products have been developed and applied in China and around the world. The catalyst alloy most widely used in China is Ni70Mn25Co5 developed at Changsha Research Institute of Mining and Metallurgy. In this article, detailed techniques for manufacturing such a typical catalyst alloy will be reviewed. The characteristics of the alloy will be described. Detailed processing of the alloy will be presented, including remelting and casting, hot rolling, annealing, surface treatment, cold rolling, blanking, finishing, packaging, and waste treatment. An example use of the catalyst alloy will also be given. Industrial experience shows that for the catalyst alloy products, a vacuum induction remelt furnace can be used for remelting, a metal mold can be used for casting, hot and cold rolling can be used for forming, and acid pickling can be used for metal surface cleaning.

  13. Identification and quantification of organic pollutants in the air of the city of Astana using solid phase microextraction

    Directory of Open Access Journals (Sweden)

    Dina Orazbayeva

    2017-06-01

    Full Text Available Solid-phase microextraction in combination with gas chromatography and mass-spectrometry (GC-MS was used for determination of benzene, toluene, ethylbenzene and o-xylene (BTEX, polycyclic aromatic hydrocarbons (PAH, and for identification of volatile organic compounds (VOCs in ambient air of the city of Astana, Kazakhstan. The screening of the samples showed the presence of mono- and polycyclic aromatic hydrocarbons, alkanes, alkenes, phenols, and benzaldehydes. The concentrations of naphthalene were 5-7 times higher than the permissible value, it was detected in all studied air samples. Average concentration of naphthalene was 18.4 μg/m3, acenaphthylene – 0.54 μg/m3, acenaphthene – 1.63 μg/m3, fluorene – 0.79 μg/m3, anthracene – 3.27 μg/m3, phenanthrene – 0.22 μg/m3, fluorantene – 0.74 μg/m3, pyrene – 0.73 μg/m3. Average concentrations of BTEX in the studied samples were 31.1, 84.9, 10.8 and 11.6 μg/m3, respectively. Based on the statistical analysis of the concentrations of BTEX and PAH, the main source of city air pollution with them was assumed to be vehicle emissions.

  14. 40 CFR 90.329 - Catalyst thermal stress test.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 20 2010-07-01 2010-07-01 false Catalyst thermal stress test. 90.329... Equipment Provisions § 90.329 Catalyst thermal stress test. (a) Oven characteristics. The oven used for... thermal stress test is not required for engine families certified to the Phase 2 standards....

  15. An attempt to selectively oxidize methane over supported gold catalysts

    NARCIS (Netherlands)

    Hereijgers, B.P.C.; Weckhuysen, B.M.

    2011-01-01

    The potential of supported gold catalysts for the selective gas-phase oxidation of methane to methanol with molecular oxygen was investigated. A broad range of supported gold-based catalyst materials was synthesized using reducible and non-reducible support materials. Although the formation of small

  16. Raney copper catalysts for the water-gas shift reaction - II. Initial catalyst optimisation

    CSIR Research Space (South Africa)

    Mellor, JR

    1997-12-23

    Full Text Available -Zn-A1 catalyst. During the controlled passivation Table 2 Crystalline phase of alloys B, C and D and their product Raney copper catalysts before and after reaction Alloy Precursor alloy phases Cat. phases before reaction a Cat. phases after reaction a... L; dry gas composition=10% CO/90% N2; CO : H20=I : 22.5; catalyst volume=2i0.1 ml): (O)=Cat. A Cu(69.3)Zn(6.9)Al( 19.5); (~)=cat. B Cu(73.6)Zn(10.9)AI(14.8); (W1)=cat. C Cu(72.4)Zn(13.3)Al(12.9); ({))=cat. D Cu(61.5)Zn(15.1)AI(19.1). It can...

  17. Resin Catalyst Hybrids

    Institute of Scientific and Technical Information of China (English)

    S. Asaoka

    2005-01-01

    @@ 1Introduction: What are resin catalyst hybrids? There are typically two types of resin catalyst. One is acidic resin which representative is polystyrene sulfonic acid. The other is basic resin which is availed as metal complex support. The objective items of this study on resin catalyst are consisting of pellet hybrid, equilibrium hybrid and function hybrid of acid and base,as shown in Fig. 1[1-5].

  18. Three-dimensional electron diffraction as a complementary technique to powder X-ray diffraction for phase identification and structure solution of powders

    Directory of Open Access Journals (Sweden)

    Yifeng Yun

    2015-03-01

    Full Text Available Phase identification and structure determination are important and widely used techniques in chemistry, physics and materials science. Recently, two methods for automated three-dimensional electron diffraction (ED data collection, namely automated diffraction tomography (ADT and rotation electron diffraction (RED, have been developed. Compared with X-ray diffraction (XRD and two-dimensional zonal ED, three-dimensional ED methods have many advantages in identifying phases and determining unknown structures. Almost complete three-dimensional ED data can be collected using the ADT and RED methods. Since each ED pattern is usually measured off the zone axes by three-dimensional ED methods, dynamic effects are much reduced compared with zonal ED patterns. Data collection is easy and fast, and can start at any arbitrary orientation of the crystal, which facilitates automation. Three-dimensional ED is a powerful technique for structure identification and structure solution from individual nano- or micron-sized particles, while powder X-ray diffraction (PXRD provides information from all phases present in a sample. ED suffers from dynamic scattering, while PXRD data are kinematic. Three-dimensional ED methods and PXRD are complementary and their combinations are promising for studying multiphase samples and complicated crystal structures. Here, two three-dimensional ED methods, ADT and RED, are described. Examples are given of combinations of three-dimensional ED methods and PXRD for phase identification and structure determination over a large number of different materials, from Ni–Se–O–Cl crystals, zeolites, germanates, metal–organic frameworks and organic compounds to intermetallics with modulated structures. It is shown that three-dimensional ED is now as feasible as X-ray diffraction for phase identification and structure solution, but still needs further development in order to be as accurate as X-ray diffraction. It is expected that three

  19. Three-dimensional electron diffraction as a complementary technique to powder X-ray diffraction for phase identification and structure solution of powders

    Science.gov (United States)

    Yun, Yifeng; Zou, Xiaodong; Hovmöller, Sven; Wan, Wei

    2015-01-01

    Phase identification and structure determination are important and widely used techniques in chemistry, physics and materials science. Recently, two methods for automated three-dimensional electron diffraction (ED) data collection, namely automated diffraction tomography (ADT) and rotation electron diffraction (RED), have been developed. Compared with X-ray diffraction (XRD) and two-dimensional zonal ED, three-dimensional ED methods have many advantages in identifying phases and determining unknown structures. Almost complete three-dimensional ED data can be collected using the ADT and RED methods. Since each ED pattern is usually measured off the zone axes by three-dimensional ED methods, dynamic effects are much reduced compared with zonal ED patterns. Data collection is easy and fast, and can start at any arbitrary orientation of the crystal, which facilitates automation. Three-dimensional ED is a powerful technique for structure identification and structure solution from individual nano- or micron-sized particles, while powder X-ray diffraction (PXRD) provides information from all phases present in a sample. ED suffers from dynamic scattering, while PXRD data are kinematic. Three-dimensional ED methods and PXRD are complementary and their combinations are promising for studying multiphase samples and complicated crystal structures. Here, two three-dimensional ED methods, ADT and RED, are described. Examples are given of combinations of three-dimensional ED methods and PXRD for phase identification and structure determination over a large number of different materials, from Ni–Se–O–Cl crystals, zeolites, germanates, metal–organic frameworks and organic compounds to intermetallics with modulated structures. It is shown that three-dimensional ED is now as feasible as X-ray diffraction for phase identification and structure solution, but still needs further development in order to be as accurate as X-ray diffraction. It is expected that three-dimensional ED

  20. Thermal decomposition of phase-stabilised ammonium nitrate (PSAM), HTPB based propellants. The effect of iron(III)oxide burning-rate catalyst

    NARCIS (Netherlands)

    Carvalheira, P.; Gadiot, G.M.H.J.L.; Klerk, W.P.C. de

    1995-01-01

    Phase-stabilised ammonium nitrate (PSAN) and hydroxyl-terminated polybutadiene (HTPB) are the main ingredients of propellants used with success in some pyrotechnic igniter components of the VULCAIN liquid rocket engine for the ARIANE 5. Small amounts of selected additives play an important role in s

  1. Au/MO2N as a new catalyst formulation for the hydrogenation of p-chloronitrobenzene in both liquid and gas phases

    NARCIS (Netherlands)

    Cárdenas-Lizana, F.; Lamey, D.; Perret, N.; Gómez-Quero, S.; Kiwi-Minsker, L.; Keane, M.A.

    2012-01-01

    The batch liquid phase hydrogenation of p-chloronitrobenzene over MO2N resulted in the sole formation of p-chloroaniline. Incorporation of Au nanoparticles (mean size = 8 nm) enhanced hydrogen uptake with a fourfold increase in rate, retention of ultraselectivity with stability over repeated reactio

  2. Induced Voltages Ratio-Based Algorithm for Fault Detection, and Faulted Phase and Winding Identification of a Three-Winding Power Transformer

    Directory of Open Access Journals (Sweden)

    Byung Eun Lee

    2014-09-01

    Full Text Available This paper proposes an algorithm for fault detection, faulted phase and winding identification of a three-winding power transformer based on the induced voltages in the electrical power system. The ratio of the induced voltages of the primary-secondary, primary-tertiary and secondary-tertiary windings is the same as the corresponding turns ratio during normal operating conditions, magnetic inrush, and over-excitation. It differs from the turns ratio during an internal fault. For a single phase and a three-phase power transformer with wye-connected windings, the induced voltages of each pair of windings are estimated. For a three-phase power transformer with delta-connected windings, the induced voltage differences are estimated to use the line currents, because the delta winding currents are practically unavailable. Six detectors are suggested for fault detection. An additional three detectors and a rule for faulted phase and winding identification are presented as well. The proposed algorithm can not only detect an internal fault, but also identify the faulted phase and winding of a three-winding power transformer. The various test results with Electromagnetic Transients Program (EMTP-generated data show that the proposed algorithm successfully discriminates internal faults from normal operating conditions including magnetic inrush and over-excitation. This paper concludes by implementing the algorithm into a prototype relay based on a digital signal processor.

  3. 固体单相催化剂CVD法制备成束或分散MWCNT%Solid Single Phase Catalyst for Growth of Bundled or Dispersed MWCNT by CVD

    Institute of Scientific and Technical Information of China (English)

    徐军明; 张孝彬; 李昱; 陶新永; 陈飞; 杨晓芳

    2003-01-01

    Fe-Mo-Mg-O catalyst prepared by combustion method has great efficiency to grow carbon nanotubes with CVD method. Through investigation of TEM, it is found that bundles of multi-wall carbon nanotubos (MWCNT) can be got when the catalyst is directly used to synthesize the product in CH4/H2 afinosphere; however, the dispersed carbon nanotubes are obtained while the catalyst is reduced firstly in the H2 before the synthesis. The morphology and structure of the catalysts before and after reduced are analyzed by TEM and XRD. The growth mechanism is suggeested for the formation off these two kinds of carbon nanotubes.

  4. Surface Chemistry and Properties of Oxides as Catalyst Supports

    Energy Technology Data Exchange (ETDEWEB)

    DeBusk, Melanie Moses [ORNL; Narula, Chaitanya Kumar [ORNL; Contescu, Cristian I [ORNL

    2015-01-01

    Heterogeneous catalysis relies on metal-oxides as supports for the catalysts. Catalyst supports are an indispensable component of most heterogeneous catalysts, but the role of the support is often minimized in light of the one played by the catalytically active species it supports. The active species of supported catalysts are located on the surface of the support where their contact with liquid or gas phase reactants will be greatest. Considering that support plays a major role in distribution and stability of active species, the absorption and retention of reactive species, and in some cases in catalytic reaction, the properties and chemistry that can occur at the surface of an oxide support are important for understanding their impact on the activity of a supported catalyst. This chapter examines this rich surface chemistry and properties of oxides used as catalyst supports, and explores the influence of their interaction with the active species.

  5. Structure and Catalytic Activity of Polymer-Supported Polyethylene Glycol and Onium Phase Transfer Catalyst%聚合物固载化聚乙二醇季铵盐型相转移催化剂的结构与催化活性

    Institute of Scientific and Technical Information of China (English)

    李顺子; 冯鸣华; 梁逊

    2001-01-01

    The gelatinous and macroporous phase-transfer c atalysts with multiple active centers were synthesized by means of quarterisatio n of PEG tertiary amine and chloromethylated St-DVB copolymer. They were examin ed as phase-transfer catalysts in the reaction of n-C8H17Br with s olid NaI. The experimental results showed that the reaction rate was first-orde r with respect to the concentration of n-C8H17Br. The effects of ca talyst structure on the catalytic activity were also investigated. The observed reaction rate constant (kobsd) increased as the degree of cross-linki ng of polymer decreased. Macroporous catalysts showed a higher activity (2~2.5 times) than that of microporous catalysts with the same degree of cross-linkin g of polymer, particle size and amount of supported PEG. Molecular weight of PEG also showed much influence on kobsd. As molecular weight of PEG rose properly, the catalysts showed a higher activity. The results were discussed fro m the aspect of triphase catalysis reaction mechanism.

  6. External Catalyst Breakup Phenomena

    Science.gov (United States)

    1976-06-01

    14-18 Mesh Catalyst 127 4-12 Hot Gas Thermal Fatigue Test Results for 25-30 Mesh Catalyst 128 4-13 Hot Gas Thermal Aging Test Results 131 - 19 - LISI ...magnitude of the thermal and internal pressure solution3, These solucions siu- Li.L fti’r oir =ztcrii ad the pressure and temperature profiles of

  7. Catalyst for Ammonia Oxidation

    DEFF Research Database (Denmark)

    2015-01-01

    The present invention relates to a bimetallic catalyst for ammonia oxidation, a method for producing a bimetallic catalyst for ammonia oxidation and a method for tuning the catalytic activity of a transition metal. By depositing an overlayer of less catalytic active metal onto a more catalytic...

  8. Reducible oxide based catalysts

    Science.gov (United States)

    Thompson, Levi T.; Kim, Chang Hwan; Bej, Shyamal K.

    2010-04-06

    A catalyst is disclosed herein. The catalyst includes a reducible oxide support and at least one noble metal fixed on the reducible oxide support. The noble metal(s) is loaded on the support at a substantially constant temperature and pH.

  9. Alloy catalyst material

    DEFF Research Database (Denmark)

    2014-01-01

    The present invention relates to a novel alloy catalyst material for use in the synthesis of hydrogen peroxide from oxygen and hydrogen, or from oxygen and water. The present invention also relates to a cathode and an electrochemical cell comprising the novel catalyst material, and the process use...

  10. Computerized identification and classification of stance phases as made by front or hind feet of walking cows based on 3-dimensional ground reaction forces

    DEFF Research Database (Denmark)

    Skjøth, Flemming; Thorup, V. M.; do Nascimento, Omar Feix

    2013-01-01

    Lameness is a frequent disorder in dairy cows and in large dairy herds manual lameness detection is a time-consuming task. This study describes a method for automatic identification of stance phases in walking cows, and their classification as made by a front or a hind foot based on ground reaction...... force information. Features were derived from measurements made using two parallel 3-dimensional force plates. The approach presented is based on clustering of Centre of Pressure (COP) trace points over space and time, combined with logical sequencing of stance phases based on the dynamics...

  11. DNA microarray-based solid-phase RT-PCR for rapid detection and identification of influenza virus type A and subtypes H5 and H7

    DEFF Research Database (Denmark)

    Yi, Sun; Dhumpa, Raghuram; Bang, Dang Duong

    2011-01-01

    Endemic of avian influenza virus (AIV) in Asia and epizootics in some European regions have caused considerable public concern on a possible pandemic of AIV. A rapid method for virus detection and effective surveillance in wild avian, poultry production as well as in humans is required....... In this article, a DNA microarray-based solid-phase polymerase chain reaction (PCR) approach has been developed for rapid detection of influenza virus type A and for simultaneous identification of pathogenic virus subtypes H5 and H7. This solid-phase RT-PCR method combined reverse-transcription amplification...

  12. Overview of Support Effects in Hydrotreating Catalysts

    Institute of Scientific and Technical Information of China (English)

    Michèle Breysse

    2004-01-01

    @@ Industrial hydrotreating (HDT) catalysts are composed of a molybdenum sulfide (or tungsten sulfide) phase promoted by cobalt or nickel and usually supported on alumina. The origin of the almost exclu1sive use of alumina as support has to be ascribed to its outstanding textural and mechanical properties and its relatively low cost[1].

  13. Magnetic properties, microstructure and mineralogical phases of technogenic magnetic particles (TMPs) in urban soils: Their source identification and environmental implications

    Energy Technology Data Exchange (ETDEWEB)

    Lu, Shenggao, E-mail: lusg@zju.edu.cn [College of Environmental and Resource Sciences, Zhejiang University, Hangzhou 310058 (China); Yu, Xiuling [College of Environmental and Resource Sciences, Zhejiang University, Hangzhou 310058 (China); Chen, Yuyin [Institute of Biological Resources, Zhejiang University, Hangzhou 310058 (China)

    2016-02-01

    Magnetic measurement is an effective method to determine spatial distribution and the degree of heavy metal pollution and to identify various anthropogenic sources of heavy metals. The objectives of this investigation are to characterize the magnetic properties, microstructure and mineralogical phases of technogenic magnetic particles (TMPs) in urban soils and to discuss their potential environmental implications. The TMPs are separated from the urban topsoils of Luoyang city, China. The magnetic properties, morphology, and mineral phase of TMPs are studied using mineral magnetic measurement, scanning electron microscopy equipped with energy-dispersive X-ray spectroscopy (SEM/EDS), X-ray diffraction, and synchrotron–radiation-based microprobe. The content of TMPs in urban topsoils ranges from 0.05 to 1.95% (on average 0.32%). The magnetic susceptibility of TMPs ranges from 4559 × 10{sup −8} to 23,661 × 10{sup −8} m{sup 3} kg{sup −1} (on average 13,637 × 10{sup −8} m{sup 3} kg{sup −1}). Thermomagnetic and bulk X-ray diffraction analyses indicate that main magnetic minerals of TMPs are magnetite (Fe{sub 3}O{sub 4}) and hematite (α-Fe{sub 2}O{sub 3}). The morphology of TMPs observed by SEM includes three shape types: spherule, irregular-shaped, and aggregate particles. The size of spherical TMPs ranges from 30 to about 200 μm, with the largest percentage of 30–50 μm. Synchrotron–radiation-based microprobe (μ-XRF and μ-XRD) indicates that TMPs are enriched with heavy metals Pb, Cd, Zn, Cu, and Cr, which are incorporated into lattice or adsorbed on the surface of magnetite/hematite. The content of TMPs significantly relates with the Tomlinson Pollution Load Index (PLI) (R{sup 2} = 0.467), suggesting that it can be used as proxy indicator of degree of heavy metal contamination in urban soils. The magnetic properties, microstructure and mineralogical phases of TMPs can serve as the identification of pollution sources in urban soils. - Graphical

  14. A HYDROGEN BONDING ASSISTED CATALYST SCREENED OUT VIA COMBINATORIAL CHEMISTRY STRATEGY

    Institute of Scientific and Technical Information of China (English)

    XUMancai; OUZhize; 等

    2000-01-01

    Possibilities for enhancement of catalytic reaction rate by combining phase transfer catalysis and hydrogen bonding of the catalyst with the substrate and reagent were studied.A phase transfer catalyst library with sixty polystyrene-supported quaternary ammonium salt catalysts was synthesized.The reduction of acetophenone by NaBH4 was used as the probing reaction to select out the ost active catalyst in the library by using iterative method.which was the gel-type triethanolamine aminsating strongly asic anion exchange resin with the crosslinking degeree of 2% A hydrogen bonding assisted catalytic mechanism was proposed to explain the high catalytic activity of the catalyst.

  15. Research advances in the catalysts for the selective oxidation of ethane to aldehydes

    Institute of Scientific and Technical Information of China (English)

    ZHANG Zhe; ZHAO Zhen; XU Chunming

    2005-01-01

    Selective oxidation of ethane to aldehydes is one of the most difficult processes in the catalysis researches of low alkanes. The development of selective oxidation of ethane to aldehydes (formaldehyde, acetaldehyde and acrolein) is discussed. The latest progress of the catalysts, including bulk or supported metal oxide catalysts, highly dispersed and isolated active sites catalysts, and the photo-catalytic ethane oxidation catalysts, partial oxidation of ethane in the gas phase, and the proposed reaction pathways from ethane to aldehydes are involved.

  16. Hydrogen evolution from aqueous-phase photocatalytic reforming of ethylene glycol over Pt/TiO2 catalysts: Role of Pt and product distribution

    Science.gov (United States)

    Li, Fuying; Gu, Quan; Niu, Yu; Wang, Renzhang; Tong, Yuecong; Zhu, Shuying; Zhang, Hualei; Zhang, Zizhong; Wang, Xuxu

    2017-01-01

    Pt nanoparticles were loaded on anatase TiO2 by the photodeposition method to investigate their photocatalytic activity for H2 evolution in an aqueous solution containing a certain amount of ethylene glycol (EG) as the sacrificial agent. The surface properties and chemical states of the Pt/TiO2 sample were characterized by X-ray powder diffraction analysis, Brunauer-Emmett-Teller surface area analysis, transmission electron microscopy, X-ray photoelectron spectroscopy, electron paramagnetic resonance, and electrochemical resistance. The aqueous-phase photocatalytic EG reforming using Pt/TiO2 and anatase TiO2 generated not only H2 and CO2, but also CO, CH4, C2H6, and C2H4. Moreover, the amount of formate and acetate complexes in the solution increased gradually. The EG adsorption and gas-phase intermediates during photocatalytic reaction processes were investigated by the in situ FTIR spectrum. Finally, the photocatalytic EG reforming reaction mechanism was elucidated. This helped to better understand the role of a sacrificial agent in a photocatalytic hydrogen production.

  17. Co/ZnO and Ni/ZnO catalysts for hydrogen production by bioethanol steam reforming. Influence of ZnO support morphology on the catalytic properties of Co and Ni active phases

    Energy Technology Data Exchange (ETDEWEB)

    Da Costa-Serra, J.F.; Chica, A. [Instituto de Tecnolgia Quimica (UPV-CSIC), Universidad Politecnica de Valencia, Consejo Superior de Investigaciones Cientificas, Avenida de los naranjos s/n, 46022 Valencia (Spain); Guil-Lopez, R. [Instituto de Catalisis y Petroleoquimica, CSIC, Marie Curie 2, Cantoblanco, 28049 Madrid (Spain)

    2010-07-15

    Renewable hydrogen production from steam reforming of bioethanol is an interesting approach to produce sustainable hydrogen. However, simultaneous competitive reactions can occur, decreasing the hydrogen production yield. To overcome this problem, modifications in the steam reforming catalysts are being studied. Ni and Co active phases supported over modified ZnO have been widely studied in hydrogen production from steam reforming of bioethanol. However, the influence of the morphology and particle size of ZnO supports on the catalytic behaviour of the supported Ni and Co has not been reported. In the present work, we show how the morphology, shape, and size of ZnO support particles can control the impregnation process of the metal active centres, which manages the properties of active metallic particles. It has been found that nanorod particles of ZnO, obtained by calcination of Zn acetate, favour the metal-support interactions, decreasing the metallic particle sizes and avoiding metal (Co or Ni) sinterization during the calcination of metal precursors. Small metallic particle sizes lead to high values of active metal exposure surface, increasing the bioethanol conversion and hydrogen production. (author)

  18. Asymmetric Synthesis of Mixed Metal Clusters Induced by Phase-transfer Catalysts%光学活性四面体过渡金属簇合物的诱导合成

    Institute of Scientific and Technical Information of China (English)

    张玉华; 吴树林; 李庆山; 殷元骐

    2001-01-01

    报导了用手性季铵盐诱导合成SFeCoMo等手性四面体过渡金属簇合物的新方法. 发现, 苄基辛可宁对四面体簇的合成有手性诱导作用; 在不同溶剂中, 手性簇产物的绝对构型不同, 而且含钌簇的旋光度比含铁簇的旋光度小.%Three series of chiral metal clusters induced by two kinds of phase-transfer catalysts have been synthesized. Benzyl cinchonium chloride is active to all kinds of metal clusters under all sorts of conditions. Ether is found to be the most suitable solvent, and the enantiomer obtained is different if the synthesis was proceeded in different solvents. Unfortunately, the e.e. value was not obtained, so only some tentative conclusions were postulated.

  19. Catalysts, methods of making catalysts, and methods of use

    KAUST Repository

    Renard, Laetitia

    2014-03-06

    Embodiments of the present disclosure provide for catalysts, methods of making catalysts, methods of using catalysts, and the like. In an embodiment, the method of making the catalysts can be performed in a single step with a metal nanoparticle precursor and a metal oxide precursor, where a separate stabilizing agent is not needed.

  20. Technology development for iron Fischer-Tropsch catalysts

    Energy Technology Data Exchange (ETDEWEB)

    O`Brien, R.J.; Raje, A.; Keogh, R.A. [and others

    1995-12-31

    The objective of this research project is to develop the technology for the production of physically robust iron-based Fischer-Tropsch catalysts that have suitable activity, selectivity and stability to be used in the slurry phase synthesis reactor development. The catalysts that are developed shall be suitable for testing in the Advanced Fuels Development Facility at LaPorte, Texas, to produce either low-or high-alpha product distributions. Previous work by the offeror has produced a catalyst formulation that is 1.5 times as active as the {open_quotes}standard-catalyst{close_quotes} developed by German workers for slurry phase synthesis. In parallel, work will be conducted to design a high-alpha iron catalyst this is suitable for slurry phase synthesis. Studies will be conducted to define the chemical phases present at various stages of the pretreatment and synthesis stages and to define the course of these changes. The oxidation/reduction cycles that are anticipated to occur in large, commercial reactors will be studied at the laboratory scale. Catalyst performance will be determined for catalysts synthesized in this program for activity, selectivity and aging characteristics.

  1. Crotonaldehyde hydrogenation on Rh supported catalysts

    OpenAIRE

    Reyes, P; Aguirre, Mª del Carmen; Pecchi, Gina; García Fierro, José Luis

    2000-01-01

    The vapor-phase hydrogenation of crotonaldehyde on Rh supported catalysts has been studied. The effect of some variables of preparation in catalysts prepared by the sol-gel and impregnation methods on the surface and catalytic properties were analyzed. It was found, that the porosity of the support has a small effect on the selectivity to the unsaturated alcohol and the presence of partially reducible supports such as ZrO2 and TiO2, may increase the selectivity to crotyl alcohol via an enhanc...

  2. Catalyst in Basic Oleochemicals

    Directory of Open Access Journals (Sweden)

    Eva Suyenty

    2007-10-01

    Full Text Available Currently Indonesia is the world largest palm oil producer with production volume reaching 16 million tones per annum. The high crude oil and ethylene prices in the last 3 – 4 years contribute to the healthy demand growth for basic oleochemicals: fatty acids and fatty alcohols. Oleochemicals are starting to replace crude oil derived products in various applications. As widely practiced in petrochemical industry, catalyst plays a very important role in the production of basic oleochemicals. Catalytic reactions are abound in the production of oleochemicals: Nickel based catalysts are used in the hydrogenation of unsaturated fatty acids; sodium methylate catalyst in the transesterification of triglycerides; sulfonic based polystyrene resin catalyst in esterification of fatty acids; and copper chromite/copper zinc catalyst in the high pressure hydrogenation of methyl esters or fatty acids to produce fatty alcohols. To maintain long catalyst life, it is crucial to ensure the absence of catalyst poisons and inhibitors in the feed. The preparation methods of nickel and copper chromite catalysts are as follows: precipitation, filtration, drying, and calcinations. Sodium methylate is derived from direct reaction of sodium metal and methanol under inert gas. The sulfonic based polystyrene resin is derived from sulfonation of polystyrene crosslinked with di-vinyl-benzene. © 2007 BCREC UNDIP. All rights reserved.[Presented at Symposium and Congress of MKICS 2007, 18-19 April 2007, Semarang, Indonesia][How to Cite: E. Suyenty, H. Sentosa, M. Agustine, S. Anwar, A. Lie, E. Sutanto. (2007. Catalyst in Basic Oleochemicals. Bulletin of Chemical Reaction Engineering and Catalysis, 2 (2-3: 22-31.  doi:10.9767/bcrec.2.2-3.6.22-31][How to Link/DOI: http://dx.doi.org/10.9767/bcrec.2.2-3.6.22-31 || or local: http://ejournal.undip.ac.id/index.php/bcrec/article/view/6

  3. 气相氟化四氯乙烯的ZnF_2/Al_2O_3催化剂%Study on ZnF_2/Al_2O_3 catalysts for the vapor phase hydrofluorination of tetrachloroethylene

    Institute of Scientific and Technical Information of China (English)

    程永香; 谢遵运; 彭小波; 罗孟飞

    2012-01-01

    ZnF2/Al2O3 catalysts were prepared by an impregnation method.The effect of the Al2O3 support calcination temperature on catalytic performance for the vapor phase hydrofluorination of tetrachloroethylene was studied.The catalysts were characterized by XRD,Raman,NH3-TPD and BET techniques.The results show that-Al2O3 started to transform to-Al2O3 and α-Al2O3 at 900 ℃.-Al2O3 reaches to its maximum at 1100℃.By further increasing the calcination temperature,all-Al2O3 transformed to α-Al2O3.The highest activity was obtained on a ZnF2/Al2O3 catalyst with the Al2O3 support calcined at 1110 ℃.The conversion of tetrachloroethylene was 45.7% and the selectivity to HCFC-123(2,2-dichloro-1,1,1-three ethyl fluoride) and HCFC-124(2-chloro-1,1,1,2-tetrafluoroethane) was 48.2% at a reaction temperature of 300 ℃.%采用浸渍法制备了ZnO/Al2O3催化剂,考察了载体Al2O3的焙烧温度对催化剂性能的影响。并对催化剂进行了X射线衍射(XRD)、Raman光谱、氨气程序升温脱附(NH3-TPD)和BET表征。结果表明:随着Al2O3焙烧温度升高,从900℃开始,-Al2O3逐渐向-Al2O3和α-Al2O3转变,1100℃焙烧样品中-Al2O3的XRD峰强度达到最大。当温度继续升高,-Al2O3将转变成α-Al2O3。Al2O3载体经过1100℃焙烧制得的ZnF2/Al2O3催化剂催化性能最高,当反应温度为300℃时,四氯乙烯的转化率为45.7%,HCFC-123(2,2-二氯-1,1,1-三氟乙烷)和HCFC-124(2-氯-1,1,1,2-四氟乙烷)的总选择性为48.2%。

  4. ALKALI RESISTANT CATALYST

    DEFF Research Database (Denmark)

    2008-01-01

    The present invention concerns the selective removal of nitrogen oxides (NOx) from gasses. In particular, the invention concerns a process, a catalyst and the use of a catalyst for the selective removal of nitrogen oxides in the presence of ammonia from gases containing a significant amount...... of alkali metal and/or alkali-earth compounds which process comprises using a catalyst combined of (i) a formed porous superacidic support, said superacidic support having an Hammett acidity stronger than Ho=-12, and (ii) a metal oxide catalytic component deposited on said superacidic support selected from...

  5. Preparation of biodiesel from soybean oil by using heterogeneous catalyst

    Directory of Open Access Journals (Sweden)

    Kaniz Ferdous, M. Rakib Uddin, Maksudur R. Khan, M. A. Islam

    2013-01-01

    Full Text Available The predicted shortage of fossil fuels and related environmental concerns has recently attracted significant attention to search alternative fuel. Biodiesel is one of the alternatives to fossil fuel. Now-a-days, most biodiesel is produced by the transesterification of oils using methanol and a homogeneous base catalyst. The use of homogeneous catalysts is normally limited to batch mode processing followed by a catalyst separation step. The immiscible glycerol phase, which accumulates during the course of the reaction, solubilizes the homogeneous base catalyst and therefore, withdraws from the reaction medium. Moreover, other difficulties of using homogeneous base catalysts relate to their sensitivity to free fatty acid (FFA and water and resulting saponification phenomenon. High energy consumption and costly separation of the catalyst from the reaction mixture have inspired the use of heterogeneous catalyst. The use of heterogeneous catalysts does not lead to the formation of soaps through neutralization of FFA and saponification of oil. In the present paper, biodiesel was prepared from crude (soybean oil by transesterification reaction using heterogeneous base catalyst name calcium oxide (CaO. Various reaction parameters were optimized and the biodiesel properties were evaluated.

  6. Preparation of biodiesel from soybean oil by using heterogeneous catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Ferdous, Kaniz; Rakib Uddin, M.; Islam, M.A. [Department of Chemical Engineering and Polymer Science, Shah Jalal University of Science and Technology, Sylhet 3114 (Bangladesh); Khan, Maksudur R. [Department of Chemical Engineering and Polymer Science, Shah Jalal University of Science and Technology, Sylhet 3114 (Bangladesh); Faculty of Chemical and Natural Resources Engineering, University Malaysia Pahang, 26300 Gambang, Kuantan, Pahang (Malaysia)

    2013-07-01

    The predicted shortage of fossil fuels and related environmental concerns has recently attracted significant attention to search alternative fuel. Biodiesel is one of the alternatives to fossil fuel. Now-a-days, most biodiesel is produced by the transesterification of oils using methanol and a homogeneous base catalyst. The use of homogeneous catalysts is normally limited to batch mode processing followed by a catalyst separation step. The immiscible glycerol phase, which accumulates during the course of the reaction, solubilizes the homogeneous base catalyst and therefore, withdraws from the reaction medium. Moreover, other difficulties of using homogeneous base catalysts relate to their sensitivity to free fatty acid (FFA) and water and resulting saponification phenomenon. High energy consumption and costly separation of the catalyst from the reaction mixture have inspired the use of heterogeneous catalyst. The use of heterogeneous catalysts does not lead to the formation of soaps through neutralization of FFA and saponification of oil. In the present paper, biodiesel was prepared from crude (soybean) oil by transesterification reaction using heterogeneous base catalyst name calcium oxide (CaO). Various reaction parameters were optimized and the biodiesel properties were evaluated.

  7. Characterization of Deactivated Bio-oil Hydrotreating Catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Huamin; Wang, Yong

    2015-10-06

    Deactivation of bio-oil hydrotreating catalysts remains a significant challenge because of the poor quality of pyrolysis bio-oil input for hydrotreating and understanding their deactivation mode is critical to developing improved catalysts and processes. In this research, we developed an understanding of the deactivation of two-step bio-oil hydrotreating catalysts (sulfided Ru/C and sulfided CoMo/C) through detailed characterization of the catalysts using various complimentary analytical techniques. Severe fouling of both catalysts by carbonaceous species was the major form of deactivation, which is consistent with the significant loss of surface area and pore volume of both deactivated catalysts and the significant increase of the bulk density. Further analysis of the carbonaceous species by thermogravimetric analysis and x-ray photoelectron spectroscopy indicated that the carbonaceous species was formed by condensation reaction of active species such as sugars and sugar derivatives (aldehydes and ketones) in bio-oil feedstock during bio-oil hydrotreating under the conditions and catalysts used. Microscopy results did not show metal sintering of the Ru/C catalyst. However, X-ray diffraction indicated a probable transformation of the highly-active CoMoS phase in the sulfided CoMo/C catalyst to Co8S9 and MoS2 phase with low activity. Loss of the active site by transport of inorganic elements from the bio-oil and the reactor construction material onto the catalyst surface also might be a cause of deactivation as indicated by elemental analysis of spent catalysts.

  8. Phase I - Smart Grid Data Access Pilot Program: Utilizing STEM Education as a Catalyst for Residential Consumer Decision Making and Change

    Energy Technology Data Exchange (ETDEWEB)

    Lishness, Alan [Gulf Of Maine Research Inst., Portland, ME (United States); Peake, Leigh [Gulf Of Maine Research Inst., Portland, ME (United States)

    2014-11-19

    Under Phase I of the Smart Grid Data Access Pilot Program, the Gulf of Maine Research Institute (GMRI) partnered with Central Maine Power (CMP), and the Maine Mathematics and Science Alliance (MMSA) and engaged key vendors Tilson Government Services, LLC (Tilson), and Image Works to demonstrate the efficacy of PowerHouse, an interactive online learning environment linking middle school students with their home electricity consumption data provided through CMP’s Advanced Metering Infrastructure (AMI). The goal of the program is to harness the power of youth to alter home energy consumption behaviors using AMI data. Successful programs aimed at smoking cessation, recycling, and seat belt use have demonstrated the power of young people to influence household behaviors. In an era of increasing concern about energy costs, availability, and human impacts on global climate, GMRI sought to demonstrate the effectiveness of a student-focused approach to understanding and managing household energy use. We also sought to contribute to a solid foundation of science-literate students who can analyze evidence to find solutions to increasingly complex energy challenges.

  9. The origin of the selectivity and activity of ruthenium-cluster catalysts for fuel-cell feed-gas purification: a gas-phase approach.

    Science.gov (United States)

    Lang, Sandra M; Bernhardt, Thorsten M; Krstić, Marjan; Bonačić-Koutecký, Vlasta

    2014-05-19

    Gas-phase ruthenium clusters Ru(n)(+) (n=2-6) are employed as model systems to discover the origin of the outstanding performance of supported sub-nanometer ruthenium particles in the catalytic CO methanation reaction with relevance to the hydrogen feed-gas purification for advanced fuel-cell applications. Using ion-trap mass spectrometry in conjunction with first-principles density functional theory calculations three fundamental properties of these clusters are identified which determine the selectivity and catalytic activity: high reactivity toward CO in contrast to inertness in the reaction with CO2; promotion of cooperatively enhanced H2 coadsorption and dissociation on pre-formed ruthenium carbonyl clusters, that is, no CO poisoning occurs; and the presence of Ru-atom sites with a low number of metal-metal bonds, which are particularly active for H2 coadsorption and activation. Furthermore, comprehensive theoretical investigations provide mechanistic insight into the CO methanation reaction and discover a reaction route involving the formation of a formyl-type intermediate.

  10. Liquid-phase non-thermal plasma-prepared N-doped TiO(2) for azo dye degradation with the catalyst separation system by ceramic membranes.

    Science.gov (United States)

    Cheng, Hsu-Hui; Chen, Shiao-Shing; Cheng, Yi-Wen; Tseng, Wei-Lun; Wang, Yi-Hui

    2010-01-01

    This study strived to improve the photocatalytic activity by using liquid-phase non-thermal plasma (LPNTP) technology for preparing N-doping TiO(2) as well as to separate/recover the N-dope TiO(2) particles by using ceramic ultrafiltration membrane process. The yellow color N-doped TiO(2) photocatalysts, obtained through the LPNTP process, were characterized with UV-Vis spectroscopy, X-ray diffraction (XRD), and electron spectroscopy for chemical analysis (ESCA). The UV-Vis spectrum of N-doped TiO(2) showed that the absorption band was shifted to 439 nm and the band gap was reduced to 2.82 eV. The structure analysis of XRD spectra showed that the peak positions and the crystal structure remained unchanged as anatase after plasma-treating at 13.5 W for 40 min. The photocatalytic activity of N-doped TiO(2) was evaluated by azo dyes under visible light, and 63% of them was degraded after 16 hours in a continuous-flow photocatalytic system. For membrane separation/recover system, the recovery efficiency reached 99.5% after the ultrafiltration had been carried out for 90 min, and the result indicated that the photocatalyst was able to be separated/recovered completely.

  11. Fluoridation of gaseous phase chlorinated hydrocarbons in presence of chromium oxide-based catalysts. Effect of doping substance addition; Fluoration d'hydrocarbures chlores en phase gazeuse en presence de catalyseurs a base d'oxyde de chrome. Effet de l'ajout de dopant

    Energy Technology Data Exchange (ETDEWEB)

    Loustaunau, A.

    2003-11-01

    The preparation of various hydro-fluorocarbons (HFC), like CF{sub 3}CH{sub 2}F, CF{sub 3}CHF{sub 2} and CH{sub 2}F{sub 2}, has been studied at temperatures of 380 deg. C and 250 deg. C in gaseous phase by catalytic fluoridation of the corresponding chlorinated hydrocarbons. The addition of doping substances like zinc, nickel or magnesium to fluorinated alumina supported chromium oxide-based catalysts, has been particularly examined in order to favour the main fluoridation reaction (by simple Cl/F exchange) with respect to secondary reactions (de-hydro-fluoridation and Deacon). Only the addition of small amounts of Zn (Zn/(Zn+Cr) = 0.15) allows to promote the fluoridation reaction and to inhibit the secondary reactions. This effect is enhanced when the molecule is less reactive and when the quantity of matter at the surface of the fluorinated alumina is low. Therefore, the promoting effect is more important in presence of CF{sub 3}CH{sub 2}Cl than in presence of CF{sub 3}CHCl{sub 2} and CH{sub 2}Cl{sub 2}. This positive effect of zinc may result from the formation of a mixed ZnCr{sub 2}O{sub 4} phase during the preparation of the catalyst (evidenced by X-ray photoelectron spectroscopy (XPS)) which may have modified the chemical properties of chromium atoms. Moreover, the XPS and electron microscopy characterizations indicate that the presence of zinc (contrary to nickel and magnesium) may allow a better dispersion of the active chromium atoms for Cl/F exchanges after fluoridation of the catalyst. Those may correspond to the presence of very fluorinated species, like 'Cr-F', and oxi-fluorinated like 'CrOF'. Thus, in the presence of a small amount of metals at the surface of the support, the formation of these different species is favoured. (J.S.)

  12. X-ray characterization of platinum group metal catalysts

    Science.gov (United States)

    Peterson, Eric J.

    complements information obtained from both XRD and XAS. With aberration-corrected HAADF, particles ranging from sub-nm-size down to clusters of a few atoms and isolated single-atoms can be routinely imaged. A challenge to the interpretation of these images is the characterization of mixed atomic species, in this case, palladium and lanthanum. In this work we show for the first time that quantitative chemical identification of atomically-dispersed mixtures of palladium and lanthanum in an industrially relevant catalyst (palladium on lanthanum-stabilized gamma-alumina) can be obtained through image intensity analysis. Using these techniques we have characterized the state of bimetallic fuel cell catalysts, ex situ, and have examined the state of Pd catalysts under operando CO oxidation conditions.

  13. Catalyst for microelectromechanical systems microreactors

    Science.gov (United States)

    Morse, Jeffrey D.; Sopchak, David A.; Upadhye, Ravindra S.; Reynolds, John G.; Satcher, Joseph H.; Gash, Alex E.

    2010-06-29

    A microreactor comprising a silicon wafer, a multiplicity of microchannels in the silicon wafer, and a catalyst coating the microchannels. In one embodiment the catalyst coating the microchannels comprises a nanostructured material. In another embodiment the catalyst coating the microchannels comprises an aerogel. In another embodiment the catalyst coating the microchannels comprises a solgel. In another embodiment the catalyst coating the microchannels comprises carbon nanotubes.

  14. Epoxidation catalyst and process

    Science.gov (United States)

    Linic, Suljo; Christopher, Phillip

    2010-10-26

    Disclosed herein is a catalytic method of converting alkenes to epoxides. This method generally includes reacting alkenes with oxygen in the presence of a specific silver catalyst under conditions suitable to produce a yield of the epoxides. The specific silver catalyst is a silver nanocrystal having a plurality of surface planes, a substantial portion of which is defined by Miller indices of (100). The reaction is performed by charging a suitable reactor with this silver catalyst and then feeding the reactants to the reactor under conditions to carry out the reaction. The reaction may be performed in batch, or as a continuous process that employs a recycle of any unreacted alkenes. The specific silver catalyst has unexpectedly high selectivity for epoxide products. Consequently, this general method (and its various embodiments) will result in extraordinarily high epoxide yields heretofore unattainable.

  15. New Catalysts for ROMP

    Institute of Scientific and Technical Information of China (English)

    H. Berke; C. Frech; A. Lhamazares; O. Blacque; H.W. Schmalle; C. Adlhart; P. Chen

    2005-01-01

    @@ 1Introduction Ring Opening Metathesis Polymerization (ROMP) is based on the olefin metathesis reaction, which requires transition metal catalysts. Mainly molybdenum, tungsten and ruthenium based catalysts have up to now been used. The "in-between" metal rhenium was only rarely applied in olefin metathesis reactions, and not at all in ROMP processes.We have found that cationic phosphine substituted dinitrosyl rhenium complexes[1]1a and 1b effectively catalyze ROMP of norbonene, dicyclopentadiene and of cyclooctene. See Fig. 1.

  16. Identification of Fat in Myxoid Matrix-Rich Mesenteric Lipoblastoma Using In-Phase and Opposed-Phase MRI: A Case Report

    Energy Technology Data Exchange (ETDEWEB)

    Wen, Yang [Dept. of Radiology, Beijing Chikdren' s Hospital Afilated Capital Medical University, Beijing (China); Ha, Jin Young; Goo, Hyun Woo [Dept. of Radiology and Research Institute of Radiology, Asan Medical Center, Ulsan University College of Medicine, Seoul (Korea, Republic of)

    2011-07-15

    We present a rare case of a myxoid matrix-rich mesenteric lipoblastoma. In this case, fat-saturated T1-weighted magnetic resonance (MR) imaging failed to disclose the fatty component of the tumor, while in-phase and opposed-phase MR imaging could accurately identify small fat scattered in this myxoid matrix-rich tumor.

  17. Heteropoly acid promoted Cu and Fe catalysts for the selective catalytic reduction of NO with ammonia

    DEFF Research Database (Denmark)

    Putluru, Siva Sankar Reddy; Mossin, Susanne L.; Riisager, Anders

    2011-01-01

    Cu/TiO2, Fe/TiO2 and heteropoly acid promoted Cu/TiO2, Fe/TiO2 catalysts were prepared and characterized by N2 physisorption, XRPD, NH3-TPD, H2-TPR and EPR. The catalysts exhibited only crystalline TiO2 phases with the active metals and promoters in highly dispersed state. The acidic properties...... activity and acidity was lower for promoted catalysts than for unpromoted catalysts. In the heteropoly acid promoted catalysts the SCR active Cu and Fe metals were protected from potassium poisons by bonding of the potassium to the Brønsted acid centres. Thus heteropoly acid promoted catalysts might...... were studied and compared with the catalytic activity for the selective catalytic reduction (SCR) of NO with ammonia. The SCR activities and acidity values of heteropoly acid promoted catalysts were found to be much higher than unpromoted catalysts. The influence of potassium poisons on the SCR...

  18. Identification and characterization of the intermediate phase in hybrid organic-inorganic MAPbI3 perovskite.

    Science.gov (United States)

    Guo, Xin; McCleese, Christopher; Kolodziej, Charles; Samia, Anna C S; Zhao, Yixin; Burda, Clemens

    2016-03-07

    Perovskite films were prepared using single step solution deposition at different annealing temperatures and annealing times. The crystal structure, phases and grain size were investigated with XRD, XPS and SEM/EDX. The prepared films show a typical orientation of tetragonal perovskite phase and a gradual transition at room temperature from the yellow intermediate phase to the black perovskite phase. Films with high purity were obtained by sintering at 100 °C. In addition, the chemical composition and crystal structure of intermediate phase were investigated in detail. FTIR, UV-vis and NMR spectra revealed the occurance of DMF complexes. Interestingly, the intermediate phase could be transformed to the black perovskite phase upon X-ray irradiation. In addition, the recovery of the aged perovskite films from a yellow intermediate phase back to the black perovskite was shown to be viable via heating and X-ray irradiation.

  19. Site-Selective Acylations with Tailor-Made Catalysts.

    Science.gov (United States)

    Huber, Florian; Kirsch, Stefan F

    2016-04-18

    The acylation of alcohols catalyzed by N,N-dimethylamino pyridine (DMAP) is, despite its widespread use, sometimes confronted with substrate-specific problems: For example, target compounds with multiple hydroxy groups may show insufficient selectivity for one hydroxyl, and the resulting product mixtures are hardly separable. Here we describe a concept that aims at tailor-made catalysts for the site-specific acylation. To this end, we introduce a catalyst library where each entry is constructed by connecting a variable and readily tuned peptide scaffold with a catalytically active unit based on DMAP. For selected examples, we demonstrate how library screening leads to the identification of optimized catalysts, and the substrates of interest can be converted with a markedly enhanced site-selectivity compared with only DMAP. Furthermore, substrate-optimized catalysts of this type can be used to selectively convert "their" substrate in the presence of structurally similar compounds, an important requisite for reactions with mixtures of substances.

  20. Blind identification of full-field vibration modes from video measurements with phase-based video motion magnification

    Science.gov (United States)

    Yang, Yongchao; Dorn, Charles; Mancini, Tyler; Talken, Zachary; Kenyon, Garrett; Farrar, Charles; Mascareñas, David

    2017-02-01

    user supervision and calibration. First a multi-scale image processing method is applied on the frames of the video of a vibrating structure to extract the local pixel phases that encode local structural vibration, establishing a full-field spatiotemporal motion matrix. Then a high-spatial dimensional, yet low-modal-dimensional, over-complete model is used to represent the extracted full-field motion matrix using modal superposition, which is physically connected and manipulated by a family of unsupervised learning models and techniques, respectively. Thus, the proposed method is able to blindly extract modal frequencies, damping ratios, and full-field (as many points as the pixel number of the video frame) mode shapes from line of sight video measurements of the structure. The method is validated by laboratory experiments on a bench-scale building structure and a cantilever beam. Its ability for output (video measurements)-only identification and visualization of the weakly-excited mode is demonstrated and several issues with its implementation are discussed.

  1. Studies on dehydrogenation of cyclohexanol to cyclohexanone over mesoporous SiO₂ supported copper catalysts

    Indian Academy of Sciences (India)

    B SRIDEVI; P NAGAIAH; A H PADMASRI; B DAVID RAJU; K S RAMA RAO

    2017-05-01

    SBA-15, KIT-6, SiO₂ supported catalysts with 10% Cu loading have been prepared by impregnation techniques. The prepared catalysts have been characterized by BET technique, X-ray diffraction, Temperature programmed reduction (TPR), XPS and N₂O pulse chemisorption techniques. Dehydrogenation of cyclohexanol has been performed over these catalysts in vapour phase at 523 K. SBA-15 and KIT-6 supported copper catalystsshowed higher activity than SiO₂ supported Cu catalyst in dehydrogenation of cyclohexanol, which can be attributed to better Cu dispersion, small copper particle size and more number of Cu active species presented on the surface of mesoporous supported catalysts.

  2. 钼催化剂结构对其催化气相丙烯环氧化反应选择性的影响%Effects of structures of molybdenum catalysts on selectivity in gas-phase propylene oxidation

    Institute of Scientific and Technical Information of China (English)

    Martin Šustek; Blažej Horváth; Ivo Vávra; Miroslav Gál; Edmund Dobročka; Milan Hronec

    2015-01-01

    考察了Mo基催化剂上空气气相氧化丙烯反应。从无机的和有机金属Mo前驱体出发,采用浸渍法和物理气相沉积法(PVD)制备了不同类型的SiO2负载氧化钼和Mo-Bi复合氧化物催化剂。透射电镜结果证实,所制催化剂上环氧化反应活性与其纳米结构直接有关。催化剂中出现部分或完全结晶的氧化钼相,它们与载体SiO2的相互作用较弱,使得反应生成环氧丙烷的选择性低于10%,而锚合在SiO2上的非结晶的八配位Mo物种上的环氧丙烷选择性达55%以上,此时丙烯转化率约为11%。不同形貌氧化钼的电化学表征结果证实了结构缺陷的重要性。另外,还讨论了Bi对氧化钼催化环氧化活性的直接促进效应。%Molybdenum‐based catalysts for the gas‐phase oxidation of propylene with air were investigated. Various types of silica‐supported molybdenum oxide and molybdenum‐bismuth mixed oxide cata‐lysts were prepared from inorganic and organometallic molybdenum precursors using wet im‐pregnation and physical vapor deposition methods. The epoxidation activities of the prepared cata‐lysts showed direct correlations with their nanostructures, which were identified using transmis‐sion electron microscopy. The appearance of a partly or fully crystalline molybdenum oxide phase, which interacted poorly with the silica support, decreased the selectivity for propylene oxide for‐mation to below 10%;non‐crystalline octahedrally coordinated molybdenum species anchored on the support gave propylene oxide formations greater than 55%, with 11%propylene conversion. Electrochemical characterization of molybdenum oxides with various morphologies showed the importance of structural defects. Direct promotion by bismuth of the epoxidation reactivities over molybdenum oxides is disputed.

  3. The Design of Reactions, Catalysts and Materials with Aromatic Ions

    Science.gov (United States)

    Bandar, Jeffrey Scott

    (dialkylamino)cyclopropenimine catalyst to promote asymmetric Mannich reactions of glycinate imines and N -Boc-aldimines is described in Chapter 4. The products of this transformation are optically enriched diamino acid derivatives, an important motif widely utilized in medicinal and synthetic chemistry. Importantly, unlike existing methods, our technology promotes reactions between tert-butyl glycinate and aliphatic N-Boc-aldimine substrates. A preparative-scale reaction is demonstrated and derivatization of its product to several valuable chiral compounds is shown. Chapter 5 describes the use of tris(dialkylamino)cyclopropenium (TDAC) ions as a new class of onium-like catalyst. A simple TDAC chloride salt is prepared on a 75-gram scale and its use as a phase transfer catalyst for a variety of reactions is demonstrated. This same salt is also utilized as an epoxide opening catalyst for a variety of transformations, including the fixation of carbon dioxide. Chapter 6 briefly highlights several continued applications of the chemistry advanced throughout this thesis. First, the work of other members of the Lambert Group toward the continued development of cyclopropenimine chemistry is described. Second, a broad initiative between the Lambert and Campos Groups at Columbia University focused on the synthesis and application of TDAC-based polymers is introduced. Lastly, the identification of a previously unknown equilibrium between fulvenes and imines/aldehydes in the context of a new mode of catalysis is presented.

  4. Synthesis, Characterization and Photocatalytic Performance of Ag-modified TiO2 Catalysts for the Degradation of Gas-phase Toluene%Ag改性TiO2催化剂的制备、表征及其甲苯气相光催化降解性能

    Institute of Scientific and Technical Information of China (English)

    方奕文; 余林; 叶飞; 孙明

    2011-01-01

    Ag-modified TiO2 catalysts were synthesized by sol-gel method and characterized by XRD, SEM, BET, O2-TPD and UV-Vis DRS. The results showed that the Ag-TiO2 catalysts demonstrated smaller particle sizes, larger specific surface areas and higher absorbing ability in visible light when compared with TiO2 catalyst. The surface adsorbed oxygen and Ag electron trapping center also appeared on the Ag-TiO2 catalysts. The single-pass degradation rate of toluene reached 42.9% when the Ag/Ti atomic ratio was 1.6%. The catalysts were transfered from pure anatase phase to anatase-rutile composite phase when the calcination temperatures were increased. The coexisting of anatase phase and rutile phase with appropriate ratio can reduce the recombination probability of the electron-hole pairs and enhance the toluene degradation activities.%用溶胶-凝胶法制备Ag改性的TiO2催化剂,并用XRD、SEM、BET、O2-TPD和UV-Vis DRS等测试手段对其进行表征.结果表明,与TiO2相比,所制备催化剂颗粒直径明显减小,比表面积明显增大,对可见光的吸收明显增强,同时出现了表面吸附氧和Ag电子捕获中心.甲苯气相光催化降解结果显示,当Ag与Ti的摩尔比(nAg/nTi)为1.6%时,甲苯单程降解率达到42.9%.焙烧温度提高,使催化剂从单一锐钛矿相向锐钛矿、金红石混合相转变,适量比例的锐钛矿相和金红石相共存,能减少电子-空穴对复合几率,提高催化剂的甲苯降解活性.

  5. Early Identification of Delinquency Prone Youth. The Eau Claire County Youth Study, Phase IV, 1969-1972.

    Science.gov (United States)

    Feldhusen, John F.; And Others

    Procedures for early identification of delinquency-prone youth in Eau Claire County, Wisconsin, are described in this report of a 1961-1972 study designed to delineate the problems of aggressive and disruptive classroom behavior as related to delinquency. Data collection began in 1961, when each 3rd-, 6th-, and 9th-grade teacher in Eau Claire…

  6. Rapid separation of seed gliadins by reversed-phase ultra performance liquid chromatography (RP-UPLC) and its application in wheat cultivar and germplasm identification.

    Science.gov (United States)

    Han, Caixia; Lu, Xaiobing; Yu, Zitong; Li, Xiaohui; Ma, Wujun; Yan, Yueming

    2015-01-01

    To separate gliadin from wheat flour, a novel and stability-indicating reversed-phase ultra performance liquid chromatography (RP-UPLC) method is established and optimized. A comparative analysis of routine capillary electrophoresis (CE), reversed-phase high-performance liquid chromatography (RP-HPLC), and RP-UPLC was performed and the results showed that the resolution and efficiency of RP-UPLC were significantly higher than those of CE and RP-HPLC. Characteristic RP-UPLC patterns of different bread wheat variety and related species were readily identified. These results demonstrated that our RP-UPLC procedure resulted in significant improvements in sensitivity, speed, and resolution, and thus is highly useful in wheat cultivar and germplasm identification.

  7. Catalyst fines behavior among FCC flue gas turbine blade rows -Effect of gaseous phase flow field distribution%烟气轮机叶片间隙中FCC催化剂细粉运动规律——气相流场分布的影响

    Institute of Scientific and Technical Information of China (English)

    杜玉朋; 赵辉; 杨朝合; 胡仁波; 张云

    2012-01-01

    针对近年来炼厂中出现的催化裂化烟气轮机内结垢严重的问题,首先采用数值模拟方法,探讨了烟机内部气相流场的分布.模拟结果表明:在动叶片的压力面上,气相速度分布较低、水气浓度分布较大以及温度分布较高的特点,使得随烟气进入烟机的催化剂颗粒极易在叶片压力面上堆积和熔融.此外,通过采用仪器分析的方法对新鲜剂、平衡剂和垢物进行了微观形貌(SEM)与矿物组成(XRD)等分析,结果表明:烟机叶片上的结垢主要是由催化剂颗粒堆积与颗粒中某些物质生成了低熔点共熔物共同作用的结果.所得结论可为进一步研究催化剂颗粒在烟机内的流动情况和揭示结垢机理等后续工作提供理论基础.%According to the problem of serious scale formation in the FCC flue gas turbines in many refineries, the distribution of gaseous phase flow field in flue gas turbines was studied by using a CFD-based numerical simulation method. The simulation shows that the distribution is characterized by low gas velocity, high humidity, and high temperature on the pressure-side of rotors, which makes the catalyst particles entrained by exhaust gases more readily accumulate and melt there. By means of instrumental analyses to fresh catalyst, equilibrium catalyst and scaling catalyst, including scanning electron microscope ( SEM) for micro-morphology analysis, and X-ray diffraction (XRD) for phase analysis, the catalyst scaling on the surface of blade is proved to be the concurrent consequence of particle accumulation and low-melting eutectic matter formation. The results provide a theoretical basis for further study on the catalyst particles behavior and the scaling mechanism in FCC flue gas turbines.

  8. Identification and Assessment of Paradoxical Ventricular Wall Motion Using ECG Gated Blood Pool Scan - Comparison of cine Loop , Phase Analysis and Paradox Image -

    Energy Technology Data Exchange (ETDEWEB)

    Lee, Jae Tae; Kim, Gwang Weon; Lee, Kyu Bo; Chung, Byung Chun; Whang, Kee Suk; Chae, Sung Chul; Paek, Wee Hyun; Cheon, Jae Eun [Kyungpook National University School of Medicine, Daegu (Korea, Republic of); Lee, Hyong Woo; Chung, Jin Hong [Yeongnam National University College of Medicine, Daegu (Korea, Republic of)

    1990-07-15

    Sixty-four patients with paradoxical ventricular wall motion noticed both in angiocardiography or 2-dimensional echocardiography were assessed by ECG gated blood pool scan (GBPS). Endless cine loop image, phase and amplitude images and paradox image obtained by visual inspection of each cardiac beat or Fourier transformation of acquired raw data were investigated to determine the incremental value of GBPS with these processing methods for identification of paradoxical ventricular wall motion. The results were as follows:1) Paradoxical wall motions were observed on interventricular septum in 34 cases, left ventricular free wall in 26 and right ventricular wall in 24. Underlying heart diseases were is chemic (23 cases) valvular(9), congenital heart disease (12), cardiomyopathy (5), pericardial effusion(5), post cardiac surgery(3), corpulmonale (2), endocarditis (l) and right ventricular tumor(l). 2) Left ventricular ejection fractions of patients with paradoxical left ventricular wall motion were significantly lower than those with paradoxical septal motion (p <0.005). 3) The sensitivity of each processing methods for detecting paradoxical wall motion was 76.9% by phase analysis, 74.6% by endless cine loop mapping and 68.4% by paradox image manipulation respectively. Paradoxial motions visualized only in phase, paradox or both images were appeared as hypokinesia or akinesia in cine loop image. 4) All events could be identified by at least one of above three processing methods, however only 34 cases (48.4%) showed the paradoxical motions in all of the three images. By these findings, we concluded that simultaneous inspection of all above three processing methods-endless cine loop, phase analysis and paradox image is necessary for accurate identification and assessment of paradoxical ventricular wall motion when performing GBPS.

  9. Supported organoiridium catalysts for alkane dehydrogenation

    Science.gov (United States)

    Baker, R. Thomas; Sattelberger, Alfred P.; Li, Hongbo

    2013-09-03

    Solid supported organoiridium catalysts, a process for preparing such solid supported organoiridium catalysts, and the use of such solid supported organoiridium catalysts in dehydrogenation reactions of alkanes is provided. The catalysts can be easily recovered and recycled.

  10. Catalysts for Efficient Production of Carbon Nanotubes

    Science.gov (United States)

    Sun, Ted X.; Dong, Yi

    2009-01-01

    Several metal alloys have shown promise as improved catalysts for catalytic thermal decomposition of hydrocarbon gases to produce carbon nanotubes (CNTs). Heretofore almost every experiment on the production of carbon nanotubes by this method has involved the use of iron, nickel, or cobalt as the catalyst. However, the catalytic-conversion efficiencies of these metals have been observed to be limited. The identification of better catalysts is part of a continuing program to develop means of mass production of high-quality carbon nanotubes at costs lower than those achieved thus far (as much as $100/g for purified multi-wall CNTs or $1,000/g for single-wall CNTs in year 2002). The main effort thus far in this program has been the design and implementation of a process tailored specifically for high-throughput screening of alloys for catalyzing the growth of CNTs. The process includes an integral combination of (1) formulation of libraries of catalysts, (2) synthesis of CNTs from decomposition of ethylene on powders of the alloys in a pyrolytic chemical-vapor-decomposition reactor, and (3) scanning- electron-microscope screening of the CNTs thus synthesized to evaluate the catalytic efficiencies of the alloys. Information gained in this process is put into a database and analyzed to identify promising alloy compositions, which are to be subjected to further evaluation in a subsequent round of testing. Some of these alloys have been found to catalyze the formation of carbon nano tubes from ethylene at temperatures as low as 350 to 400 C. In contrast, the temperatures typically required for prior catalysts range from 550 to 750 C.

  11. Synthesis and Photocatalytic Activity of TiO2/V2O5 Composite Catalyst Doped with Rare Earth Ions

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    TiO2/V2O5 catalyst doped with rare earth ions was prepared by sol-gel method. Titanium tetrapropoxide and vanadium pentoxide were used as precursor of the composite catalyst and rare earth ions were used as dopant. The crystal phases, crystalline sizes, microstructure, absorption spectra of doped composite catalyst were studied by XRD, EDS, FT-IR and UV-Vis. Photoactivity of the prepared catalyst under ultraviolet irradiation were evaluated by degradation of methyl orange (MO) in aqueous solution. It is shown that the prepared catalyst is composed of anatase and rutile. The rare earth ions are highly dispersed in composite catalyst. All the doped catalysts appear higher photocatalytic activity than TiO2/V2O5 catalyst and catalyst doped with Ce4+ present the best activity to MO.

  12. Catalytic liquid-phase oxidation of acetaldehyde to acetic acid over a Pt/CeO2-ZrO2-SnO2/γ-alumina catalyst.

    Science.gov (United States)

    Choi, Pil-Gyu; Ohno, Takanobu; Masui, Toshiyuki; Imanaka, Nobuhito

    2015-10-01

    Pt/CeO2-ZrO2-SnO2/γ-Al2O3 catalysts were prepared by co-precipitation and wet impregnation methods for catalytic oxidation of acetaldehyde to acetic acid in water. In the present catalysts, Pt and CeO2-ZrO2-SnO2 were successfully dispersed on the γ-Al2O3 support. Dependences of platinum content and reaction time on the selective oxidation of acetaldehyde to acetic acid were investigated to optimize the reaction conditions for obtaining both high acetaldehyde conversion and highest selectivity to acetic acid. Among the catalysts, a Pt(6.4wt.%)/Ce0.68Zr0.17Sn0.15O2.0(16wt.%)/γ-Al2O3 catalyst showed the highest acetaldehyde oxidation activity. On this catalyst, acetaldehyde was completely oxidized after the reaction at 0°C for 8hr, and the selectivity to acetic acid reached to 95% and higher after the reaction for 4hr and longer.

  13. A lab-on-a-chip device for rapid identification of avian influenza viral RNA by solid-phase PCR

    DEFF Research Database (Denmark)

    Yi, Sun; Dhumpa, Raghuram; Bang, Dang Duong

    2011-01-01

    This paper describes a lab-on-a-chip device for fast AIV screening by integrating DNA microarray-based solid-phase PCR on a microfluidic chip.......This paper describes a lab-on-a-chip device for fast AIV screening by integrating DNA microarray-based solid-phase PCR on a microfluidic chip....

  14. Carbon Fiber Composite Monoliths as Catalyst Supports

    Energy Technology Data Exchange (ETDEWEB)

    Contescu, Cristian I [ORNL; Gallego, Nidia C [ORNL; Pickel, Joseph M [ORNL; Blom, Douglas Allen [ORNL; Burchell, Timothy D [ORNL

    2006-01-01

    Carbon fiber composite monoliths are rigid bodies that can be activated to a large surface area, have tunable porosity, and proven performance in gas separation and storage. They are ideal as catalyst supports in applications where a rigid support, with open structure and easy fluid access is desired. We developed a procedure for depositing a dispersed nanoparticulate phase of molybdenum carbide (Mo2C) on carbon composite monoliths in the concentration range of 3 to 15 wt% Mo. The composition and morphology of this phase was characterized using X-ray diffraction and electron microscopy, and a mechanism was suggested for its formation. Molybdenum carbide is known for its catalytic properties that resemble those of platinum group metals, but at a lower cost. The materials obtained are expected to demonstrate catalytic activity in a series of hydrocarbon reactions involving hydrogen transfer. This project demonstrates the potential of carbon fiber composite monoliths as catalyst supports.

  15. Carbon Fiber Composite Monoliths for Catalyst Supports

    Energy Technology Data Exchange (ETDEWEB)

    Contescu, Cristian I [ORNL; Gallego, Nidia C [ORNL; Pickel, Joseph M [ORNL; Blom, Douglas Allen [ORNL; Burchell, Timothy D [ORNL

    2006-01-01

    Carbon fiber composite monoliths are rigid bodies that can be activated to a large surface area, have tunable porosity, and proven performance in gas separation and storage. They are ideal as catalyst supports in applications where a rigid support, with open structure and easy fluid access is desired. We developed a procedure for depositing a dispersed nanoparticulate phase of molybdenum carbide (Mo2C) on carbon composite monoliths in the concentration range of 3 to 15 wt% Mo. The composition and morphology of this phase was characterized using X-ray diffraction and electron microscopy, and a mechanism was suggested for its formation. Molybdenum carbide is known for its catalytic properties that resemble those of platinum group metals, but at a lower cost. The materials obtained are expected to demonstrate catalytic activity in a series of hydrocarbon reactions involving hydrogen transfer. This project demonstrates the potential of carbon fiber composite monoliths as catalyst supports.

  16. Real-Time Identification of Smoldering and Flaming Combustion Phases in Forest Using a Wireless Sensor Network-Based Multi-Sensor System and Artificial Neural Network

    Directory of Open Access Journals (Sweden)

    Xiaofei Yan

    2016-08-01

    Full Text Available Diverse sensing techniques have been developed and combined with machine learning method for forest fire detection, but none of them referred to identifying smoldering and flaming combustion phases. This study attempts to real-time identify different combustion phases using a developed wireless sensor network (WSN-based multi-sensor system and artificial neural network (ANN. Sensors (CO, CO2, smoke, air temperature and relative humidity were integrated into one node of WSN. An experiment was conducted using burning materials from residual of forest to test responses of each node under no, smoldering-dominated and flaming-dominated combustion conditions. The results showed that the five sensors have reasonable responses to artificial forest fire. To reduce cost of the nodes, smoke, CO2 and temperature sensors were chiefly selected through correlation analysis. For achieving higher identification rate, an ANN model was built and trained with inputs of four sensor groups: smoke; smoke and CO2; smoke and temperature; smoke, CO2 and temperature. The model test results showed that multi-sensor input yielded higher predicting accuracy (≥82.5% than single-sensor input (50.9%–92.5%. Based on these, it is possible to reduce the cost with a relatively high fire identification rate and potential application of the system can be tested in future under real forest condition.

  17. Real-Time Identification of Smoldering and Flaming Combustion Phases in Forest Using a Wireless Sensor Network-Based Multi-Sensor System and Artificial Neural Network.

    Science.gov (United States)

    Yan, Xiaofei; Cheng, Hong; Zhao, Yandong; Yu, Wenhua; Huang, Huan; Zheng, Xiaoliang

    2016-08-04

    Diverse sensing techniques have been developed and combined with machine learning method for forest fire detection, but none of them referred to identifying smoldering and flaming combustion phases. This study attempts to real-time identify different combustion phases using a developed wireless sensor network (WSN)-based multi-sensor system and artificial neural network (ANN). Sensors (CO, CO₂, smoke, air temperature and relative humidity) were integrated into one node of WSN. An experiment was conducted using burning materials from residual of forest to test responses of each node under no, smoldering-dominated and flaming-dominated combustion conditions. The results showed that the five sensors have reasonable responses to artificial forest fire. To reduce cost of the nodes, smoke, CO₂ and temperature sensors were chiefly selected through correlation analysis. For achieving higher identification rate, an ANN model was built and trained with inputs of four sensor groups: smoke; smoke and CO₂; smoke and temperature; smoke, CO₂ and temperature. The model test results showed that multi-sensor input yielded higher predicting accuracy (≥82.5%) than single-sensor input (50.9%-92.5%). Based on these, it is possible to reduce the cost with a relatively high fire identification rate and potential application of the system can be tested in future under real forest condition.

  18. Carbon xerogels as supports for catalysts and electrocatalysts

    OpenAIRE

    Job, Nathalie; Berthon-Fabry, Sandrine; Lambert, Stephanie; Chatenet, Marian; Maillard, Frédéric; Brigaudet, Mathilde; Pirard, Jean-Paul

    2009-01-01

    International audience; In order to improve mass transport in the pore texture of carbon supported catalysts, the widely used supports (activated carbons or carbon blacks) can be replaced by carbon gels, i.e. texture-tailored materials obtained by drying and pyrolysis of organic gels. Carbon xerogels issued from resorcinol-formaldehyde aqueous gels were used as metal catalyst supports both in gas phase heterogeneous catalysis and in PEM fuel cell electrodes. These materials, composed of very ...

  19. Mesoporous molecular sieve catalysts

    DEFF Research Database (Denmark)

    Højholt, Karen Thrane

    be used as solid acid catalysts but can also be used as a size-selective matrix. It was shown that it is possible to encapsulate 1-2 nm sized gold nanoparticles by silicalite-1 or ZSM-5 zeolite crystals thereby forming a sintering-stable and substrate size-selective oxidation catalyst. After carrying out...... calcination experiments, both in situ and ex situ indicated that the gold nanoparticles embedded in the crystals were highly stable towards sintering. The catalytic tests proved that the embedded gold nanoparticles were active in selective aldehyde oxidation and were only accessible through the micropores...

  20. Dynamics of Catalyst Nanoparticles

    DEFF Research Database (Denmark)

    Hansen, Thomas Willum; Cavalca, Filippo; Wagner, Jakob Birkedal

    under gas exposure, dynamic phenomena such as sintering and growth can be observed with sub-Ångstrøm resolution. Metal nanoparticles contain the active sites in heterogeneous catalysts, which are important for many industrial applications including the production of clean fuels, chemicals...... and pharmaceuticals, and the cleanup of exhaust from automobiles and stationary power plants. Sintering, or thermal deactivation, is an important mechanism for the loss of catalyst activity. In order to initiate a systematic study of the dynamics and sintering of nanoparticles, various catalytic systems have been...

  1. Aerogel derived catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Reynolds, J. G., LLNL

    1996-12-11

    Aerogels area class of colloidal materials which have high surface areas and abundant mesoporous structure. SiO{sub 2} aerogels show unique physical, optical and structural properties. When catalytic metals are incorporated in the aerogel framework, the potential exists for new and very effective catalysts for industrial processes. Three applications of these metal-containing SiO{sub 2} aerogels as catalysts are briefly reviewed in this paper--NO{sub x} reduction, volatile organic compound destruction, and partial oxidation of methane.

  2. Olefin metathesis catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Kukes, S.G.; Banks, R.L.

    1986-05-20

    A process is described for preparing a disproportionation catalyst comprising admixing a catalytically effective amount of a calcined and activated catalyst consisting essentially of at least one metal oxide selected from molybdenum oxide and tungsten oxide and a support containing a major proportion of silica or alumina with a promoting amount of a methylating agent selected from the group consisting of dimethyl sulfate, dimethylsulfoxide, trimethyloxonium tetrafluorborate, methyl iodide, and methyl bromide, and subjecting same to inert atmospheric conditions for the methylating agent to promote the activity of the calcined molybdenum and tungsten oxides for the disproportionation of olefins.

  3. Fundamental investigations of catalyst nanoparticles

    DEFF Research Database (Denmark)

    Elkjær, Christian Fink

    fundamental understanding of catalytic processes and our ability to make use of that understanding. This thesis presents fundamental studies of catalyst nanoparticles with particular focus on dynamic processes. Such studies often require atomic-scale characterization, because the catalytic conversion takes...... place on the molecular and atomic level. Transmission electron microscopy (TEM) has the ability to image nanostructures with atomic resolution and reveal the atomic configuration of the important nanoparticle surfaces. In the present work, TEM has been used to study nanoparticles in situ at elevated...... different topics, each related to different aspects of nanoparticle dynamics and catalysis. The first topic is the reduction of a homogeneous solid state precursor to form the catalytically active phase which is metal nanoparticles on an inert support. Here, we have reduced Cu phyllosilicate to Cu on silica...

  4. Deactivation-resistant catalyst for selective catalyst reduction of NOx

    DEFF Research Database (Denmark)

    2011-01-01

    The present invention relates to a catalyst for selective catalytic reduction of NOx in alkali metal containing flue gas using ammonia as reductant, the catalyst comprising a surface with catalytically active sites, wherein the surface is at least partly coated with a coating comprising at least...... one metal oxide. In another aspect the present invention relates to the use of said catalyst and to a method of producing said catalyst. In addition, the present invention relates to a method of treating an catalyst for conferring thereon an improved resistance to alkali poisoning....

  5. PGM-free Fe-N-C catalysts for oxygen reduction reaction: Catalyst layer design

    Science.gov (United States)

    Stariha, Sarah; Artyushkova, Kateryna; Workman, Michael J.; Serov, Alexey; Mckinney, Sam; Halevi, Barr; Atanassov, Plamen

    2016-09-01

    This work studies the morphology of platinum group metal-free (PGM-free) iron-nitrogen-carbon (Fe-N-C) catalyst layers for the oxygen reduction reaction (ORR) and compares catalytic performance via polarization curves. Three different nitrogen-rich organic precursors are used to prepare the catalysts. Using scanning electron microscopy (SEM) and focused ion beam (FIB) tomography, the porosity, Euler number (pore connectivity), overall roughness, solid phase size and pore size are calculated for catalyst surfaces and volumes. Catalytic activity is determined using membrane electrode assembly (MEA) testing. It is found that the dominant factor in MEA performance is transport limitations. Through the 2D and 3D metrics it is concluded that pore connectivity has the biggest effect on transport performance.

  6. States of Carbon Nanotube Supported Mo-Based HDS Catalysts

    Institute of Scientific and Technical Information of China (English)

    Hongyan Shang; Chenguang Liu; Yongqiang Xu; Jieshan Qiu; Fei Wei

    2006-01-01

    The dispersion of the active phase and loading capacity of the Mo species on carbon nanotube (CNT) was studied by the XRD technique. The reducibility properties of Co-Mo catalysts in the oxide state over CNTs were investigated by TPR, while the sulfided Co-Mo/CNT catalysts were characterized by means of the XRD and LRS techniques. The activity and selectivity with respect to the hydrodesulfurization (HDS) performances on carbon nanotube supported Co-Mo catalysts were evaluated. It was found that the main active molybdenum species in the oxide state MoO3/CNT catalysts were MoO2, but not MoO3, as generally expected. The maximum loading before the formation of the bulk phase was lower than 6% (percent by mass, based on MoO3). TPR studies revealed that the active species in the oxide state Co-Mo/CNT catalysts were reduced more easily at relatively lower temperatures in comparison to those of the Co-Mo/γ-Al2O3 catalysts, indicating that the CNT support promoted or favored the reduction of the active species. The active species of a Co-Mo-0.7/CNT catalyst were more easily reduced than those of the Co-Mo/CNT catalysts with Co/Mo atomic ratios of 0.2, 0.35, and 0.5, respectively, suggesting that the Co/Mo atomic ratio has a great effect on the reducibility of the active species. It was found that the incorporation of cobalt improved the dispersion of the molybdenum species on the support, and a phenomenon of mobilization and re-dispersion had occurred during the sulfurization process, resulting in low valence state Mo3S4 and Co-MoS2.17 active phases. HDS measurements showed that the Co-Mo/CNT catalysts were more active than the Co-Mo/γ-Al2O3 ones for the desulfurization of DBT, and the hydrogenolysis/hydrogenation selectivity of the Co-Mo/CNT catalysts was also much higher than those of the Co-Mo/γ-Al2O3. The Co-Mo/CNT catalyst with a Co/Mo atomic ratio of 0.7 showed the highest activity, whereas the catalyst with a Co/Mo atomic ratio of 0.35 had the highest selectivity.

  7. Nanopore and nanoparticle catalysts.

    Science.gov (United States)

    Thomas, J M; Raja, R

    2001-01-01

    The design, atomic characterization, performance, and relevance to clean technology of two distinct categories of new nanocatalysts are described and interpreted. Exceptional molecular selectivity and high activity are exhibited by these catalysts. The first category consists of extended, crystallographically ordered inorganic solids possessing nanopores (apertures, cages, and channels), the diameters of which fall in the range of about 0.4 to about 1.5 nm, and the second of discrete bimetallic nanoparticles of diameter 1 to 2 nm, distributed more or less uniformly along the inner walls of mesoporous (ca. 3 to 10 nm diameter) silica supports. Using the principles and practices of solid-state and organometallic chemistry and advanced physico-chemical techniques for in situ and ex situ characterization, a variety of powerful new catalysts has been evolved. Apart from those that, inter alia, simulate the behavior of enzymes in their specificity, shape selectivity, regio-selectivity, and ability to function under ambient conditions, many of these new nanocatalysts are also viable as agents for effecting commercially significant processes in a clean, benign, solvent-free, single-step fashion. In particular, a bifunctional, molecular sieve nanopore catalyst is described that converts cyclohexanone in air and ammonia to its oxime and caprolactam, and a bimetallic nanoparticle catalyst that selectively converts cyclic polyenes into desirable intermediates. Nanocatalysts in the first category are especially effective in facilitating highly selective oxidations in air, and those in the second are well suited to effecting rapid and selective hydrogenations of a range of organic compounds.

  8. Heterogeneous chromium catalysts

    NARCIS (Netherlands)

    2005-01-01

    The present invention relates to a heterogeneous chromium catalyst system for the polymerisation of ethylene and/or alpha olefins prepared by the steps of: (a) providing a silica-containing support, (b) treating the silica-containing support with a chromium compound to form a chromium-based silica-c

  9. Olefin metathesis and catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Kukes, S. G.; Banks, R. L.

    1985-05-14

    Olefins are converted into other olefins having different numbers of carbon atoms by contact with a catalyst comprising an inorganic refractory oxide support containing at least one of tungsten oxide and molybdenum oxide and a promoting amount of at least one methylating agent under conditions suitable for the methylating agent compounds to promote the activity of tungsten and molybdenum oxides for the disproportionation reaction.

  10. Deactivation of Oxidation Catalysts

    Science.gov (United States)

    1991-05-01

    Levenspiel (Reference 10) have proposed an equivalent general expression of the form dS _KST (4) dtk to account for deactivation due to catalyst pore...Voorhies, A., IEC, 1954, vol. 37, p. 318. 10. Szepe, S., and 0. Levenspiel , Proc. 4th Europ. Symp. Chem. React. Eng., Pergamon Press, p. 265. 11. U.S

  11. Catalysts for Environmental Remediation

    DEFF Research Database (Denmark)

    Abrams, B. L.; Vesborg, Peter Christian Kjærgaard

    2013-01-01

    The properties of catalysts used in environmental remediation are described here through specific examples in heterogeneous catalysis and photocatalysis. In the area of heterogeneous catalysis, selective catalytic reduction (SCR) of NOx was used as an example reaction with vanadia and tungsta...

  12. Studies of Heterogeneous Catalyst Selectivity and Stability for Biorefining Applications

    Science.gov (United States)

    O'Neill, Brandon J.

    The conversion of raw resources into value-added end products has long underlain the importance of catalysts in economic and scientific development. In particular, the development of selective and stable heterogeneous catalysts is a challenge that continues to grow in importance as environmental, sociological, and economic concerns have motivated an interest in sustainability and the use of renewable raw materials. Within this context, biomass has been identified as the only realistic source of renewable carbon for the foreseeable future. The development of processes to utilize biomass feedstocks will require breakthroughs in fundamental understanding and practical solutions to the challenges related to selectivity and stability of the catalysts employed. Selectivity is addressed on multiple fronts. First, the selectivity for C-O bond scission reactions of a bifunctional, bimetallic RhRe/C catalyst is investigated. Using multiple techniques, the origin of Bronsted acidity in the catalyst and the role of pretreatment on the activity, selectivity, and stability are explored. In addition, reaction kinetics experiments and kinetic modeling are utilized to understand the role of chemical functional group (i.e. carboxylic acid versus formate ester) in determining the decarbonylation versus decarboxylation selectivity over a Pd/C catalyst. Finally, kinetic studies over Pd/C and Cu/gamma-Al2O3 were performed so that that may be paired with density functional theory calculations and microkinetic modeling to elucidate the elementary reaction mechanism, identify the active site, and provide a basis for future rational catalyst design. Next, the issue of catalyst stability, important in the high-temperature, liquid-phase conditions of biomass processing, is examined, and a method for stabilizing the base-metal nanoparticles of a Cu/gamma-Al2O 3 catalyst using atomic layer deposition (ALD) is developed. This advancement may facilitate the development of biorefining by enabling

  13. SCALEUP OF ALUMINUM PHOSPHATE CATALYST FOR PILOT PLANT LPDMEtm RUN

    Energy Technology Data Exchange (ETDEWEB)

    Andrew W. Wang

    2002-01-01

    The Liquid Phase Dimethyl Ether (LPDME{trademark}) process converts synthesis gas to dimethyl ether in a single slurry bubble column reactor. A mixed slurry of methanol synthesis catalyst and methanol dehydration catalyst in a neutral mineral oil simultaneously synthesizes methanol from syngas and converts some of it to dimethyl ether and water. The reaction scheme is shown below: 2H{sub 2} + CO = CH{sub 3}OH; 2CH{sub 3}OH = CH{sub 3}OCH{sub 3} + H{sub 2}O; H{sub 2}O + CO = CO{sub 2} + H{sub 2}. Most of the water produced in this reaction is converted to hydrogen by reduction with carbon monoxide (water gas shift reaction). This synergy permits higher per pass conversion than methanol synthesis alone. The enhancement in conversion occurs because dehydration of the methanol circumvents the equilibrium constraint of the syngas-to-methanol step. The slurry bubble column reactor provides the necessary heat transfer capacity to handle the greater heat duty associated with high conversion. In order to improve the stability of the catalyst system, non-stoichiometric aluminum phosphate was proposed as the dehydration catalyst for the LPDME{trademark} process. This aluminum phosphate material is a proprietary catalyst. This catalyst system of a standard methanol catalyst and the aluminum phosphate provided stable process performance that met the program targets under our standard test process conditions in the laboratory. These targets are (1) an initial methanol equivalent productivity of 28 gmol/kg/hr, (2) a CO{sub 2}-free, carbon selectivity of 80% to dimethyl ether and (3) stability of both catalysts equivalent to that of the methanol catalyst in the absence of the aluminum phosphate. A pilot plant trial of the LPDME{trademark} process using the aluminum phosphate catalyst was originally planned for March 1998 at the DOE-owned, Air Products (APCI)-operated facility at LaPorte, Texas. Because the aluminum phosphate catalyst is not commercially available, we initiated a

  14. SCALEUP OF ALUMINUM PHOSPHATE CATALYST FOR PILOT PLANT LPDMEtm RUN

    Energy Technology Data Exchange (ETDEWEB)

    Andrew W. Wang

    2002-05-15

    The Liquid Phase Dimethyl Ether (LPDME{trademark}) process converts synthesis gas to dimethyl ether in a single slurry bubble column reactor. A mixed slurry of methanol synthesis catalyst and methanol dehydration catalyst in a neutral mineral oil simultaneously synthesizes methanol from syngas and converts some of it to dimethyl ether and water. The reaction scheme is: 2H{sub 2} + CO = CH{sub 3}OH 2CH{sub 3}OH = CH{sub 3}OCH{sub 3} + H{sub 2}O H{sub 2}O + CO = CO{sub 2} + H{sub 2}. Most of the water produced in this reaction is converted to hydrogen by reduction with carbon monoxide (water gas shift reaction). This synergy permits higher per pass conversion than methanol synthesis alone. The enhancement in conversion occurs because dehydration of the methanol circumvents the equilibrium constraint of the syngas-to-methanol step. The slurry bubble column reactor provides the necessary heat transfer capacity to handle the greater heat duty associated with high conversion. In order to improve the stability of the catalyst system, non-stoichiometric aluminum phosphate was proposed as the dehydration catalyst for the LPDME{trademark} process. This aluminum phosphate material is a proprietary catalyst. This catalyst system of a standard methanol catalyst and the aluminum phosphate provided stable process performance that met the program targets under our standard test process conditions in the laboratory. These targets are (1) an initial methanol equivalent productivity of 28 gmol/kg/hr, (2) a CO{sub 2}-free, carbon selectivity of 80% to dimethyl ether and (3) stability of both catalysts equivalent to that of the methanol catalyst in the absence of the aluminum phosphate. A pilot plant trial of the LPDME{trademark} process using the aluminum phosphate catalyst was originally planned for March 1998 at the DOE-owned, Air Products (APCI)-operated facility at LaPorte, Texas. Because the aluminum phosphate catalyst is not commercially available, we initiated a scaleup project

  15. Partial oxidation of methane to syngas catalyzed by a nickel nanowire catalyst

    Institute of Scientific and Technical Information of China (English)

    Xuebin Hong; Yaquan Wang

    2009-01-01

    A nickel nanowire catalyst was prepared by a hard template method,and characterized by transmission electron microscopy (TEM),N2 physical adsorption,X-ray photoelectron spectrometry (XPS),X-ray diffraction (XRD) and H2 temperature-programmed reduction (H2-TPR).The catalytic properties of the nanowire catalyst in the partial oxidation of methane to syngas were compared with a metallic Ni catalyst which was prepared with nickel sponge.The characterization results showed that the nickel nanowire catalyst had high specific surface area and there was more NiO phase in the nickel nanowire catalyst than in the metallic Ni catalyst.The reaction results showed that the nickel nanowire catalyst had high CH4 conversion and selectivities for H2 and CO under low space velocity.

  16. 氢-水液相交换疏水催化剂制备及活性影响因素研究进展%Hydrophobic Catalysts for Liquid Phase Catalytic Exchange: A Review of Preparation Methods and Influencing Factors of Catalytic Activities

    Institute of Scientific and Technical Information of China (English)

    胡胜; 熊亮萍; 侯京伟; 罗顺忠; 罗阳明

    2012-01-01

    Liquid phase catalytic exchange (LPCE) between liquid water and gaseous hydrogen has been developed for various applications, such as tritium recovery, water upgrade and heavy-water production. Good wetproofing properties of the hydrophobic catalysts can make the reaction to proceed smoothly. In this article, the preparation methods of the hydrophobic catalysts and the factors affecting the catalytic activities are reviewed. In particular, progress on the hydrophobic Pt/C/inert carrier catalysts is introduced, including the selection of inert carrier and active metal carrier, and the preparation methods of carbon-supported Pt based catalysts. Basic research activities on controllable fabrication of hydro-phobic catalysts are discussed, including the LPCE reaction mechanism, and the relation between the microstructure of active metal and the catalytic activity, etc. Finally, questions remaining to be answered and future directions in the field of hydrophobic catalysts are dis-cussed.%氢-水液相催化交换反应(LPCE)可用于含氚废水处理、含氚重水提氚、重水升级和重水生产等工艺,疏水催化剂是实现LPCE的关键.本文对疏水催化剂的制备方法及活性影响因素进行了综述,重点介绍了Pt/C/惰性载体类疏水催化剂的研究进展,包括惰性载体、活性金属载体的选择,碳负载Pt基催化剂制备方法,详细介绍了围绕疏水催化剂制备开展的基础研究工作,如LPCE微观反应机理,活性金属微观结构与催化活性的关系等.对疏水催化剂这一领域有待解决的问题及下一步的研究方向进行了探讨.

  17. Molybdenum sulfide/carbide catalysts

    Science.gov (United States)

    Alonso, Gabriel; Chianelli, Russell R.; Fuentes, Sergio; Torres, Brenda

    2007-05-29

    The present invention provides methods of synthesizing molybdenum disulfide (MoS.sub.2) and carbon-containing molybdenum disulfide (MoS.sub.2-xC.sub.x) catalysts that exhibit improved catalytic activity for hydrotreating reactions involving hydrodesulfurization, hydrodenitrogenation, and hydrogenation. The present invention also concerns the resulting catalysts. Furthermore, the invention concerns the promotion of these catalysts with Co, Ni, Fe, and/or Ru sulfides to create catalysts with greater activity, for hydrotreating reactions, than conventional catalysts such as cobalt molybdate on alumina support.

  18. An Active and Stable Methanol Synthesis Catalyst for the Three-Phase Process%一种适用于三相过程的高活性和高稳定性的甲醇合成催化剂

    Institute of Scientific and Technical Information of China (English)

    王兆谦; 潘伟雄; 李晋鲁; 黎汉生; 王金福

    2003-01-01

    Methanol is one of the most important basic feedstock for the organic chemical industry and also is a potential fuel. Although the technology for the production of methanol is generally considered mature, much attention is still being paid to the improvements of the process, equipment and catalyst.

  19. The application of water-soluble ruthenium catalysts for the hydrogenation of the dichloromethane soluble fraction of fast pyrolysis oil and related model compounds in a two phase aqueous-organic system

    NARCIS (Netherlands)

    Mahfud, F.H.; Bussemaker, S.; Kooi, B.J.; ten Brink, Gert; Heeres, H.J.

    2007-01-01

    The hydrogenation of a dichloromethane soluble fraction of flash pyrolysis oil (bio-oil, BO), obtained by treatment of BO with a water–dichloromethane solvent mixture, was investigated using a water-soluble homogeneous ruthenium catalyst (RuCl3·3H2O/tris(m-sulfonatophenyl)phosphine, TPPTS). The

  20. Chemical Tagging Can Work: Identification of Stellar Phase-space Structures Purely by Chemical-abundance Similarity

    Science.gov (United States)

    Hogg, David W.; Casey, Andrew R.; Ness, Melissa; Rix, Hans-Walter; Foreman-Mackey, Daniel; Hasselquist, Sten; Ho, Anna Y. Q.; Holtzman, Jon A.; Majewski, Steven R.; Martell, Sarah L.; Mészáros, Szabolcs; Nidever, David L.; Shetrone, Matthew

    2016-12-01

    Chemical tagging promises to use detailed abundance measurements to identify spatially separated stars that were, in fact, born together (in the same molecular cloud) long ago. This idea has not yielded much practical success, presumably because of the noise and incompleteness in chemical-abundance measurements. We have succeeded in substantially improving spectroscopic measurements with The Cannon, which has now delivered 15 individual abundances for ∼ {10}5 stars observed as part of the APOGEE spectroscopic survey, with precisions around 0.04 dex. We test the chemical-tagging hypothesis by looking at clusters in abundance space and confirming that they are clustered in phase space. We identify (by the k-means algorithm) overdensities of stars in the 15-dimensional chemical-abundance space delivered by The Cannon, and plot the associated stars in phase space. We use only abundance-space information (no positional information) to identify stellar groups. We find that clusters in abundance space are indeed clusters in phase space, and we recover some known phase-space clusters and find other interesting structures. This is the first-ever project to identify phase-space structures at the survey-scale by blind search purely in abundance space; it verifies the precision of the abundance measurements delivered by The Cannon the prospects for future data sets appear very good.