National Library of Energy BETA

Sample records for topics catalysis homogeneous

  1. Homogeneous and Interfacial Catalysis in 3D Controlled Environment | The

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

    Ames Laboratory Homogeneous and Interfacial Catalysis in 3D Controlled Environment FWP/Project Description: Project Leader(s): Marek Pruski Principal Investigators: Marek Pruski, Aaron Sadow, Igor Slowing Key Scientific Personnel: Takeshi Kobayashi This collaborative research effort is geared toward bringing together the best features of homogeneous and heterogeneous catalysis for developing new catalytic principles. Novel silica-based, single-site mesoporous catalysts with controlled,

  2. Converting Homogeneous to Heterogeneous in Electrophilic Catalysis using Monodisperse Metal Nanoparticles

    SciTech Connect (OSTI)

    Witham, Cole A.; Huang, Wenyu; Tsung, Chia-Kuang; Kuhn, John N.; Somorjai, Gabor A.; Toste, F. Dean

    2009-10-15

    A continuing goal in catalysis is the transformation of processes from homogeneous to heterogeneous. To this end, nanoparticles represent a new frontier in heterogeneous catalysis, where this conversion is supplemented by the ability to obtain new or divergent reactivity and selectivity. We report a novel method for applying heterogeneous catalysts to known homogeneous catalytic reactions through the design and synthesis of electrophilic platinum nanoparticles. These nanoparticles are selectively oxidized by the hypervalent iodine species PhICl{sub 2}, and catalyze a range of {pi}-bond activation reactions previously only homogeneously catalyzed. Multiple experimental methods are utilized to unambiguously verify the heterogeneity of the catalytic process. The discovery of treatments for nanoparticles that induce the desired homogeneous catalytic activity should lead to the further development of reactions previously inaccessible in heterogeneous catalysis. Furthermore, our size and capping agent study revealed that Pt PAMAM dendrimer-capped nanoparticles demonstrate superior activity and recyclability compared to larger, polymer-capped analogues.

  3. ISHHC XIII International Symposium on the Relations betweenHomogeneous and Heterogeneous Catalysis

    SciTech Connect (OSTI)

    Somorjai , G.A.

    2007-06-11

    The International Symposium on Relations between Homogeneous and Heterogeneous Catalysis (ISHHC) has a long and distinguished history. Since 1974, in Brussels, this event has been held in Lyon, France (1977), Groeningen, The Netherlands (1981); Asilomar, California (1983); Novosibirsk, Russia (1986); Pisa, Italy (1989); Tokyo, Japan (1992); Balatonfuered, Hungary (1995); Southampton, United Kingdom (1999); Lyon, France (2001); Evanston, Illinois (2001) and Florence, Italy (2005). The aim of this international conference in Berkeley is to bring together practitioners in the three fields of catalysis, heterogeneous, homogeneous and enzyme, which utilize mostly nanosize particles. Recent advances in instrumentation, synthesis and reaction studies permit the nanoscale characterization of the catalyst systems, often for the same reaction, under similar experimental conditions. It is hoped that this circumstance will permit the development of correlations of these three different fields of catalysis on the molecular level. To further this goal we aim to uncover and focus on common concepts that emerge from nanoscale studies of structures and dynamics of the three types of catalysts. Another area of focus that will be addressed is the impact on and correlation of nanosciences with catalysis. There is information on the electronic and atomic structures of nanoparticles and their dynamics that should have importance in catalyst design and catalytic activity and selectivity.

  4. Surface functionalization of metal?organic polyhedron for homogeneous cyclopropanation catalysis

    SciTech Connect (OSTI)

    Lu, Weigang; Yuan, Daqiang; Yakovenko, Andrey; Zhou, Hong-Cai

    2012-03-13

    A super-paddlewheel (comprised of two paddlewheels) metal-organic polyhedron (MOP) containing surface hydroxyl groups was synthesized and characterized. Condensation reactions with linear alkyl anhydrides lead to new MOPs with enhanced solubility. As a result, the surface-modified MOP 4 was demonstrated as a homogeneous Lewis-acid catalyst.

  5. Is It Homogeneous or Heterogeneous Catalysis Derived from [RhCp*Cl2]2? In Operando-XAFS, Kinetic and Crucial Kinetic Poisoning Evidence for Subnanometer Rh4 Cluster-Based Benzene Hydrogenation Catalysis

    SciTech Connect (OSTI)

    Bayram, Ercan; Linehan, John C.; Fulton, John L.; Roberts, John A.; Szymczak, Nathaniel; Smurthwaite, Tricia D.; Ozkar, Saim; Balasubramanian, Mahalingam; Finke, Richard G.

    2011-11-23

    Determining the true, kinetically dominant catalytically active species, in the classic benzene hydrogenation system pioneered by Maitlis and co-workers 34 years ago starting with [RhCp*Cl2]2 (Cp* = [{eta}5-C5(CH3)5]), has proven to be one of the most challenging case studies in the quest to distinguish single-metal-based 'homogeneous' from polymetallic, 'heterogeneous' catalysis. The reason, this study will show, is the previous failure to use the proper combination of (i) operando spectroscopy to determine the dominant form(s) of the precatalyst's mass under catalysis (i.e., operating) conditions, plus then and crucially also (ii) the previous lack of the necessary kinetic studies, catalysis being a 'wholly kinetic phenomenon' as J. Halpern long ago noted. An important contribution from this study will be to reveal the power of quantitiative kinetic poisoning experiments for distinguishing single-metal, or in this case subnanometer Rh4 cluster-based catalysis from larger, polymetallic Rh(0)n nanoparticle catalysis, at least under favorable conditions. The combined operando-XAFS (X-ray absorption fine structure) spectroscopy and kinetic evidences provide a compelling case for Rh4-based, with average stoichiometry 'Rh4Cp*2.4Cl4Hc', benzene hydrogenation catalysis in 2-propanol with added Et3N and at 100 C and 50 atm initial H2 pressure. The results also reveal, however, that if even ca. 1.4% of the total soluble Rh(0)n had formed nanoparticles, then those Rh(0)n nanoparticles would have been able to account for all the observed benzene hydrogenation catalytic rate (using commercial, ca. 2 nm, polyethyleneglycol-dodecylether hydrosol stabilized Rh(0)n nanoparticles as a model system). The results 'especially the poisoning methodology developed and employed' are of significant, broader interest since determining the nature of the true catalyst continues to be a central, often vexing issue in any and all catalytic reactions. The results are also of fundamental interest in that they add to a growing body of evidence indicating that certain, appropriately ligated, coordinatively unsaturated, subnanometer M4 transition-metal clusters can be relatively robust catalysts. Also demonstrated herein is that Rh4 clusters are poisoned by Hg(0), demonstrating for the first time that the classic Hg(0) poisoning test of 'homogeneous' vs 'heterogeneous'catalysts cannot distinguish Rh4-based subnanometer catalysts from Rh(0)n nanoparticle catalysts, at least for the present examples of these two specific, Rh-based catalysts.

  6. Virtual special issue on catalysis at the U.S. Department of Energy's National Laboratories

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

    Pruski, Marek; Sadow, Aaron D.; Slowing, Igor I.; Marshall, Christopher L.; Stair, Peter; Rodriguez, Jose; Harris, Alex; Somorjai, Gabor A.; Biener, Juergen; Matranga, Christopher; et al

    2016-04-21

    Here the catalysis research at the U.S. Department of Energy's (DOE's) National Laboratories covers a wide range of research topics in heterogeneous catalysis, homogeneous/molecular catalysis, biocatalysis, electrocatalysis, and surface science. Since much of the work at National Laboratories is funded by DOE, the research is largely focused on addressing DOE's mission to ensure America's security and prosperity by addressing its energy, environmental, and nuclear challenges through transformative science and technology solutions.

  7. Low temperature, sulfur tolerant homogeneous catalysts for the water-gas shift reaction. Task 1, Topical report No. 1

    SciTech Connect (OSTI)

    Laine, R.M.

    1986-01-20

    The purpose of this report is to update and reorganize our recent review on homogeneous catalysis of the water-gas shift reaction (WGSR) based on recent literature publications and patents. This updated version will serve as a means of selecting 10 candidate catalyst systems for use in developing effective, sulfur-tolerant, low temperature WGSR catalysts. This report discusses the variations possible in the basic chemistry associated with WGSR catalytic cycles, including basic, acidic, and neutral conditions. Then individual mechanism for specific WGSR catalyst systems are discussed. Finally, on the basis of the literature reports, a list is presented of candidate catalysts and basic systems we have chosen for study in Task 3.

  8. Fabrication of Carbon-Platinum Interdigitated Array Electrodes and Their Application for Investigating Homogeneous Hydrogen Evolution Catalysis

    SciTech Connect (OSTI)

    Liu, Fei; Divan, Ralu; Parkinson, Bruce A.

    2015-06-29

    Carbon interdigitated array (IDA) electrodes have been applied to study the homogeneous hydrogen evolution electrocatalyst [Ni(PPh2NBn2)2]2+ (where PPh2NBn2 is 1,5-dibenzyl-3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane). The existence of reaction intermediates in the catalytic cycle is inferred from the electrochemical behavior of a glassy carbon disk electrodes and carbon IDA electrodes. The currents on IDA electrodes for an EC (electron transfer reaction followed by a catalytic reaction) mechanism are derived from the number of redox cycles and the contribution of non-catalytic currents. The catalytic reaction rate constant was then extracted from the IDA current equations. Applying the IDA current and kinetic equations to the electrochemical response of the [Ni(PPh2NBn2)2]2+ catalyst yielded a rate constant of 0.10 s-1 for the hydrogen evolution reaction that agrees with the literature value. The quantitative analysis of IDA cyclic voltammetry can be used as a simple and straightforward method for determining rate constants in other catalytic systems. This work was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for DOE. Use of the Center for Nanoscale Materials was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357.

  9. Catalysis Workshop

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

    Opportunities in Catalysis Research Using Synchrotron Radiation Stanford Synchrotron Radiation Laboratory October 8-9, 2002 Organizer: Anders Nilsson Chemical catalysis is one of the research areas of enormous importance for the industrial society. There are important challenges to be met in the near future where development of new processes and catalysts are a necessity. We need to find a way to make methanol from methane, split water into hydrogen using sunlight, find replacement of platinum

  10. DOE Laboratory Catalysis Research Symposium - Abstracts

    SciTech Connect (OSTI)

    Dunham, T.

    1999-02-01

    The conference consisted of two sessions with the following subtopics: (1) Heterogeneous Session: Novel Catalytic Materials; Photocatalysis; Novel Processing Conditions; Metals and Sulfides; Nuclear Magnetic Resonance; Metal Oxides and Partial Oxidation; Electrocatalysis; and Automotive Catalysis. (2) Homogeneous Catalysis: H-Transfer and Alkane Functionalization; Biocatalysis; Oxidation and Photocatalysis; and Novel Medical, Methods, and Catalyzed Reactions.

  11. Center for Biological Electron Transfer and Catalysis (BETCy...

    Office of Science (SC) Website

    Research Topics solar (fuels), biofuels (including algae and biomass), bio-inspired, ... 5 GrandChallenge 2 Grand Challenge 2 BES Reports Catalysis Hydrogen Solar Energy

  12. Workshop: Synchrotron Applications in Chemical Catalysis | Stanford

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

    Synchrotron Radiation Lightsource Synchrotron Applications in Chemical Catalysis Tuesday, October 25, 2011 - 8:00am 2011 SSRL/LCLS Annual Users Conference This workshop, part of the 2011 SSRL/LCLS Annual Users Conference, will focus on understanding processes in homogeneous (both biological and small molecule) and heterogeneous catalysis, using synchrotron-based methods. The workshop will cover more traditional applications (using XANES and EXAFS), as well as applications of XES, RIXS and

  13. Seventh BES (Basic Energy Sciences) catalysis and surface chemistry research conference

    SciTech Connect (OSTI)

    Not Available

    1990-03-01

    Research programs on catalysis and surface chemistry are presented. A total of fifty-seven topics are included. Areas of research include heterogeneous catalysis; catalysis in hydrogenation, desulfurization, gasification, and redox reactions; studies of surface properties and surface active sites; catalyst supports; chemical activation, deactivation; selectivity, chemical preparation; molecular structure studies; sorption and dissociation. Individual projects are processed separately for the data bases. (CBS)

  14. A Hydrogen-Evolving Ni(P2N2)2 Electrocatalyst Covalently Attached to a Glassy Carbon Electrode: Preparation, Characterization, and Catalysis. Comparisons With the Homogeneous Analog

    SciTech Connect (OSTI)

    Das, Atanu K.; Engelhard, Mark H.; Bullock, R. Morris; Roberts, John A.

    2014-07-07

    A hydrogen-evolving homogeneous Ni(P2N2)2 electrocatalyst with peripheral ester groups has been covalently attached to a 1,2,3-triazolyllithium-terminated glassy carbon electrode. The surface-confined complex is an electroctalyst for hydrogen evolution, showing onset of catalytic current at the same potential as the soluble parent complex. X-ray photoemission spectra show excellent agreement between the coupled and homogeneous species. Coverage approaches a dense monolayer. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the US Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for the US Department of Energy. The XPS measurements were performed at EMSL, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory.

  15. 2012 Catalysis Lectures

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

    Catalysis Lectures May 21-24 2012 Bert Weckhuysen Bert Weckhuysen, who holds the chair of Inorganic Chemistry and Catalysis at Utrecht University, will give a series of catalysis lectures during his sabbatical period at Stanford University and SLAC. (1) "Characterization of Heterogeneous Catalysts: Possibilities and Limitations of In-situ Spectroscopy" (Part I) Monday, May 21, 2012, 4.30-6 p.m. Location: SLAC Redwood Conference Room C&D (2) "Characterization of Heterogeneous

  16. Neutrons for Catalysis: A Workshop on Neutron Scattering Techniques for Studies in Catalysis

    SciTech Connect (OSTI)

    Overbury, Steven {Steve} H; Coates, Leighton; Herwig, Kenneth W; Kidder, Michelle

    2011-10-01

    This report summarizes the Workshop on Neutron Scattering Techniques for Studies in Catalysis, held at the Spallation Neutron Source (SNS) at Oak Ridge National Laboratory (ORNL) on September 16 and 17, 2010. The goal of the Workshop was to bring experts in heterogeneous catalysis and biocatalysis together with neutron scattering experimenters to identify ways to attack new problems, especially Grand Challenge problems in catalysis, using neutron scattering. The Workshop locale was motivated by the neutron capabilities at ORNL, including the High Flux Isotope Reactor (HFIR) and the new and developing instrumentation at the SNS. Approximately 90 researchers met for 1 1/2 days with oral presentations and breakout sessions. Oral presentations were divided into five topical sessions aimed at a discussion of Grand Challenge problems in catalysis, dynamics studies, structure characterization, biocatalysis, and computational methods. Eleven internationally known invited experts spoke in these sessions. The Workshop was intended both to educate catalyst experts about the methods and possibilities of neutron methods and to educate the neutron community about the methods and scientific challenges in catalysis. Above all, it was intended to inspire new research ideas among the attendees. All attendees were asked to participate in one or more of three breakout sessions to share ideas and propose new experiments that could be performed using the ORNL neutron facilities. The Workshop was expected to lead to proposals for beam time at either the HFIR or the SNS; therefore, it was expected that each breakout session would identify a few experiments or proof-of-principle experiments and a leader who would pursue a proposal after the Workshop. Also, a refereed review article will be submitted to a prominent journal to present research and ideas illustrating the benefits and possibilities of neutron methods for catalysis research.

  17. Zeolite catalysis: technology

    SciTech Connect (OSTI)

    Heinemann, H.

    1980-07-01

    Zeolites have been used as catalysts in industry since the early nineteen sixties. The great majority of commercial applications employ one of three zeolite types: zeolite Y; Mordenite; ZSM-5. By far the largest use of zeolites is in catalytic cracking, and to a lesser extent in hydrocracking. This paper reviews the rapid development of zeolite catalysis and its application in industries such as: the production of gasoline by catalytic cracking of petroleum; isomerization of C/sub 5/ and C/sub 6/ paraffin hydrocarbons; alkylation of aromatics with olefins; xylene isomerization; and conversion of methanol to gasoline.

  18. Electron Microscopy Catalysis Projects: Success Stories from...

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

    Electron Microscopy Catalysis Projects: Success Stories from the High Temperature Materials Laboratory (HTML) User Program Electron Microscopy Catalysis Projects: Success Stories ...

  19. Catalysis and Synthesis | Argonne National Laboratory

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

    Catalysis and Synthesis Catalysis and Synthesis Many different types of chemical reactions depend on catalysts in order to work, and the hunt for better catalysts has deep...

  20. Catalysis Capabilities | Argonne National Laboratory

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

    Catalysis Research Areas Facilities and Equipment Intellectual Property Publications Staff Partnerships Licensing Sponsored Research Technical Services Technologist in Residence News Press Releases Feature Stories In the News Photos Videos Ombudsman Ombudsman Argonne National Laboratory Technology Development and Commercialization About Technologies Available for Licensing Capabilities Partnerships News Capabilities Catalysis Research Areas Facilities and Equipment Intellectual Property

  1. 2013 DOE Catalysis Working Group Meeting Agenda | Department...

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

    DOE Catalysis Working Group Meeting Agenda 2013 DOE Catalysis Working Group Meeting Agenda Agenda for the 2013 DOE Catalysis Working Group Meeting on May 15, 2013. PDF icon...

  2. Topic Committee

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

    RAP Work Plan Topics Page 1 of 3 Topic Committee Potential FY 2016 Action/Product Context (from FY 2016 HAB Work Plan) 6-Month Status (IM, Committee, Advice, Deferred, No Action) 1. 100 Area retrieval process, K Basin RAP Project update (May not be ready until 2017 for an update; work ready in 2018 per milestone)  Attended tour in October 2015, including visit to MO-500/Sludge Annex facility 2. 100 D/H Proposed Plan RAP Project update Cleanup of soils and groundwater at D/H. Are the proposed

  3. Topic Committee

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

    TWC Work Plan Topics Page 1 of 2 Topic Committee Potential FY 2016 Action/Product Context (from FY 2016 HAB Work Plan) 6-Month Status (IM, Committee, Advice, Deferred, No Action) 11. AY-102 status update TWC Project update Provide updates on the planning, design, and installation of the equipment to begin pumping waste from double-shell tank AY-102 no later than March 4, 2016.  Received briefing on A/AX tank farms retrieval at committee in September 2015  Attended tour in October 2015,

  4. Enhanced Micellar Catalysis LDRD.

    SciTech Connect (OSTI)

    Betty, Rita G.; Tucker, Mark David; Taggart, Gretchen; Kinnan, Mark K.; Glen, Crystal Chanea; Rivera, Danielle; Sanchez, Andres; Alam, Todd Michael

    2012-12-01

    The primary goals of the Enhanced Micellar Catalysis project were to gain an understanding of the micellar environment of DF-200, or similar liquid CBW surfactant-based decontaminants, as well as characterize the aerosolized DF-200 droplet distribution and droplet chemistry under baseline ITW rotary atomization conditions. Micellar characterization of limited surfactant solutions was performed externally through the collection and measurement of Small Angle X-Ray Scattering (SAXS) images and Cryo-Transmission Electron Microscopy (cryo-TEM) images. Micellar characterization was performed externally at the University of Minnesota's Characterization Facility Center, and at the Argonne National Laboratory Advanced Photon Source facility. A micellar diffusion study was conducted internally at Sandia to measure diffusion constants of surfactants over a concentration range, to estimate the effective micelle diameter, to determine the impact of individual components to the micellar environment in solution, and the impact of combined components to surfactant phase behavior. Aerosolized DF-200 sprays were characterized for particle size and distribution and limited chemical composition. Evaporation rates of aerosolized DF-200 sprays were estimated under a set of baseline ITW nozzle test system parameters.

  5. Biomimetic Chalcogels for Solar Fuel Catalysis | ANSER Center...

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

    Biomimetic Chalcogels for Solar Fuel Catalysis Home > Research > ANSER Research Highlights > Biomimetic Chalcogels for Solar Fuel Catalysis...

  6. Integrated Mesoscale Architectures for Sustainable Catalysis...

    Office of Science (SC) Website

    Integrated Mesoscale Architectures for Sustainable Catalysis (IMASC) Energy Frontier ... science, molecular dynamics (MD), density functional theory (DFT), quantum ...

  7. Catalysis Working Group Meeting: June 2015

    Broader source: Energy.gov [DOE]

    Agenda and presentations from the Catalysis Working Group meeting held on June 8, 2015, in Arlington, Virginia.

  8. Reaction Selectivity in Heterogeneous Catalysis

    SciTech Connect (OSTI)

    Somorjai, Gabor A.; Kliewer, Christopher J.

    2009-02-02

    The understanding of selectivity in heterogeneous catalysis is of paramount importance to our society today. In this review we outline the current state of the art in research on selectivity in heterogeneous catalysis. Current in-situ surface science techniques have revealed several important features of catalytic selectivity. Sum frequency generation vibrational spectroscopy has shown us the importance of understanding the reaction intermediates and mechanism of a heterogeneous reaction, and can readily yield information as to the effect of temperature, pressure, catalyst geometry, surface promoters, and catalyst composition on the reaction mechanism. DFT calculations are quickly approaching the ability to assist in the interpretation of observed surface spectra, thereby making surface spectroscopy an even more powerful tool. HP-STM has revealed three vitally important parameters in heterogeneous selectivity: adsorbate mobility, catalyst mobility, and selective site-blocking. The development of size controlled nanoparticles from 0.8 to 10 nm, of controlled shape, and of controlled bimetallic composition has revealed several important variables for catalytic selectivity. Lastly, DFT calculations may be paving the way to guiding the composition choice for multi-metallic heterogeneous catalysis for the intelligent design of catalysts incorporating the many factors of selectivity we have learned.

  9. Workshop: Synchrotron Applications in Chemical Catalysis | Stanford...

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

    Applications in Chemical Catalysis Tuesday, October 25, 2011 - 8:00am 2011 SSRLLCLS Annual Users Conference This workshop, part of the 2011 SSRLLCLS Annual Users...

  10. Biochemical Conversion: Using Hydrolysis, Fermentation, and Catalysis...

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

    Biochemical Conversion: Using Hydrolysis, Fermentation, and Catalysis to Make Fuels and Chemicals BETO works with the emerging U.S. bioindustry to sustainably convert non-food ...

  11. Basic Research Needs: Catalysis for Energy

    SciTech Connect (OSTI)

    Bell, Alexis T.; Gates, Bruce C.; Ray, Douglas; Thompson, Michael R.

    2008-03-11

    The report presents results of a workshop held August 6-8, 2007, by DOE SC Basic Energy Sciences to determine the basic research needs for catalysis research.

  12. The energy landscape of ;#8203;adenylate kinase during catalysis...

    Office of Scientific and Technical Information (OSTI)

    The energy landscape of ;8203;adenylate kinase during catalysis Citation Details In-Document Search Title: The energy landscape of ;8203;adenylate kinase during catalysis ...

  13. Materials Design and Discovery: Catalysis and Energy Storage...

    Office of Scientific and Technical Information (OSTI)

    Materials Design and Discovery: Catalysis and Energy Storage (Mira Early Science Program ... Citation Details In-Document Search Title: Materials Design and Discovery: Catalysis and ...

  14. Pre-Competitive Catalysis Research: Fundamental Sulfation/Desulfation...

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

    Pre-Competitive Catalysis Research: Fundamental SulfationDesulfation Studies of Lean NOx Traps Pre-Competitive Catalysis Research: Fundamental SulfationDesulfation Studies of...

  15. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

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

    More Documents & Publications Low-Temperature HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Low-Temperature HydrocarbonCO Oxidation Catalysis in Support ...

  16. Biomimetic Chalcogels for Solar Fuel Catalysis | ANSER Center |

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

    Argonne-Northwestern National Laboratory Biomimetic Chalcogels for Solar Fuel Catalysis Home > Research > ANSER Research Highlights > Biomimetic Chalcogels for Solar Fuel Catalysis

  17. Transmural Catalysis - High Efficiency Catalyst Systems for NOx...

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

    Transmural Catalysis - High Efficiency Catalyst Systems for NOx Adsorbers and SCR Transmural Catalysis - High Efficiency Catalyst Systems for NOx Adsorbers and SCR Presentation ...

  18. "Nanocrystal bilayer for tandem catalysis"

    SciTech Connect (OSTI)

    Yamada, Yusuke; Tsung, Chia Kuang; Huang, Wenyu; Huo, Ziyang; E.Habas, Susan E; Soejima, Tetsuro; Aliaga, Cesar E; Samorjai, Gabor A; Yang, Peidong

    2011-01-24

    Supported catalysts are widely used in industry and can be optimized by tuning the composition and interface of the metal nanoparticles and oxide supports. Rational design of metal-metal oxide interfaces in nanostructured catalysts is critical to achieve better reaction activities and selectivities. We introduce here a new class of nanocrystal tandem catalysts that have multiple metal-metal oxide interfaces for the catalysis of sequential reactions. We utilized a nanocrystal bilayer structure formed by assembling platinum and cerium oxide nanocube monolayers of less than 10 nm on a silica substrate. The two distinct metal-metal oxide interfaces, CeO2-Pt and Pt-SiO2, can be used to catalyse two distinct sequential reactions. The CeO2-Pt interface catalysed methanol decomposition to produce CO and H2, which were subsequently used for ethylene hydroformylation catalysed by the nearby Pt-SiO2 interface. Consequently, propanal was produced selectively from methanol and ethylene on the nanocrystal bilayer tandem catalyst. This new concept of nanocrystal tandem catalysis represents a powerful approach towards designing high-performance, multifunctional nanostructured catalysts

  19. CABS | U.S. DOE Office of Science (SC)

    Office of Science (SC) Website

    Research Topics: catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), ... GC5 Non-equilibrium BRN Addressed CombustionTransportation Fuels Solar Energy Utilization

  20. Center for Catalysis at Iowa State University

    SciTech Connect (OSTI)

    Kraus, George A.

    2006-10-17

    The overall objective of this proposal is to enable Iowa State University to establish a Center that enjoys world-class stature and eventually enhances the economy through the transfer of innovation from the laboratory to the marketplace. The funds have been used to support experimental proposals from interdisciplinary research teams in areas related to catalysis and green chemistry. Specific focus areas included: Catalytic conversion of renewable natural resources to industrial materials Development of new catalysts for the oxidation or reduction of commodity chemicals Use of enzymes and microorganisms in biocatalysis Development of new, environmentally friendly reactions of industrial importance These focus areas intersect with barriers from the MYTP draft document. Specifically, section 2.4.3.1 Processing and Conversion has a list of bulleted items under Improved Chemical Conversions that includes new hydrogenation catalysts, milder oxidation catalysts, new catalysts for dehydration and selective bond cleavage catalysts. Specifically, the four sections are: 1. Catalyst development (7.4.12.A) 2. Conversion of glycerol (7.4.12.B) 3. Conversion of biodiesel (7.4.12.C) 4. Glucose from starch (7.4.12.D) All funded projects are part of a soybean or corn biorefinery. Two funded projects that have made significant progress toward goals of the MYTP draft document are: Catalysts to convert feedstocks with high fatty acid content to biodiesel (Kraus, Lin, Verkade) and Conversion of Glycerol into 1,3-Propanediol (Lin, Kraus). Currently, biodiesel is prepared using homogeneous base catalysis. However, as producers look for feedstocks other than soybean oil, such as waste restaurant oils and rendered animal fats, they have observed a large amount of free fatty acids contained in the feedstocks. Free fatty acids cannot be converted into biodiesel using homogeneous base-mediated processes. The CCAT catalyst system offers an integrated and cooperative catalytic system that performs both esterification (of free fatty acids) and transesterification (of soybean oil) in a one-pot fashion. This will allow the biodiesel producers to use the aforementioned cheap feedstocks without any pretreatment. In addition, the catalyst system is heterogeneous and is highly recyclable and reusable. Although markets currently exist for glycerin, concern is mounting that the price of glycerin may plummet to $.05 - $.10 per pound if future production exceeds demand. Developing a system to make high value chemicals such as 1,3-propanediol from the glycerin stream will add value for biodiesel producers who implement the new technology. Given the fact that both DuPont and Shell chemicals have announced the commercialization of two new PDO-based polymers, a rapid increase of market demand for a cheaper PDO source is very likely. 4. Comparison of actual accomplishments with goals and objectives From our progress reports, the four areas are: 1. Catalyst development (7.4.12.A) 2. Conversion of glycerol (7.4.12.B) 3. Conversion of biodiesel (7.4.12.C) 4. Glucose from starch (7.4.12.D)

  1. Nanocrystal assembly for tandem catalysis

    DOE Patents [OSTI]

    Yang, Peidong; Somorjai, Gabor; Yamada, Yusuke; Tsung, Chia-Kuang; Huang, Wenyu

    2014-10-14

    The present invention provides a nanocrystal tandem catalyst comprising at least two metal-metal oxide interfaces for the catalysis of sequential reactions. One embodiment utilizes a nanocrystal bilayer structure formed by assembling sub-10 nm platinum and cerium oxide nanocube monolayers on a silica substrate. The two distinct metal-metal oxide interfaces, CeO.sub.2--Pt and Pt--SiO.sub.2, can be used to catalyze two distinct sequential reactions. The CeO.sub.2--Pt interface catalyzed methanol decomposition to produce CO and H.sub.2, which were then subsequently used for ethylene hydroformylation catalyzed by the nearby Pt--SiO.sub.2 interface. Consequently, propanal was selectively produced on this nanocrystal bilayer tandem catalyst.

  2. Catalysis Working Group Meeting: June 2014

    Broader source: Energy.gov [DOE]

    Agenda and presentations from the Catalysis Working Group held on June 16, 2014, in Washington, D.C., in conjunction with the DOE Hydrogen and Fuel Cells Program Annual Merit Review and Peer Evaluation Meeting.

  3. Catalysis Working Group Meeting: May 2013

    Broader source: Energy.gov [DOE]

    Information from the Catalysis Working Group meeting held on May 15, 2013, in Arlington, Virginia, in conjunction with the DOE Hydrogen and Fuel Cells Program Annual Merit Review and Peer Evaluation Meeting.

  4. Center for Molecular Electrocatalysis (CME) | U.S. DOE Office...

    Office of Science (SC) Website

    To understand and design molecular electrocatalysts for conversions between electrical energy and chemical energy. Research Topics catalysis (homogeneous), solar (fuels), ...

  5. Advanced Resources for Catalysis Science; Recommendations for a National Catalysis Research Institute

    SciTech Connect (OSTI)

    Peden, Charles HF.; Ray, Douglas

    2005-10-05

    Catalysis is one of the most valuable contributors to our economy and historically an area where the United States has enjoyed, but is now losing, international leadership. While other countries are stepping up their work in this area, support for advanced catalysis research and development in the U.S. has diminished. Yet, more than ever, innovative and improved catalyst technologies are imperative for new energy production processes to ease our dependence on imported resources, for new energy-efficient and environmentally benign chemical production processes, and for new emission reduction technologies to minimize the environmental impact of an active and growing economy. Addressing growing concerns about the future direction of U.S. catalysis science, experts from the catalysis community met at a workshop to determine and recommend advanced resources needed to address the grand challenges for catalysis research and development. The workshop's primary conclusion: To recapture our position as the leader in catalysis innovation and practice, and promote crucial breakthroughs, the U.S. must establish one or more well-funded and well-equipped National Catalysis Research Institutes competitively selected, centered in the national laboratories and, by charter, networked to other national laboratories, universities, and industry. The Institute(s) will be the center of a national collaboratory that gives catalysis researchers access to the most advanced techniques available in the scientific enterprise. The importance of catalysis to our energy, economic, and environmental security cannot be overemphasized. Catalysis is a vital part of our core industrial infrastructure, as it is integral to chemical processing and petroleum refining, and is critical to proposed advances needed to secure a sustainable energy future. Advances in catalysis could reduce our need for foreign oil by making better use of domestic carbon resources, for example, allowing cost-effective and zero emission conversion of coal into transportation fuels. No matter what energy sources are being considered (oil, natural gas, coal, biomass, solar, or nuclear based), a clean, sustainable energy future will involve catalysis to improve energy efficiency and storage and use options, and to mitigate environmental impacts. Recent revolutionary advances in nanotechnology and high-performance computing are enabling the breakthroughs in catalysis science and technology essential for a secure energy future. Thus, the time is right for substantially increased investments in catalysis science and technology.

  6. TEC Communications Topic Group

    Office of Environmental Management (EM)

    procurement - Routing criteriaemergency preparedness Tribal Issues Topic Group * TEPP Navajo Nation (Tom Clawson) - 1404 - Needs Assessment * Identified strengths and...

  7. HOMOGENEOUS NUCLEAR POWER REACTOR

    DOE Patents [OSTI]

    King, L.D.P.

    1959-09-01

    A homogeneous nuclear power reactor utilizing forced circulation of the liquid fuel is described. The reactor does not require fuel handling outside of the reactor vessel during any normal operation including complete shutdown to room temperature, the reactor being selfregulating under extreme operating conditions and controlled by the thermal expansion of the liquid fuel. The liquid fuel utilized is a uranium, phosphoric acid, and water solution which requires no gus exhaust system or independent gas recombining system, thereby eliminating the handling of radioiytic gas.

  8. Shining Light on Catalysis | Stanford Synchrotron Radiation Lightsourc...

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

    Shining Light on Catalysis Tuesday, July 19, 2011 - 4:38pm SSRL Conference Room 137-322 Jeroen A. van Bokhoven, Professor for Heterogeneous Catalysis Institute for Chemical and...

  9. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis ALS X-Rays Shine a New Light on Catalysis Print Thursday, 21 May 2015 11:16 Electrocatalysts are responsible for expediting reactions in...

  10. Catalysis Science | U.S. DOE Office of Science (SC)

    Office of Science (SC) Website

    Catalysis Science Chemical Sciences, Geosciences, & Biosciences (CSGB) Division CSGB Home ... principles enabling rational catalyst design and chemical transformation control. ...

  11. Opportunities in Catalysis Research Using Synchrotron Radiation

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

    in Catalysis Research Using Synchrotron Radiation Tuesday 10/8/02 Chair: Lars Pettersson 1:30-1:40 Anders Nilsson Welcome 1:40-2:30 Gabor Somorjai University of California, Berkeley and LBLN Need for New Directions of Research at the Frontiers of Catalysis Science 2:30-3:00 Geoff Thornton University of Manchester Influence of defects on the reactivity of ZnO 3:00-3:30 Anders Nilsson Stanford Synchrotron Radiation Laboratory Soft X-ray Spectroscopy of Surfaces and Reactions 3:30-3:45 Break Chair:

  12. HOMOGENEOUS NUCLEAR REACTOR

    DOE Patents [OSTI]

    Hammond, R.P.; Busey, H.M.

    1959-02-17

    Nuclear reactors of the homogeneous liquid fuel type are discussed. The reactor is comprised of an elongated closed vessel, vertically oriented, having a critical region at the bottom, a lower chimney structure extending from the critical region vertically upwardly and surrounded by heat exchanger coils, to a baffle region above which is located an upper chimney structure containing a catalyst functioning to recombine radiolyticallydissociated moderator gages. In operation the liquid fuel circulates solely by convection from the critical region upwardly through the lower chimney and then downwardly through the heat exchanger to return to the critical region. The gases formed by radiolytic- dissociation of the moderator are carried upwardly with the circulating liquid fuel and past the baffle into the region of the upper chimney where they are recombined by the catalyst and condensed, thence returning through the heat exchanger to the critical region.

  13. Heterogeneous Catalysis for Thermochemical Conversion | Bioenergy | NREL

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

    Heterogeneous Catalysis for Thermochemical Conversion Our mission is to transform thermal biomass deconstruction products (syngas and pyrolysis oil) into the fuels and chemicals that keep society moving forward. Figure includes three panels. The first pane, labeled single-source precursors, depicts a bis(triphenylphosphine)rhodium(I) carbonyl chloride single-source precursor for producing rhodium phosphide nanoparticles, shown by a vertical line labeled PPh3 at the top, Rh in the middle, and

  14. USD Catalysis Group for Alternative Energy

    SciTech Connect (OSTI)

    Hoefelmeyer, James D.; Koodali, Ranjit; Sereda, Grigoriy; Engebretson, Dan; Fong, Hao; Puszynski, Jan; Shende, Rajesh; Ahrenkiel, Phil

    2012-03-13

    The South Dakota Catalysis Group (SDCG) is a collaborative project with mission to develop advanced catalysts for energy conversion with two primary goals: (1) develop photocatalytic systems in which polyfunctionalized TiO2 are the basis for hydrogen/oxygen synthesis from water and sunlight (solar fuels group), (2) develop new materials for hydrogen utilization in fuel cells (fuel cell group). In tandem, these technologies complete a closed chemical cycle with zero emissions.

  15. Nanoscale Advances in Catalysis and Energy Applications

    SciTech Connect (OSTI)

    Li, Yimin; Somorjai, Gabor A.

    2010-05-12

    In this perspective, we present an overview of nanoscience applications in catalysis, energy conversion, and energy conservation technologies. We discuss how novel physical and chemical properties of nanomaterials can be applied and engineered to meet the advanced material requirements in the new generation of chemical and energy conversion devices. We highlight some of the latest advances in these nanotechnologies and provide an outlook at the major challenges for further developments.

  16. ARM - Topic List

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

    TeachersTopic List Outreach Home Room News Publications Traditional Knowledge Kiosks Barrow, Alaska Tropical Western Pacific Site Tours Contacts Students Study Hall About ARM Global Warming FAQ Just for Fun Meet our Friends Cool Sites Teachers Teachers' Toolbox Lesson Plans Topic List Atmosphere Atmospheric Heat Budget Atmospheric Pressure Composition of the Atmosphere Evolution of the Atmosphere Mesosphere Stratosphere Thermosphere Troposphere Oceans Oceans Sea Surface and Sea Level Weather and

  17. Thermochemical Conversion: Using Heat and Catalysis to Make Biofuels and

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

    Bioproducts | Department of Energy Conversion: Using Heat and Catalysis to Make Biofuels and Bioproducts Thermochemical Conversion: Using Heat and Catalysis to Make Biofuels and Bioproducts The Bioenergy Technologies Office works with industry to develop pathways that use heat, pressure, and catalysis to convert domestic, non-food biomass into gasoline, jet fuel, and other products. PDF icon thermochemical_four_pager.pdf More Documents & Publications 2013 Peer Review

  18. Catalysis Working Group Meeting: January 2015 | Department of Energy

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

    January 2015 Catalysis Working Group Meeting: January 2015 The Catalysis Working Group held a meeting on January 21, 2015, in Los Alamos, New Mexico. Meeting Agenda and Presentations PDF icon Catalysis Working Group January 2015 Meeting Agenda PDF icon Electrocatalysts with Ultra-Low PGM Loadings-Vojislav Stamenkovic, Argonne National Laboratory PDF icon Improving Stability and Activity of Pt Monolayer in Non-Pt Core-Shell Electrocatalysts-Radoslav Adzic, Brookhaven National Laboratory PDF icon

  19. Shining Light on Catalysis | Stanford Synchrotron Radiation Lightsource

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

    Shining Light on Catalysis Tuesday, July 19, 2011 - 4:38pm SSRL Conference Room 137-322 Jeroen A. van Bokhoven, Professor for Heterogeneous Catalysis Institute for Chemical and Bioengineering ETH Zurich Head of Laboratory for Catalysis and Sustainable Chemistry (LSK) Swiss Light Source Paul Scherrer Institute Understanding a functioning catalyst requires understanding at the atomic scales in a time-resolved manner. X-rays can be readily used to accomplish that task, because of the large

  20. Catalysis by Design: Bridging the Gap between Theory and Experiments...

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

    Catalysis by Design: Bridging the Gap between Theory and Experiments Poster presentation at the 2007 Diesel Engine-Efficiency & Emissions Research Conference (DEER 2007). 13-16 ...

  1. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme...

  2. Materials Design and Discovery: Catalysis and Energy Storage...

    Office of Scientific and Technical Information (OSTI)

    Materials Design and Discovery: Catalysis and Energy Storage (Mira Early Science Program Final Technical Report): ALCF-2 Early Science Program Technical Report Citation Details ...

  3. Control Heterogeneous Catalysis at Atomic and Electronic-level...

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

    Control Heterogeneous Catalysis at Atomic and Electronic-level Using Intermetallic Compounds Precious metals and metal alloys are important heterogeneous catalysts for renewable...

  4. Catalysis by Design - Theoretical and Experimental Studies of...

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

    Design - Theoretical and Experimental Studies of Model Catalysts for Lean NOx Treatment Catalysis by Design - Theoretical and Experimental Studies of Model Catalysts for Lean NOx ...

  5. Catalysis | U.S. DOE Office of Science (SC)

    Office of Science (SC) Website

    Catalysis Basic Energy Sciences Advisory Committee (BESAC) BESAC Home Meetings Meeting Presentations History Logistics BESAC 2016-2017 Membership ChargesReports Charter .pdf file ...

  6. Topical Committee | Department of Energy

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

    Topical Committee Topical Committee In the interest of optimum technology transfer, the DOE Technical Standards Program (TSP) has set up a network of topical committees. These committees provide a forum for communication across the DOE complex on technical standards related activities. If you would like information about a specific topical committee, or wish to join one of the groups, we've provided a roster of TSP Topical Committees and corresponding Topical Committee Chairpersons. Expectations

  7. Plasma-Activated Lean NOx Catalysis for Heavy-Duty Diesel Emissions...

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

    Plasma-Activated Lean NOx Catalysis for Heavy-Duty Diesel Emissions Control Plasma-Activated Lean NOx Catalysis for Heavy-Duty Diesel Emissions Control PDF icon ...

  8. UNIRIB: Physics Topics

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

    Physics Topics Research Capitalizing on the strengths of nine collaborating research universities and the world-class equipment available at the Holifield Radioactive Ion Beam Facility (HRIBF) at Oak Ridge National Laboratory (ORNL), the University Radioactive Ion Beam (UNIRIB) consortium is conducting research at the forefront of nuclear physics. UNIRIB, a division of the Oak Ridge Institute for Science and Education (ORISE), brings together researchers from around the world to study the

  9. Featured Topic Pages

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

    Featured Topic Pages * Renowned scientists, with information about the scientists' R&D results * Significant DOE research disciplines, with R&D results * Manhattan Project, including scientists and key events Laureates * Nobel Prize winners associated with DOE and predecessor agencies * Winners of the Enrico Fermi Award, a U.S. Presidential award Database * Selected documents about noteworthy R&D results * Documents and individual pages searchable by word or phrase * Tag cloud

  10. Manufacturing Innovation Topics Workshop

    Broader source: Energy.gov [DOE]

    The Advanced Manufacturing Office (AMO) and the Office of the Secretary of Defense Manufacturing Technology Program (OSD ManTech) will host a workshop to discuss AMO's recent Request for Information (RFI) on Clean Energy Manufacturing Topic Areas as well as the recent areas of interest announced by OSD ManTech for a new Manufacturing Innovation Institute on October 8-9, 2014 in Fort Worth, TX.

  11. Computationally Optimized Homogenization Heat Treatment of Metal...

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

    Return to Search Computationally Optimized Homogenization Heat Treatment of Metal Alloys ... PDF Document Publication Computationally Optimized Homogenization Heat Treatment of Metal ...

  12. TECHNICAL STANDARDS PROGRAM TOPICAL COMMITTEES

    Broader source: Energy.gov [DOE]

    PurposeThis procedure describes how topical committees are organized and recognized under the Technical Standards Program. 

  13. Catalysis Working Group Kick-Off Meeting Agenda

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

    Arlington, VA - May 14, 2012 Catalysis Working Group Kick-off Meeting Co-Chairs: Piotr Zelenay Los Alamos National Laboratory Nancy L. Garland U.S. Department of Energy 2 2...

  14. Catalysis Working Group Kick-Off Meeting Agenda

    Broader source: Energy.gov [DOE]

    Agenda for the kick-off meeting of the U.S. Department of Energy Fuel Cell Technologies Program's Catalysis Working Group, held May 14, 2012, in Arlington, Virginia.

  15. Materials Design and Discovery: Catalysis and Energy Storage (Mira Early

    Office of Scientific and Technical Information (OSTI)

    Science Program Final Technical Report): ALCF-2 Early Science Program Technical Report (Technical Report) | SciTech Connect Materials Design and Discovery: Catalysis and Energy Storage (Mira Early Science Program Final Technical Report): ALCF-2 Early Science Program Technical Report Citation Details In-Document Search Title: Materials Design and Discovery: Catalysis and Energy Storage (Mira Early Science Program Final Technical Report): ALCF-2 Early Science Program Technical Report Authors:

  16. Theoretical Study on Catalysis by Protein Enzymes and Ribozyme

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

    Theoretical Study on Catalysis by Protein Enzymes and Ribozyme Theoretical Study on Catalysis by Protein Enzymes and Ribozyme 2000 NERSC Annual Report 17shkarplus.jpg The energetics were determined for three mechanisms proposed for TIM catalyzed reactions. Results from reaction path calculations suggest that the two mechanisms that involve an enediol intermediate are likely to occur, while the direct intra-substrate proton transfer mechanism (in green) is energetically unfavorable due to the

  17. Biochemical Conversion: Using Hydrolysis, Fermentation, and Catalysis to

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

    Make Fuels and Chemicals | Department of Energy Biochemical Conversion: Using Hydrolysis, Fermentation, and Catalysis to Make Fuels and Chemicals Biochemical Conversion: Using Hydrolysis, Fermentation, and Catalysis to Make Fuels and Chemicals BETO works with the emerging U.S. bioindustry to sustainably convert non-food biomass resources into cost-competitive biofuels, biopower, and bioproducts. PDF icon biochemical_four_pager.pdf More Documents & Publications Replacing the Whole

  18. Visualizing Group II Intron Catalysis through the Stages of Splicing

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: Visualizing Group II Intron Catalysis through the Stages of Splicing Citation Details In-Document Search Title: Visualizing Group II Intron Catalysis through the Stages of Splicing Authors: Marcia, Marco ; Pyle, Anna Marie [1] ; HHMI) [2] + Show Author Affiliations (Yale) ( Publication Date: 2013-01-10 OSTI Identifier: 1054354 Resource Type: Journal Article Resource Relation: Journal Name: Cell; Journal

  19. Outer sphere hydrogenation catalysis (Journal Article) | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    Outer sphere hydrogenation catalysis Citation Details In-Document Search Title: Outer sphere hydrogenation catalysis Authors: Eisenstein, Odile ; Crabtree, Robert H Publication Date: 2013-01-01 OSTI Identifier: 1080563 DOE Contract Number: SC0001055 Resource Type: Journal Article Resource Relation: Journal Name: New J. Chem.; Journal Volume: 37; Related Information: CETM partners with General Electric Global Research (lead); Lawrence Berkeley National Laboratory; Stanford University; Yale

  20. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis ALS X-Rays Shine a New Light on Catalysis Print Thursday, 21 May 2015 11:16 Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab

  1. Dedicated Beamline Facilities for Catalytic Research. Synchrotron Catalysis Consortium (SCC)

    SciTech Connect (OSTI)

    Chen, Jingguang; Frenkel, Anatoly; Rodriguez, Jose; Adzic, Radoslav; Bare, Simon R.; Hulbert, Steve L.; Karim, Ayman; Mullins, David R.; Overbury, Steve

    2015-03-04

    Synchrotron spectroscopies offer unique advantages over conventional techniques, including higher detection sensitivity and molecular specificity, faster detection rate, and more in-depth information regarding the structural, electronic and catalytic properties under in-situ reaction conditions. Despite these advantages, synchrotron techniques are often underutilized or unexplored by the catalysis community due to various perceived and real barriers, which will be addressed in the current proposal. Since its establishment in 2005, the Synchrotron Catalysis Consortium (SCC) has coordinated significant efforts to promote the utilization of cutting-edge catalytic research under in-situ conditions. The purpose of the current renewal proposal is aimed to provide assistance, and to develop new sciences/techniques, for the catalysis community through the following concerted efforts: Coordinating the implementation of a suite of beamlines for catalysis studies at the new NSLS-II synchrotron source; Providing assistance and coordination for catalysis users at an SSRL catalysis beamline during the initial period of NSLS to NSLS II transition; Designing in-situ reactors for a variety of catalytic and electrocatalytic studies; Assisting experimental set-up and data analysis by a dedicated research scientist; Offering training courses and help sessions by the PIs and co-PIs.

  2. Some General Themes in Catalysis at LANL

    SciTech Connect (OSTI)

    Gordon, John C.

    2012-07-19

    Some general themes in catalysis at LANL are: (1) Storage and release of energy within chemical bonds (e.g. H{sub 2} storage in and release from covalent bonds, N{sub 2} functionalization, CO{sub 2} functionalization, H{sub 2} oxidation/evolution, O{sub 2} reduction/evolution); (2) Can we control the chemistry of reactive substrates to effect energy relevant transformations in non-traditional media (e.g. can we promote C-C couplings, dehydrations, or hydrogenations in water under relatively mild conditions)? (3) Can we supplant precious metal or rare earth catalysts to effect these transformations, by using earth abundant metals/elements instead? Can we use organocatalysis and circumvent the use of metals completely? (4) Can we improve upon existing rare earth catalyst systems (e.g. in rare earth oxides pertinent to fluid cracking or polymerization) and reduce amounts required for catalytic efficacy? Carbohydrates can be accessed from non-food based biomass sources such as woody residues and switchgrass. After extracted from the plant source, our goal is to upgrade these classes of molecules into useful fuels.

  3. Coherence delay augmented laser beam homogenizer

    DOE Patents [OSTI]

    Rasmussen, P.; Bernhardt, A.

    1993-06-29

    The geometrical restrictions on a laser beam homogenizer are relaxed by ug a coherence delay line to separate a coherent input beam into several components each having a path length difference equal to a multiple of the coherence length with respect to the other components. The components recombine incoherently at the output of the homogenizer, and the resultant beam has a more uniform spatial intensity suitable for microlithography and laser pantogography. Also disclosed is a variable aperture homogenizer, and a liquid filled homogenizer.

  4. Invariant distributions on compact homogeneous spaces

    SciTech Connect (OSTI)

    Gorbatsevich, V V

    2013-12-31

    In this paper, we study distributions on compact homogeneous spaces, including invariant distributions and also distributions admitting asub-Riemannian structure. We first consider distributions of dimension 1 and 2 on compact homogeneous spaces. After this, we study the cases of compact homogeneous spaces of dimension 2, 3, and 4 in detail. Invariant distributions on simply connected compact homogeneous spaces are also treated. Bibliography: 18 titles.

  5. Coherence delay augmented laser beam homogenizer

    DOE Patents [OSTI]

    Rasmussen, Paul (Livermore, CA); Bernhardt, Anthony (Berkeley, CA)

    1993-01-01

    The geometrical restrictions on a laser beam homogenizer are relaxed by ug a coherence delay line to separate a coherent input beam into several components each having a path length difference equal to a multiple of the coherence length with respect to the other components. The components recombine incoherently at the output of the homogenizer, and the resultant beam has a more uniform spatial intensity suitable for microlithography and laser pantogography. Also disclosed is a variable aperture homogenizer, and a liquid filled homogenizer.

  6. Special Topics and Data Reports

    U.S. Energy Information Administration (EIA) Indexed Site

    (HTML format) Yellow Arrow Energy Consumption and Expenditures (HTML format) adobe logo Download Acrobat Reader for viewing PDF files. Special Topics and Data Reports...

  7. [Zeolite catalysis in conversion of cellulosics

    SciTech Connect (OSTI)

    Tsao, G.T.

    1992-12-31

    To transform biomass into fermentable substrate for yeast, we are using zeolites instead of enzymes to catalyze the two bottleneck reactions in biomass conversion, xylose isomerization and ceuobiose hydrolysis. The experimental results on these reactions carried out over various zeolites and other catalysts are presented herein. The advantages and disadvantages of using these catalysts over enzymes are also discussed. Heterogeneous solid catalysts other than zeolites has been employed for cellobiose-to-glucose hydrolysis. The size and shape selectivity that makes zeoutes unique for some reactions can add diffusional hindrance. We have spent some time screening various known solid acidic catalysts. We report that a class of cationic ion exchange resins in the acidified form (e.g. Amberlite) has worked well as an acidic catalyst in hydrolyzing cellobiose to glucose. Our experimental results, together with those obtained from a homogeneous acid catalyst (e.g. sulfuric acid) for comparison are provided. Having succeeded in finding an alternative solid acid catalyst for hydrolysis, we explored other solid resin or other homogeneous but non-enzyme catalyst to carry out the xylose-to-xylulose isomerization. A fairly extensive search has been made. We explored the use of sodium aluminates in the homogeneous phase isomerization of glucose to fructose and obtained a very high conversion of glucose to fructose with the final mixture containing 85% of fructose instead of the common 45%. Fructose apparently complexes with aluminates, and its equilibrium concentration is shifted to considerably higher values than permitted by simple glucose/fructose equilibrium. We have recently found a number of catalysts capable of promoting isomerization between aldoses and ketoses. One solid resin, known as polyvinyl pyridine (PVP), is able to convert xylose to xylulose at a pH below 7. Our usage of alternative isomerization catalysts, including PVP, are described.

  8. [Zeolite catalysis in conversion of cellulosics

    SciTech Connect (OSTI)

    Tsao, G.T.

    1992-01-01

    To transform biomass into fermentable substrate for yeast, we are using zeolites instead of enzymes to catalyze the two bottleneck reactions in biomass conversion, xylose isomerization and ceuobiose hydrolysis. The experimental results on these reactions carried out over various zeolites and other catalysts are presented herein. The advantages and disadvantages of using these catalysts over enzymes are also discussed. Heterogeneous solid catalysts other than zeolites has been employed for cellobiose-to-glucose hydrolysis. The size and shape selectivity that makes zeoutes unique for some reactions can add diffusional hindrance. We have spent some time screening various known solid acidic catalysts. We report that a class of cationic ion exchange resins in the acidified form (e.g. Amberlite) has worked well as an acidic catalyst in hydrolyzing cellobiose to glucose. Our experimental results, together with those obtained from a homogeneous acid catalyst (e.g. sulfuric acid) for comparison are provided. Having succeeded in finding an alternative solid acid catalyst for hydrolysis, we explored other solid resin or other homogeneous but non-enzyme catalyst to carry out the xylose-to-xylulose isomerization. A fairly extensive search has been made. We explored the use of sodium aluminates in the homogeneous phase isomerization of glucose to fructose and obtained a very high conversion of glucose to fructose with the final mixture containing 85% of fructose instead of the common 45%. Fructose apparently complexes with aluminates, and its equilibrium concentration is shifted to considerably higher values than permitted by simple glucose/fructose equilibrium. We have recently found a number of catalysts capable of promoting isomerization between aldoses and ketoses. One solid resin, known as polyvinyl pyridine (PVP), is able to convert xylose to xylulose at a pH below 7. Our usage of alternative isomerization catalysts, including PVP, are described.

  9. One- and two-dimensional infrared spectroscopic studies of solution-phase homogeneous catalysis and spin-forbidden reactions

    SciTech Connect (OSTI)

    Sawyer, Karma Rae

    2008-12-12

    Understanding chemical reactions requires the knowledge of the elementary steps of breaking and making bonds, and often a variety of experimental techniques are needed to achieve this goal. The initial steps occur on the femto- through picosecond time-scales, requiring the use of ultrafast spectroscopic methods, while the rate-limiting steps often occur more slowly, requiring alternative techniques. Ultrafast one and two-dimensional infrared and step-scan FTIR spectroscopies are used to investigate the photochemical reactions of four organometallic complexes. The analysis leads to a detailed understanding of mechanisms that are general in nature and may be applicable to a variety of reactions.

  10. Study of catalysis of coal gasification at elevated pressures. [Evaluation

    Office of Scientific and Technical Information (OSTI)

    of 20 compounds at 850/sup 0/C] (Journal Article) | SciTech Connect Study of catalysis of coal gasification at elevated pressures. [Evaluation of 20 compounds at 850/sup 0/C] Citation Details In-Document Search Title: Study of catalysis of coal gasification at elevated pressures. [Evaluation of 20 compounds at 850/sup 0/C] Authors: Haynes, W.P. ; Neilson, H. [1] ; Field, J.H. + Show Author Affiliations (US Bur. Mines, Pittsburgh, PA) Publication Date: 1971-01-01 OSTI Identifier: 5238924

  11. Events & Topics | Metrolink Tour | Photosynthetic Antenna Research Center

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

    Events & Topics | Metrolink Tour Events & Topics | Metrolink Tour

  12. AQUEOUS HOMOGENEOUS REACTORTECHNICAL PANEL REPORT

    SciTech Connect (OSTI)

    Diamond, D.J.; Bajorek, S.; Bakel, A.; Flanagan, G.; Mubayi, V.; Skarda, R.; Staudenmeier, J.; Taiwo, T.; Tonoike, K.; Tripp, C.; Wei, T.; Yarsky, P.

    2010-12-03

    Considerable interest has been expressed for developing a stable U.S. production capacity for medical isotopes and particularly for molybdenum- 99 (99Mo). This is motivated by recent re-ductions in production and supply worldwide. Consistent with U.S. nonproliferation objectives, any new production capability should not use highly enriched uranium fuel or targets. Conse-quently, Aqueous Homogeneous Reactors (AHRs) are under consideration for potential 99Mo production using low-enriched uranium. Although the Nuclear Regulatory Commission (NRC) has guidance to facilitate the licensing process for non-power reactors, that guidance is focused on reactors with fixed, solid fuel and hence, not applicable to an AHR. A panel was convened to study the technical issues associated with normal operation and potential transients and accidents of an AHR that might be designed for isotope production. The panel has produced the requisite AHR licensing guidance for three chapters that exist now for non-power reactor licensing: Reac-tor Description, Reactor Coolant Systems, and Accident Analysis. The guidance is in two parts for each chapter: 1) standard format and content a licensee would use and 2) the standard review plan the NRC staff would use. This guidance takes into account the unique features of an AHR such as the fuel being in solution; the fission product barriers being the vessel and attached systems; the production and release of radiolytic and fission product gases and their impact on operations and their control by a gas management system; and the movement of fuel into and out of the reactor vessel.

  13. Homogeneous catalysts in hypersonic combustion

    SciTech Connect (OSTI)

    Harradine, D.M.; Lyman, J.L.; Oldenborg, R.C.; Pack, R.T.; Schott, G.L.

    1989-01-01

    Density and residence time both become unfavorably small for efficient combustion of hydrogen fuel in ramjet propulsion in air at high altitude and hypersonic speed. Raising the density and increasing the transit time of the air through the engine necessitates stronger contraction of the air flow area. This enhances the kinetic and thermodynamic tendency of H/sub 2/O to form completely, accompanied only by N/sub 2/ and any excess H/sub 2/(or O/sub 2/). The by-products to be avoided are the energetically expensive fragment species H and/or O atoms and OH radicals, and residual (2H/sub 2/ plus O/sub 2/). However, excessive area contraction raises air temperature and consequent combustion-product temperature by adiabatic compression. This counteracts and ultimately overwhelms the thermodynamic benefit by which higher density favors the triatomic product, H/sub 2/O, over its monatomic and diatomic alternatives. For static pressures in the neighborhood of 1 atm, static temperature must be kept or brought below ca. 2400 K for acceptable stability of H/sub 2/O. Another measure, whose requisite chemistry we address here, is to extract propulsive work from the combustion products early in the expansion. The objective is to lower the static temperature of the combustion stream enough for H/sub 2/O to become adequately stable before the exhaust flow is massively expanded and its composition ''frozen.'' We proceed to address this mechanism and its kinetics, and then examine prospects for enhancing its rate by homogeneous catalysts. 9 refs.

  14. Lean NOx Trap Catalysis for Lean Natural Gas Engine Applications

    SciTech Connect (OSTI)

    Parks, II, James E; Storey, John Morse; Theiss, Timothy J; Ponnusamy, Senthil; Ferguson, Harley Douglas; Williams, Aaron M; Tassitano, James B

    2007-09-01

    Distributed energy is an approach for meeting energy needs that has several advantages. Distributed energy improves energy security during natural disasters or terrorist actions, improves transmission grid reliability by reducing grid load, and enhances power quality through voltage support and reactive power. In addition, distributed energy can be efficient since transmission losses are minimized. One prime mover for distributed energy is the natural gas reciprocating engine generator set. Natural gas reciprocating engines are flexible and scalable solutions for many distributed energy needs. The engines can be run continuously or occasionally as peak demand requires, and their operation and maintenance is straightforward. Furthermore, system efficiencies can be maximized when natural gas reciprocating engines are combined with thermal energy recovery for cooling, heating, and power applications. Expansion of natural gas reciprocating engines for distributed energy is dependent on several factors, but two prominent factors are efficiency and emissions. Efficiencies must be high enough to enable low operating costs, and emissions must be low enough to permit significant operation hours, especially in non-attainment areas where emissions are stringently regulated. To address these issues the U.S. Department of Energy and the California Energy Commission launched research and development programs called Advanced Reciprocating Engine Systems (ARES) and Advanced Reciprocating Internal Combustion Engines (ARICE), respectively. Fuel efficiency and low emissions are two primary goals of these programs. The work presented here was funded by the ARES program and, thus, addresses the ARES 2010 goals of 50% thermal efficiency (fuel efficiency) and <0.1 g/bhp-hr emissions of oxides of nitrogen (NOx). A summary of the goals for the ARES program is given in Table 1-1. ARICE 2007 goals are 45% thermal efficiency and <0.015 g/bhp-hr NOx. Several approaches for improving the efficiency and emissions of natural gas reciprocating engines are being pursued. Approaches include: stoichiometric engine operation with exhaust gas recirculation and three-way catalysis, advanced combustion modes such as homogeneous charge compression ignition, and extension of the lean combustion limit with advanced ignition concepts and/or hydrogen mixing. The research presented here addresses the technical approach of combining efficient lean spark-ignited natural gas combustion with low emissions obtained from a lean NOx trap catalyst aftertreatment system. This approach can be applied to current lean engine technology or advanced lean engines that may result from related efforts in lean limit extension. Furthermore, the lean NOx trap technology has synergy with hydrogen-assisted lean limit extension since hydrogen is produced from natural gas during the lean NOx trap catalyst system process. The approach is also applicable to other lean engines such as diesel engines, natural gas turbines, and lean gasoline engines; other research activities have focused on those applications. Some commercialization of the technology has occurred for automotive applications (both diesel and lean gasoline engine vehicles) and natural gas turbines for stationary power. The research here specifically addresses barriers to commercialization of the technology for large lean natural gas reciprocating engines for stationary power. The report presented here is a comprehensive collection of research conducted by Oak Ridge National Laboratory (ORNL) on lean NOx trap catalysis for lean natural gas reciprocating engines. The research was performed in the Department of Energy's ARES program from 2003 to 2007 and covers several aspects of the technology. All studies were conducted at ORNL on a Cummins C8.3G+ natural gas engine chosen based on industry input to simulate large lean natural gas engines. Specific technical areas addressed by the research include: NOx reduction efficiency, partial oxidation and reforming chemistry, and the effects of sulfur poisons on the partial oxidation, reformer, and lean NOx trap catalysts. The initial work on NOx reduction efficiency demonstrated that NOx emissions <0.1 g/bhp-hr (the ARES goal) can be achieved with the lean NOx trap catalyst technology. Subsequent work focused on cost and size optimization and durability issues which addressed two specific ARES areas of interest to industry ('Cost of Power' and 'Availability, Reliability, and Maintainability', respectively). Thus, the research addressed the approach of the lean NOx trap catalyst technology toward the ARES goals as shown in Table 1-1.

  15. Frontiers, Opportunities, and Challenges in Biochemical and Chemical Catalysis of CO2

    SciTech Connect (OSTI)

    Appel, Aaron M.; Bercaw, John E.; Bocarsly, Andrew B.; Dobbek, Holger; DuBois, Daniel L.; Dupuis, Michel; Ferry, James G.; Fujita, Etsuko; Hille, Russ; Kenis, Paul; Kerfeld, Cheryl A.; Morris, Robert H.; Peden, Charles HF; Portis, Archie; Ragsdale, Steve; Rauchfuss, Thomas B.; Reek, Joost; Seefeldt, Lance C.; Thauer, Rudolf K.; Waldrop, Grover L.

    2013-08-14

    Our central premise is that catalytic scientists can learn by studying how these important metabolic processes occur in nature. Complementarily, biochemists can learn by studying how catalytic scientists view these same chemical transformations promoted by synthetic catalysts. From these studies, hypotheses can be developed and tested through manipulation of enzyme structure and by synthesizing simple molecular catalysts to incorporate different structural features of the enzymes. It is hoped that these studies will lead to new and useful concepts in catalyst design for fuel production and utilization. This paper describes the results of a workshop held to explore these concepts in regard to the development of new and more efficient catalytic processes for the conversion of CO2 to a variety of carbon-based fuels. The organization of this overview/review is as follows: 1) The first section briefly explores how interactions between the catalysis and biological communities have been fruitful in developing new catalysts for the reduction of protons to hydrogen, the simplest fuel generation reaction. 2) The second section assesses the state of the art in both biological and chemical reduction of CO2 by two electrons to form either carbon monoxide (CO) or formate (HCOO-). It also attempts to identify common principles between biological and synthetic catalysts and productive areas for future research. 3) The third section explores both biological and chemical processes that result in the reduction of CO2 beyond the level of CO and formate, again seeking to identify common principles and productive areas of future research. 4) The fourth section explores the formation of carbon-carbon bonds in biological and chemical systems in the same vein as the other sections. 5) A fifth section addresses the role of non-redox reactions of CO2 in biological systems and their role in carbon metabolism, with a parallel discussion of chemical systems. 6) In section 6, the topics of electrode modification, photochemical systems, and tandem catalysis are briefly discussed. These areas may be important for developing practical systems for CO2 reduction, and they share the common theme of coupling chemical reactions. 7) Section 7 describes some of the crosscutting activities that are critical for advancing the science underpinning catalyst development. 8) The last section attempts to summarize common issues in biological and chemical catalysis and to identify challenges that must be addressed to achieve practical catalysts that are suitable for the reduction of CO2 to fuels.

  16. TEC Working Group Topic Groups Archives Consolidated Grant Topic Group

    Broader source: Energy.gov [DOE]

    The Consolidated Grant Topic Group arose from recommendations provided by the TEC and other external parties to the DOE Senior Executive Transportation Forum in July 1998. It was proposed that the consolidation of multiple funding streams from numerous DOE sources into a single grant would provide a more equitable and efficient means of assistance to States and Tribes affected by DOE nuclear material shipments.

  17. More About "Topic A" and "Topic B" Awards | Department of Energy

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

    of major new long-distance transmission facilities and networks. Topic A, Interconnection-Level Analysis and Planning Learn more about "Topic A" requirements Topic B, ...

  18. Molecular-Level Design of Heterogeneous Chiral Catalysis

    SciTech Connect (OSTI)

    Francisco Zaera

    2012-03-21

    The following is a proposal to continue our multi-institutional research on heterogeneous chiral catalysis. Our team combines the use of surface-sensitive analytical techniques for the characterization of model systems with quantum and statistical mechanical calculations to interpret experimental data and guide the design of future research. Our investigation focuses on the interrelation among the three main mechanisms by which enantioselectivity can be bestowed to heterogeneous catalysts, namely: (1) by templating chirality via the adsorption of chiral supramolecular assemblies, (2) by using chiral modifiers capable of forming chiral complexes with the reactant and force enantioselective surface reactions, and (3) by forming naturally chiral surfaces using imprinting chiral agents. Individually, the members of our team are leaders in these various aspects of chiral catalysis, but the present program provides the vehicle to generate and exploit the synergies necessary to address the problem in a comprehensive manner. Our initial work has advanced the methodology needed for these studies, including an enantioselective titration procedure to identify surface chiral sites, infrared spectroscopy in situ at the interface between gases or liquids and solids to mimic realistic catalytic conditions, and DFT and Monte Carlo algorithms to simulate and understand chirality on surfaces. The next step, to be funded by the monies requested in this proposal, is to apply those methods to specific problems in chiral catalysis, including the identification of the requirements for the formation of supramolecular surface structures with enantioselective behavior, the search for better molecules to probe the chiral nature of the modified surfaces, the exploration of the transition from supramolecular to one-to-one chiral modification, the correlation of the adsorption characteristics of one-to-one chiral modifiers with their physical properties, in particular with their configuration, and the development of ways to imprint chiral centers on achiral solid surfaces. Chiral catalysis is not only a problem of great importance in its own right, but also the ultimate test of how to control selectivity in catalysis. The time is ripe for fundamental work in heterogeneous chiral catalysis to provide the U.S. with a leadership role in developing the next generation of catalytic processes for medicinal and agrochemical manufacturing. Our team provides the required expertise for a synergistic and comprehensive integration of physical and chemical experimentation with solid state and molecular reactivity theories to solve this problem.

  19. Methanol Synthesis over Cu/ZnO/Al2O3: The Active Site in Industrial Catalysis

    SciTech Connect (OSTI)

    Behrens, Malte

    2012-03-28

    Unlike homogeneous catalysts, heterogeneous catalysts that have been optimized through decades are typically so complex and hard to characterize that the nature of the catalytically active site is not known. This is one of the main stumbling blocks in developing rational catalyst design strategies in heterogeneous catalysis. We show here how to identify the crucial atomic structure motif for the industrial Cu/ZnO/Al{sub 2}O{sub 3} methanol synthesis catalyst. Using a combination of experimental evidence from bulk-, surface-sensitive and imaging methods collected on real high-performance catalytic systems in combination with DFT calculations. We show that the active site consists of Cu steps peppered with Zn atoms, all stabilized by a series of well defined bulk defects and surface species that need jointly to be present for the system to work.

  20. Low temperature, sulfur tolerant homogeneous catalysts for the water-gas shift reaction

    SciTech Connect (OSTI)

    Laine, R.M.

    1986-01-20

    The purpose of this report is to update and reorganize our recent review on homogeneous catalysis of the water-gas shift reaction (WGSR) based on recent literature publications and patents. This updated version will serve as a means of selecting 10 candidate catalyst systems for use in developing effective, sulfur-tolerant, low temperature WGSR catalysts. This report discusses the variations possible in the basic chemistry associated with WGSR catalytic cycles, including basic, acidic, and neutral conditions. Then individual mechanism for specific WGSR catalyst systems are discussed. Finally, on the basis of the literature reports, a list is presented of candidate catalysts and basic systems we have chosen for study in Task 3.

  1. Physics Topics - MST - UW Plasma Physics

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

    Physics Topics UW Madison Madison Symmetric Torus Physics Topics MST HomeGraduate Student InformationLinksTourControl and Auxiliary SystemsPhysics TopicsDeviceResearch MissionMST ...

  2. Recent advances of lanthanum-based perovskite oxides for catalysis

    SciTech Connect (OSTI)

    Zhu, Huiyuan; Zhang, Pengfei; Dai, Sheng

    2015-09-21

    There is a need to reduce the use of noble metal elements especially in the field of catalysis, where noble metals are ubiquitously applied. To this end, perovskite oxides, an important class of mixed oxide, have been attracting increasing attention for decades as potential replacements. Benefiting from the extraordinary tunability of their compositions and structures, perovskite oxides can be rationally tailored and equipped with targeted physical and chemical properties e.g. redox behavior, oxygen mobility, and ion conductivity for enhanced catalysis. Recently, the development of highly efficient perovskite oxide catalysts has been extensively studied. This review article summarizes the recent development of lanthanum-based perovskite oxides as advanced catalysts for both energy conversion applications and traditional heterogeneous reactions.

  3. Recent advances of lanthanum-based perovskite oxides for catalysis

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

    Zhu, Huiyuan; Zhang, Pengfei; Dai, Sheng

    2015-09-21

    There is a need to reduce the use of noble metal elements especially in the field of catalysis, where noble metals are ubiquitously applied. To this end, perovskite oxides, an important class of mixed oxide, have been attracting increasing attention for decades as potential replacements. Benefiting from the extraordinary tunability of their compositions and structures, perovskite oxides can be rationally tailored and equipped with targeted physical and chemical properties e.g. redox behavior, oxygen mobility, and ion conductivity for enhanced catalysis. Recently, the development of highly efficient perovskite oxide catalysts has been extensively studied. This review article summarizes the recent developmentmore » of lanthanum-based perovskite oxides as advanced catalysts for both energy conversion applications and traditional heterogeneous reactions.« less

  4. Missouri Botanical Gardens Tour | Events & Topics | Photosynthetic...

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

    | Events & Topics Missouri Botanical Gardens Tour | Events & Topics PARC welcomed community members for our guided tour of the Missouri Botanical Garden. http:...

  5. TEC Working Group Topic Groups Archives

    Broader source: Energy.gov [DOE]

    The following Topic Groups are no longer active; however, related documents and notes for these archived Topic Groups are available through the following links:

  6. Iron Catalysis in Oxidations by Ozone - Energy Innovation Portal

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

    Find More Like This Return to Search Iron Catalysis in Oxidations by Ozone Ames Laboratory Contact AMES About This Technology Technology Marketing Summary Ozone is used commercially for treatment of potable and non-potable water, and as an industrial oxidant. ISU and Ames Laboratory researchers have developed a method for using iron in ozone oxidation that significantly improves the speed of oxidation reactions. Description Ozone is recognized as potent and effective oxidizing agent, and has a

  7. ECIS and Compass Metals: Platinum Nanostructures for Enhanced Catalysis

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

    ECIS and Compass Metals: Platinum Nanostructures for Enhanced Catalysis - Sandia Energy Energy Search Icon Sandia Home Locations Contact Us Employee Locator Energy & Climate Secure & Sustainable Energy Future Stationary Power Energy Conversion Efficiency Solar Energy Wind Energy Water Power Supercritical CO2 Geothermal Natural Gas Safety, Security & Resilience of the Energy Infrastructure Energy Storage Nuclear Power & Engineering Grid Modernization Battery Testing Nuclear Fuel

  8. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  9. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  10. University of Delaware | Catalysis Center for Energy Innovation | Modeling

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

    Modeling Activity map produced from the new high-throughput computational engine. Example for ethylene glycol catalysis. Reforming, hydrodeoxygenation, dehydrogenation, and catalyst poisoning (e.g., coking) occur at different regions of the map. Major developments have taken place in first-principles-based prediction of reforming and hydrodeoxygenation catalysts for key biomass derivatives. These developments can eventually assist in catalyst and process design for bio-oil upgrade and conversion

  11. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  12. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  13. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  14. ALS X-Rays Shine a New Light on Catalysis

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

    ALS X-Rays Shine a New Light on Catalysis Print Electrocatalysts are responsible for expediting reactions in many promising renewable energy technologies. However, the extreme sensitivity of their surface redox states to temperatures, to gas pressures, and to electrochemical reaction conditions renders them difficult to investigate by conventional surface-science techniques. Recently a team of Stanford and Berkeley Lab researchers used x-rays at the ALS in a novel way to observe the behavior of

  15. Catalysis by Design - Theoretical and Experimental Studies of Model

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

    Catalysis Working Group (CWG) meets twice per year to exchange information, create synergies, and collaboratively develop both an understanding of and tools for studying electrocatalysis for polymer electrolyte fuel cells (PEFCs) and other low- and intermediate-temperature fuel cell systems, including direct methanol fuel cells (DMFCs), alkaline fuel cells (AFCs), alkaline membrane fuel cells (AMFCs), and phosphoric acid fuel cells (PAFCs). The CWG members include principal and co-principal

  16. 2012 LANSCE Topical User Meeting

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

    2 LANSCE Topical User Meeting January 9-10, 2012 The Office of Defense Programs is developing a long-term strategy for the construction of new experimental science facilities supporting NNSA missions. The new facilities will provide the critical science and technology capabilities necessary to execute the 21 st century responsibilities of NNSA in executing its mission and in supporting the broader national security agenda. The call focuses on large facilities with costs exceeding $100M. The NNSA

  17. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

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

    ...-temperature oxidation of hydrocarbons and CO in homogeneous charge compression ignition (HCCI) emissions. PDF icon deer08rappe.pdf More Documents & Publications Low-Temperature ...

  18. EERE Success Story-Fundamental Studies in Catalysis Enabled the use of

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

    Efficient "Lean-Burn" Engines for Vehicle Transportation | Department of Energy Fundamental Studies in Catalysis Enabled the use of Efficient "Lean-Burn" Engines for Vehicle Transportation EERE Success Story-Fundamental Studies in Catalysis Enabled the use of Efficient "Lean-Burn" Engines for Vehicle Transportation May 7, 2015 - 1:29pm Addthis Building on a catalysis research program sponsored by EERE's Vehicles Technology Office (VTO) and DOE's Office of

  19. WTP Communications Strategy Discussion Topics

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

    Discussion Topics For discussion at the April 7, 2015 PIC meeting Issue Managers: Bob Suyama, Dave Bernhard, Melanie Myers-Magnuson, Dirk Dunning, Liz Mattson, Pam Larsen, Ken Niles Some potential questions and areas that the TWC/PIC need to discuss in order to develop a Communica- tions Strategy for the Waste Treatment Plant. These questions represent the data that the TWC/PIC might need in order to provide a plan that will be of value to the Tri-Party Agencies and the Public and Stakeholders.

  20. Hydrogen catalysis and scavenging action of Pd-POSS nanoparticles

    SciTech Connect (OSTI)

    Maiti, A; Gee, R H; Maxwell, R; Saab, A

    2007-02-01

    Prompted by the need for a self-supported, chemically stable, and functionally flexible catalytic nanoparticle system, we explore a system involving Pd clusters coated with a monolayer of polyhedral oligomeric silsesquioxane (POSS) cages. With an initial theoretical focus on hydrogen catalysis and sequestration in the Pd-POSS system, we report Density Functional Theory (DFT) results on POSS binding energies to the Pd(110) surface, hydrogen storing ability of POSS, and possible pathways of hydrogen radicals from the catalyst surface to unsaturated bonds away from the surface.

  1. Fuels and energy for the future: The role of catalysis

    SciTech Connect (OSTI)

    Rostrup-Nielsen, J.R.; Nielsen, R.

    2004-07-01

    There are many reasons to decrease the dependency on oil and to increase the use of other energy sources than fossil fuels. The wish for energy security is balanced by a wish for sustainable growth. Catalysis plays an important role in creating new routes and flexibility in the network of energy sources, energy carriers, and energy conversion. The process technologies resemble those applied in the large scale manufacture of commodities. This is illustrated by examples from refinery fuels, synfuels, and hydrogen and the future role of fossil fuels is discussed.

  2. USD Catalysis Group for Alternative Energy - Final report

    SciTech Connect (OSTI)

    Hoefelmeyer, James

    2014-10-03

    I. Project Summary Catalytic processes are a major technological underpinning of modern society, and are essential to the energy sector in the processing of chemical fuels from natural resources, fine chemicals synthesis, and energy conversion. Advances in catalyst technology are enormously valuable since these lead to reduced chemical waste, reduced energy loss, and reduced costs. New energy technologies, which are critical to future economic growth, are also heavily reliant on catalysts, including fuel cells and photo-electrochemical cells. Currently, the state of South Dakota is underdeveloped in terms of research infrastructure related to catalysis. If South Dakota intends to participate in significant economic growth opportunities that result from advances in catalyst technology, then this area of research needs to be made a high priority for investment. To this end, a focused research effort is proposed in which investigators from The University of South Dakota (USD) and The South Dakota School of Mines and Technology (SDSMT) will contribute to form the South Dakota Catalysis Group (SDCG). The multidisciplinary team of the (SDCG) include: (USD) Dan Engebretson, James Hoefelmeyer, Ranjit Koodali, and Grigoriy Sereda; (SDSMT) Phil Scott Ahrenkiel, Hao Fong, Jan Puszynski, Rajesh Shende, and Jacek Swiatkiewicz. The group is well suited to engage in a collaborative project due to the resources available within the existing programs. Activities within the SDCG will be monitored through an external committee consisting of three distinguished professors in chemistry. The committee will provide expert advice and recommendations to the SDCG. Advisory meetings in which committee members interact with South Dakota investigators will be accompanied by individual oral and poster presentations in a materials and catalysis symposium. The symposium will attract prominent scientists, and will enhance the visibility of research in the state of South Dakota. The SDCG requests funding through the Department of Energy (DoE) to establish this multidisciplinary research cluster in the area of catalysis. This long-term approach includes synthesis, characterization, catalyst evaluation, modeling, and scale-up. The project includes plans to acquire instrumentation critical to enabling competitive research. These acquisitions will complement existing resources in the state. The effect of implementation of the proposed efforts will be to significantly enhance state infrastructure in personnel and equipment, and lead to a nationally and internationally recognized research center.

  3. Assessment of Homogeneous Thorium/Uranium Fuel for Pressurized...

    Office of Scientific and Technical Information (OSTI)

    Fuel for Pressurized Water Reactors Citation Details In-Document Search Title: Assessment of Homogeneous ThoriumUranium Fuel for Pressurized Water Reactors The homogeneous ...

  4. Final technical report, Symposium on New Theoretical Concepts and Directions in Catalysis

    SciTech Connect (OSTI)

    Metiu, Horia

    2014-08-22

    We organized in August 2013 a “Symposium on New Theoretical Concepts and Directions in Catalysis” with the participation of 20 invited distinguished quantum chemists and other researchers who use computations to study catalysis. Symposium website; http://catalysis.cnsi.ucsb.edu/

  5. Plasma-Activated Lean NOx Catalysis for Heavy-Duty Diesel Emissions Control

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

    | Department of Energy PDF icon 2002_deer_aardahl.pdf More Documents & Publications Heavy-Duty NOx Emissions Control: Reformer-Assisted vs. Plasma-Facilitated Lean NOx Catalysis Selective reduction of NOx in oxygen rich environments with plasma-assisted catalysis: Catalyst development and mechanistic studies

  6. TEC Working Group Topic Groups Routing

    Broader source: Energy.gov [DOE]

    The Routing Topic Group has been established to examine topics of interest and relevance concerning routing of shipments of spent nuclear fuel (SNF) and high-level radioactive waste (HLW) to a...

  7. Energy & Manufacturing Workforce Training Topics List - Version...

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

    & Manufacturing Workforce Training Topics List - Version 1.7 (02.11.14) Energy & Manufacturing Workforce Training Topics List - Version 1.7 (02.11.14) View this searchable list of ...

  8. Surface Catalysis of Water Oxidation by the Blue Ruthenium Dimer

    SciTech Connect (OSTI)

    Jurss, Jonah W.; Concepcion, Javier C.; Norris, Michael R.; Templeton, Joseph L.; Meyer, Thomas J.

    2010-04-08

    Single-electron activation of multielectron catalysis has been shown to be viable in catalytic water oxidation with stepwise proton-coupled electron transfer, leading to high-energy catalytic precursors. For the blue dimer, cis,cis-[(bpy)2(H2O)RuIIIORuIII(H2O)(bpy)2]4+, the first well-defined molecular catalyst for water oxidation, stepwise 4e-/4H+ oxidation occurs to give the reactive precursor [(O)RuVORuV(O)]4+. This key intermediate is kinetically inaccessible at an unmodified metal oxide surface, where the only available redox pathway is electron transfer. We report here a remarkable surface activation of indium-tin oxide (In2O3:Sn) electrodes toward catalytic water oxidation by the blue dimer at electrodes derivatized by surface phosphonate binding of [Ru(4,4'-((HO)2P(O)CH2)2bpy)2(bpy)]2+. Surface binding dramatically improves the rate of surface oxidation of the blue dimer and induces water oxidation catalysis.

  9. Presentation: QER Energy Topics | Department of Energy

    Energy Savers [EERE]

    QER Energy Topics Presentation: QER Energy Topics A briefing to the Secretary's Energy Advisory Board on QER Energy Topics (Energy Flows, Water Flows, and Program for Climate Model Diagnosis and Intercomparison) prepared by: A.J. Simon, Lawrence Livermore National Laboratory PDF icon QER Energy Topics More Documents & Publications Presentation: High Performance Computing Applications Computational Advances in Applied Energy December 3, 2013 SEAB Meeting Minutes

  10. Technical Assistance Topics | Department of Energy

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

    Electricity Policy Coordination and Implementation » Electricity Policy Technical Assistance Program » Technical Assistance Topics Technical Assistance Topics Topics addressed are those of greatest interest to states, regions, and Tribes, including: Reliability, resiliency, and cyber security of electric power systems Electric resource planning, integrated resource planning, regional transmission planning, and resource acquisition strategies Ratepayer-funded energy efficiency, demand response,

  11. A numerical homogenization method for heterogeneous, anisotropic elastic media based on multiscale theory

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

    Gao, Kai; Chung, Eric T.; Gibson, Richard L.; Fu, Shubin; Efendiev, Yalchin

    2015-06-05

    The development of reliable methods for upscaling fine scale models of elastic media has long been an important topic for rock physics and applied seismology. Several effective medium theories have been developed to provide elastic parameters for materials such as finely layered media or randomly oriented or aligned fractures. In such cases, the analytic solutions for upscaled properties can be used for accurate prediction of wave propagation. However, such theories cannot be applied directly to homogenize elastic media with more complex, arbitrary spatial heterogeneity. We therefore propose a numerical homogenization algorithm based on multiscale finite element methods for simulating elasticmore » wave propagation in heterogeneous, anisotropic elastic media. Specifically, our method used multiscale basis functions obtained from a local linear elasticity problem with appropriately defined boundary conditions. Homogenized, effective medium parameters were then computed using these basis functions, and the approach applied a numerical discretization that is similar to the rotated staggered-grid finite difference scheme. Comparisons of the results from our method and from conventional, analytical approaches for finely layered media showed that the homogenization reliably estimated elastic parameters for this simple geometry. Additional tests examined anisotropic models with arbitrary spatial heterogeneity where the average size of the heterogeneities ranged from several centimeters to several meters, and the ratio between the dominant wavelength and the average size of the arbitrary heterogeneities ranged from 10 to 100. Comparisons to finite-difference simulations proved that the numerical homogenization was equally accurate for these complex cases.« less

  12. A numerical homogenization method for heterogeneous, anisotropic elastic media based on multiscale theory

    SciTech Connect (OSTI)

    Gao, Kai; Chung, Eric T.; Gibson, Richard L.; Fu, Shubin; Efendiev, Yalchin

    2015-06-05

    The development of reliable methods for upscaling fine scale models of elastic media has long been an important topic for rock physics and applied seismology. Several effective medium theories have been developed to provide elastic parameters for materials such as finely layered media or randomly oriented or aligned fractures. In such cases, the analytic solutions for upscaled properties can be used for accurate prediction of wave propagation. However, such theories cannot be applied directly to homogenize elastic media with more complex, arbitrary spatial heterogeneity. We therefore propose a numerical homogenization algorithm based on multiscale finite element methods for simulating elastic wave propagation in heterogeneous, anisotropic elastic media. Specifically, our method used multiscale basis functions obtained from a local linear elasticity problem with appropriately defined boundary conditions. Homogenized, effective medium parameters were then computed using these basis functions, and the approach applied a numerical discretization that is similar to the rotated staggered-grid finite difference scheme. Comparisons of the results from our method and from conventional, analytical approaches for finely layered media showed that the homogenization reliably estimated elastic parameters for this simple geometry. Additional tests examined anisotropic models with arbitrary spatial heterogeneity where the average size of the heterogeneities ranged from several centimeters to several meters, and the ratio between the dominant wavelength and the average size of the arbitrary heterogeneities ranged from 10 to 100. Comparisons to finite-difference simulations proved that the numerical homogenization was equally accurate for these complex cases.

  13. Decision Point 1 Topical Report

    SciTech Connect (OSTI)

    Yablonsky, Al; Barsoumian, Shant; Legere, David

    2013-05-01

    This Topical Report addresses accomplishments achieved during Phase 2a of the SkyMine® Carbon Mineralization Pilot Project. The primary objectives of this project are to design, construct, and operate a system to capture CO2 from a slipstream of flue gas from a commercial coal-fired cement kiln, convert that CO2 to products having commercial value (i.e., beneficial use), show the economic viability of the CO2 capture and conversion process, and thereby advance the technology to the point of readiness for commercial scale demonstration and proliferation. The overall process is carbon negative, resulting in mineralization of CO2 that would otherwise be released into the atmosphere. The project will also substantiate market opportunities for the technology by sales of chemicals into existing markets, and identify opportunities to improve technology performance and reduce costs at the commercial scale. The project is being conducted in two phases. The primary objectives of Phase 1 were to elaborate proven SkyMine® process chemistry to commercial pilot-scale operation and complete the preliminary design for the pilot plant to be built and operated in Phase 2, complete a NEPA evaluation, and develop a comprehensive carbon life cycle analysis. The objective of the current Phase (2a) is to complete the detailed design of the pilot plant to be built in Phase 2b.

  14. Tracking topic birth and death in LDA.

    SciTech Connect (OSTI)

    Wilson, Andrew T.; Robinson, David Gerald

    2011-09-01

    Most topic modeling algorithms that address the evolution of documents over time use the same number of topics at all times. This obscures the common occurrence in the data where new subjects arise and old ones diminish or disappear entirely. We propose an algorithm to model the birth and death of topics within an LDA-like framework. The user selects an initial number of topics, after which new topics are created and retired without further supervision. Our approach also accommodates many of the acceleration and parallelization schemes developed in recent years for standard LDA. In recent years, topic modeling algorithms such as latent semantic analysis (LSA)[17], latent Dirichlet allocation (LDA)[10] and their descendants have offered a powerful way to explore and interrogate corpora far too large for any human to grasp without assistance. Using such algorithms we are able to search for similar documents, model and track the volume of topics over time, search for correlated topics or model them with a hierarchy. Most of these algorithms are intended for use with static corpora where the number of documents and the size of the vocabulary are known in advance. Moreover, almost all current topic modeling algorithms fix the number of topics as one of the input parameters and keep it fixed across the entire corpus. While this is appropriate for static corpora, it becomes a serious handicap when analyzing time-varying data sets where topics come and go as a matter of course. This is doubly true for online algorithms that may not have the option of revising earlier results in light of new data. To be sure, these algorithms will account for changing data one way or another, but without the ability to adapt to structural changes such as entirely new topics they may do so in counterintuitive ways.

  15. LANSCE | Users | LUG | Topical User Workshop

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

    2 LANSCE Topical User Meeting | January 9-10 2012 LANSCE Topical User Workshop LANSCE will host the 2012 Topical User Workshop, January 9-10, 2012. We hope to see you there! Registration | Accommodations | Agenda (some presentations are included on the agenda) LANL foreign nationals may register at anytime. | Poster Dimensions: 32 in x 40 in This workshop will solicit user input for the scientific opportunities offered by the pulse stacker and superconducting accelerator that LANSCE has proposed

  16. TEC Working Group Topic Groups Archives Communications

    Broader source: Energy.gov [DOE]

    The Communications Topic Group was convened in April 1998 to improve internal and external strategic level communications regarding DOE shipments of radioactive and other hazardous materials.

  17. TEC Working Group Topic Groups Security

    Broader source: Energy.gov [DOE]

    The Security Topic group is comprised of regulators, law enforcement officials, labor and industry representatives and other subject matter experts concerned with secure transport of spent nuclear...

  18. Collaboration Topics - Visualization | National Nuclear Security...

    National Nuclear Security Administration (NNSA)

    NNSACEA Cooperation in Computer Science Collaboration Topics - Visualization ... to visualize large data sets on small computational resources. 3) In situ visualization ...

  19. Interconnection-Wide Transmission Planning Initiative: Topic...

    Energy Savers [EERE]

    the Texas Interconnection Interconnection-Wide Transmission Planning Initiative: Topic B, State Agency Input Regarding Electric Resource and Transmission Planning in the Texas ...

  20. Interconnection-Wide Transmission Planning Initiative: Topic...

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

    Western Interconnection on Electric Resource Planning and Priorities Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation Among States in the Western ...

  1. Interconnection-Wide Transmission Planning Initiative: Topic...

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

    Eastern Interconnection on Electric Resource Planning and Priorities Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation Among States in the Eastern ...

  2. Interconnection-Wide Transmission Planning Initiative: Topic...

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

    A, Interconnection-Level Analysis and Planning Interconnection-Wide Transmission Planning Initiative: Topic A, Interconnection-Level Analysis and Planning A description of the ...

  3. Topic Index to the DOE Administrative Records Disposition Schedules...

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

    Topic Index to the DOE Administrative Records Disposition Schedules Topic Index to the DOE Administrative Records Disposition Schedules Topic Index to the DOE Administrative...

  4. Preface: Special Topic on Interfacial and Confined Water (Journal...

    Office of Scientific and Technical Information (OSTI)

    Preface: Special Topic on Interfacial and Confined Water Citation Details In-Document Search Title: Preface: Special Topic on Interfacial and Confined Water This Special Topic on...

  5. Webtrends Archives by Fiscal Year - Topic Landing Pages | Department...

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

    Topic Landing Pages Webtrends Archives by Fiscal Year - Topic Landing Pages From the EERE Web Statistics Archive: Corporate sites, Webtrends archives for the topic landing pages by ...

  6. Fundamental Studies in Catalysis Enabled the use of Efficient Lean-Burn Engines for Vehicle Transportation

    Broader source: Energy.gov [DOE]

    Building on a catalysis research program sponsored by EEREs Vehicles Technology Office (VTO) and DOEs Office of Science, researchers at Cummins, Inc. and Pacific Northwest National Laboratory ...

  7. Improving Catalysis by Putting the Best Face Forward | U.S. DOE Office of

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

    Science (SC) Improving Catalysis by Putting the Best Face Forward Basic Energy Sciences (BES) BES Home About Research Facilities Science Highlights Benefits of BES Funding Opportunities Basic Energy Sciences Advisory Committee (BESAC) Community Resources Contact Information Basic Energy Sciences U.S. Department of Energy SC-22/Germantown Building 1000 Independence Ave., SW Washington, DC 20585 P: (301) 903-3081 F: (301) 903-6594 E: Email Us More Information » 04.01.12 Improving Catalysis by

  8. Catalysis Center for Energy Innovation (CCEI) | U.S. DOE Office of Science

    Office of Science (SC) Website

    (SC) Catalysis Center for Energy Innovation (CCEI) Energy Frontier Research Centers (EFRCs) EFRCs Home Centers EFRC External Websites Research Science Highlights News & Events Publications History Contact BES Home Centers Catalysis Center for Energy Innovation (CCEI) Print Text Size: A A A FeedbackShare Page CCEI Header Director Dionisios Vlachos Lead Institution University of Delaware Year Established 2009 Mission To focus on developing innovative, transformational heterogeneous

  9. TEC Working Group Topic Groups Archives Protocols

    Broader source: Energy.gov [DOE]

    The Transportation Protocols Topic Group serves as an important vehicle for DOE senior managers to assess and incorporate stakeholder input into the protocols process. The Topic Group was formed to review a series of transportation protocols developed in response to a request for DOE to be more consistent in its approach to transportation.

  10. TEC Working Group Topic Groups Rail Conference Call Summaries...

    Office of Environmental Management (EM)

    Summaries Rail Topic Group TEC Working Group Topic Groups Rail Conference Call Summaries Rail Topic Group Rail Topic Group PDF icon May 17, 2007 PDF icon January 16, 2007 PDF icon...

  11. Soliton production with nonlinear homogeneous lines

    SciTech Connect (OSTI)

    Elizondo-Decanini, Juan M.; Coleman, Phillip D.; Moorman, Matthew W.; Petney, Sharon Joy Victor; Dudley, Evan C.; Youngman, Kevin; Penner, Tim Dwight; Fang, Lu; Myers, Katherine M.

    2015-11-24

    Low- and high-voltage Soliton waves were produced and used to demonstrate collision and compression using diode-based nonlinear transmission lines. Experiments demonstrate soliton addition and compression using homogeneous nonlinear lines. We built the nonlinear lines using commercially available diodes. These diodes are chosen after their capacitance versus voltage dependence is used in a model and the line design characteristics are calculated and simulated. Nonlinear ceramic capacitors are then used to demonstrate high-voltage pulse amplification and compression. The line is designed such that a simple capacitor discharge, input signal, develops soliton trains in as few as 12 stages. We also demonstrated output voltages in excess of 40 kV using Y5V-based commercial capacitors. The results show some key features that determine efficient production of trains of solitons in the kilovolt range.

  12. Homogeneous catalyst formulations for methanol production

    DOE Patents [OSTI]

    Mahajan, Devinder; Sapienza, Richard S.; Slegeir, William A.; O'Hare, Thomas E.

    1990-01-01

    There is disclosed synthesis of CH.sub.3 OH from carbon monoxide and hydrogen using an extremely active homogeneous catalyst for methanol synthesis directly from synthesis gas. The catalyst operates preferably between 100.degree.-150.degree. C. and preferably at 100-150 psia synthesis gas to produce methanol. Use can be made of syngas mixtures which contain considerable quantities of other gases, such as nitrogen, methane or excess hydrogen. The catalyst is composed of two components: (a) a transition metal carbonyl complex and (b) an alkoxide component. In the simplest formulation, component (a) is a complex of nickel tetracarbonyl and component (b) is methoxide (CH.sub.3 O.sup.13 ), both being dissolved in a methanol solvent system. The presence of a co-solvent such as p-dioxane, THF, polyalcohols, ethers, hydrocarbons, and crown ethers accelerates the methanol synthesis reaction.

  13. Homogeneous catalyst formulations for methanol production

    DOE Patents [OSTI]

    Mahajan, Devinder; Sapienza, Richard S.; Slegeir, William A.; O'Hare, Thomas E.

    1991-02-12

    There is disclosed synthesis of CH.sub.3 OH from carbon monoxide and hydrogen using an extremely active homogeneous catalyst for methanol synthesis directly from synthesis gas. The catalyst operates preferably between 100.degree.-150.degree. C. and preferably at 100-150 psia synthesis gas to produce methanol. Use can be made of syngas mixtures which contain considerable quantities of other gases, such as nitrogen, methane or excess hydrogen. The catalyst is composed of two components: (a) a transition metal carbonyl complex and (b) an alkoxide component. In the simplest formulation, component (a) is a complex of nickel tetracarbonyl and component (b) is methoxide (CH.sub.3 O.sup.-), both being dissolved in a methanol solvent system. The presence of a co-solvent such as p-dioxane, THF, polyalcohols, ethers, hydrocarbons, and crown ethers accelerates the methanol synthesis reaction.

  14. Soliton production with nonlinear homogeneous lines

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

    Elizondo-Decanini, Juan M.; Coleman, Phillip D.; Moorman, Matthew W.; Petney, Sharon Joy Victor; Dudley, Evan C.; Youngman, Kevin; Penner, Tim Dwight; Fang, Lu; Myers, Katherine M.

    2015-11-24

    Low- and high-voltage Soliton waves were produced and used to demonstrate collision and compression using diode-based nonlinear transmission lines. Experiments demonstrate soliton addition and compression using homogeneous nonlinear lines. We built the nonlinear lines using commercially available diodes. These diodes are chosen after their capacitance versus voltage dependence is used in a model and the line design characteristics are calculated and simulated. Nonlinear ceramic capacitors are then used to demonstrate high-voltage pulse amplification and compression. The line is designed such that a simple capacitor discharge, input signal, develops soliton trains in as few as 12 stages. We also demonstrated outputmore » voltages in excess of 40 kV using Y5V-based commercial capacitors. The results show some key features that determine efficient production of trains of solitons in the kilovolt range.« less

  15. Application of solid ash based catalysts in heterogeneous catalysis

    SciTech Connect (OSTI)

    Shaobin Wang

    2008-10-01

    Solid wastes, fly ash, and bottom ash are generated from coal and biomass combustion. Fly ash is mainly composed of various metal oxides and possesses higher thermal stability. Utilization of fly ash for other industrial applications provides a cost-effective and environmentally friendly way of recycling this solid waste, significantly reducing its environmental effects. On the one hand, due to the higher stability of its major component, aluminosilicates, fly ash could be employed as catalyst support by impregnation of other active components for various reactions. On the other hand, other chemical compounds in fly ash such as Fe{sub 2}O{sub 3} could also provide an active component making fly ash a catalyst for some reactions. In this paper, physicochemical properties of fly ash and its applications for heterogeneous catalysis as a catalyst support or catalyst in a variety of catalytic reactions were reviewed. Fly-ash-supported catalysts have shown good catalytic activities for H{sub 2} production, deSOx, deNOx, hydrocarbon oxidation, and hydrocracking, which are comparable to commercially used catalysts. As a catalyst itself, fly ash can also be effective for gas-phase oxidation of volatile organic compounds, aqueous-phase oxidation of organics, solid plastic pyrolysis, and solvent-free organic synthesis. 107 refs., 4 figs., 2 tabs.

  16. Jonathan Link, Columbia KEK Topical Conference

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

    -22, 2001 Jonathan Link, Columbia KEK Topical Conference Short Baseline Neutrino Oscillations and MiniBooNE Jonathan Link Columbia University The 5 th KEK Topical Conference - Frontiers in Flavor Physics November 20-22, 2001 November 20-22, 2001 Jonathan Link, Columbia KEK Topical Conference Outline 1. Background on Short Baseline Neutrino Oscillations * A little neutrino physics * The LSND oscillation result 2. About MiniBooNE 3. Status of MiniBooNE. Some of you may have noticed that I'll be

  17. University of Delaware | Catalysis Center for Energy Innovation | Furans

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

    Research Thrust Sugars to Furans Converting sugars to high-value intermediates. CCEI introduced an iconic technology for the isomerization of aldoses to ketoses production via Sn-beta zeolite and other related heterogeneous and homogeneous Lewis acid catalysts in water and demonstrated that this technology is broadly applicable to the conversion of C6 and C5 sugars. Researchers discovered the first single-pot process that combines heterogeneous Lewis acidity with Bronsted acidity to carry

  18. TEC Working Group Topic Groups Rail

    Broader source: Energy.gov [DOE]

    The Rail Topic Group has the responsibility to identify and discuss current issues and concerns regarding rail transportation of radioactive materials by the Department of Energy (DOE). The group’s...

  19. TEC Working Group Topic Groups Tribal

    Broader source: Energy.gov [DOE]

    The Tribal Topic Group was established in January 1998 to address government-to-government consultation between DOE and Indian Tribes affected by its transportation activities. The group focuses on...

  20. Highly Dispersed Pseudo-Homogeneous and Heterogeneous Catalysts Synthesized via Inverse Micelle Solutions for the Liquefaction of Coal

    SciTech Connect (OSTI)

    Hampden-Smith, M.; Kawola, J.S.; Martino, A.; Sault, A.G.; Yamanaka, S.A.

    1999-01-05

    The mission of this project was to use inverse micelle solutions to synthesize nanometer sized metal particles and test the particles as catalysts in the liquefaction of coal and other related reactions. The initial focus of the project was the synthesis of iron based materials in pseudo-homogeneous form. The frost three chapters discuss the synthesis, characterization, and catalyst testing in coal liquefaction and model coal liquefaction reactions of iron based pseudo-homogeneous materials. Later, we became interested in highly dispersed catalysts for coprocessing of coal and plastic waste. Bifunctional catalysts . to hydrogenate the coal and depolymerize the plastic waste are ideal. We began studying, based on our previously devised synthesis strategies, the synthesis of heterogeneous catalysts with a bifunctional nature. In chapter 4, we discuss the fundamental principles in heterogeneous catalysis synthesis with inverse micelle solutions. In chapter 5, we extend the synthesis of chapter 4 to practical systems and use the materials in catalyst testing. Finally in chapter 6, we return to iron and coal liquefaction now studied with the heterogeneous catalysts.

  1. Foam Generation in Homogeneous Porous Media

    SciTech Connect (OSTI)

    Gauglitz, Phillip A.; Friedman, F.; Kam, S. I.; Rossen, W. R.

    2002-10-01

    In steady gas-liquid flow in homogeneous porous media with surfactant present, there is often observed a critical injection velocity or pressure gradient ?grad p min? at which ?weak? or ?coarse? foam is abruptly converted into ?strong foam,? with reduction of one to two orders of magnitude in total mobility: i.e., ?foam generation.? Earlier research on foam generation is extended here with extensive data for a variety of porous media, permeabilities, gases (N2 and C02), surfactants, and temperatures. For bead and sandpacks, ?grad p min? scales like (1/k), where k is permeability, over 2 1/2 orders of magnitude in k; for consolidated media the relation is more complex. For dense C02 foam, ?grad p min? exists but can be less than 1 psi/ft. If pressure drop, rather than flow rates, is fixed, one observes and unstable regime between stable ?strong? and ?coarse? foam regimes; in the unstable regime ?grad p? is nonuniform in space or variable in time.

  2. Homogeneously dispersed, multimetal oxygen-evolving catalysts

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

    Zhang, Bo; Zheng, Xueli; Voznyy, Oleksandr; Comin, Riccardo; Bajdich, Michal; Garcia-Melchor, Max; Han, Lili; Xu, Jixian; Liu, Min; Zheng, Lirong; et al

    2016-03-24

    Earth-abundant first-row (3d) transition-metal-based catalysts have been developed for the oxygen-evolution reaction (OER); however, they operate at overpotentials significantly above thermodynamic requirements. Density functional theory suggested that non-3d high-valency metals such as tungsten can modulate 3d metal oxides, providing near-optimal adsorption energies for OER intermediates. We developed a room-temperature synthesis to produce gelled oxy-hydroxide materials with an atomically homogeneous metal distribution. These gelled FeCoW oxy-hydroxide exhibits the lowest overpotential (191 mV) reported at 10 mA per square centimeter in alkaline electrolyte. Here, the catalyst shows no evidence of degradation following more than 500 hours of operation. X-ray absorption and computationalmore » studies reveal a synergistic interplay between W, Fe and Co in producing a favorable local coordination environment and electronic structure that enhance the energetics for OER.« less

  3. Structural Insights into the Mechanism of PEPCK Catalysis

    SciTech Connect (OSTI)

    Holyoak,T.; Sullivan, S.; Nowak, T.

    2006-01-01

    Phosphoenolpyruvate carboxykinase catalyzes the reversible decarboxylation of oxaloacetic acid with the concomitant transfer of the {gamma}-phosphate of GTP to form PEP and GDP as the first committed step of gluconeogenesis and glyceroneogenesis. The three structures of the mitochondrial isoform of PEPCK reported are complexed with Mn{sup 2+}, Mn{sup 2+}-PEP, or Mn{sup 2+}-malonate-Mn{sup 2+}GDP and provide the first observations of the structure of the mitochondrial isoform and insight into the mechanism of catalysis mediated by this enzyme. The structures show the involvement of the hyper-reactive cysteine (C307) in the coordination of the active site Mn{sup 2+}. Upon formation of the PEPCK-Mn{sup 2+}-PEP or PEPCK-Mn{sup 2+}-malonate-Mn{sup 2+}GDP complexes, C307 coordination is lost as the P-loop in which it resides adopts a different conformation. The structures suggest that stabilization of the cysteine-coordinated metal geometry holds the enzyme as a catalytically incompetent metal complex and may represent a previously unappreciated mechanism of regulation. A third conformation of the mobile P-loop in the PEPCK-Mn{sup 2+}-malonate-Mn{sup 2+}GDP complex demonstrates the participation of a previously unrecognized, conserved serine residue (S305) in mediating phosphoryl transfer. The ordering of the mobile active site lid in the PEPCK-Mn{sup 2+}-malonate-Mn{sup 2+}GDP complex yields the first observation of this structural feature and provides additional insight into the mechanism of phosphoryl transfer.

  4. Shape-selective catalysis in dimethyl ether conversion

    SciTech Connect (OSTI)

    Sardesai, A.; Lee, S.

    1999-07-01

    Coal-derived syngas can be effectively converted to dimethyl ether (DME) in a single-stage, liquid-phase process. This Liquid Phase Dimethyl Ether (LPDME) process utilizes a dual catalytic system, which comprises of a physical blend between the methanol synthesis and the methanol dehydration catalyst slurried in an inert mineral oil. Such produced DME has vast potential as a building block chemical in the petrochemical industry to produce value-added specialty chemicals. The current research efforts are made to exploit the utilization of shape-selective catalysis using zeolites to produce targeted petrochemicals, including lower olefinic hydrocarbons. The catalysts probed in this investigation include zeolites of different physical, morphological, and chemical configurations. The effect of acidity of ZSM-5 type zeolites as well as the effect of the different channel size and orientation of the zeolites on product selectivity and catalyst deactivation are examined. Results obtained from experimentation of this study show that ZSM-5 type zeolite with low acidity (high SiO{sub 2}/Al{sub 2}O{sub 3} ratio, in this case 150) exhibits the highest selectivity towards lower (C{sub 2}-C{sub 4}) olefins in general. Controlled selectivity toward targeted olefinic species can be accomplished via devising catalytic reaction systems in such a way that the structural property of the catalyst and reactive interaction between molecules in the pores are geared toward formation of targeted molecular species which also at the same time prevent the formation of less desirable products. The internal morphology of the catalyst also has a pronounced effect on the deactivation phenomenon, where it is observed that zeolites possessing high acidity and a unidimensional channel structure are prone towards catalyst deactivation by coking and pore blockage.

  5. Assessment of Homogeneous Thorium/Uranium Fuel for Pressurized Water

    Office of Scientific and Technical Information (OSTI)

    Reactors (Journal Article) | SciTech Connect Assessment of Homogeneous Thorium/Uranium Fuel for Pressurized Water Reactors Citation Details In-Document Search Title: Assessment of Homogeneous Thorium/Uranium Fuel for Pressurized Water Reactors The homogeneous ThO{sub 2}-UO{sub 2} fuel cycle option for a pressurized water reactor (PWR) of current technology is investigated. The fuel cycle assessment was carried out by calculating the main performance parameters: natural uranium and separative

  6. TEC Working Group Topic Groups Rail Conference Call Summaries Rail Topic

    Office of Environmental Management (EM)

    Group | Department of Energy Summaries Rail Topic Group TEC Working Group Topic Groups Rail Conference Call Summaries Rail Topic Group Rail Topic Group PDF icon May 17, 2007 PDF icon January 16, 2007 PDF icon August 31, 2006 PDF icon July 27, 2006 PDF icon June 8, 2006 PDF icon April 20, 2006 PDF icon March 9, 2006 PDF icon January 26, 2006 PDF icon November 9, 2005 PDF icon September 15, 2005 PDF icon April 28, 2005 PDF icon March 24, 2005 PDF icon February 24, 2005 PDF icon January 27,

  7. 2010 CATALYSIS GORDON RESEARCH CONFERENCE, JUNE 27 - JULY 2, 2010, NEW LONDON, NEW HAMPSHIRE

    SciTech Connect (OSTI)

    Abhaya Datye

    2010-07-02

    Catalysis is a key technology for improving the quality of life while simultaneously reducing the adverse impact of human activities on the environment. The discovery of new catalytic processes and the improvement of existing ones are also critically important for securing the nation's energy supply. The GRC on Catalysis is considered one the most prestigious conference for catalysis research, bringing together leading researchers from both academia, industry and national labs to discuss the latest, most exciting research in catalysis and the future directions for the field. The 2010 GRC on Catalysis will follow time-honored traditions and feature invited talks from the world's leading experts in the fundamentals and applications of catalytic science and technology. We plan to have increased participation from industry. The extended discussions in the company of outstanding thinkers will stimulate and foster new science. The conference will include talks in the following areas: Alternative feedstocks for chemicals and fuels, Imaging and spectroscopy, Design of novel catalysts, Catalyst preparation fundamentals, Molecular insights through theory, Surface Science, Catalyst stability and dynamics. In 2010, the Catalysis conference will move to a larger conference room with a new poster session area that will allow 40 posters per session. The dorm rooms provide single and double accommodations, free WiFi and the registration fee includes all meals and the famous lobster dinner on Thursday night. Afternoons are open to enjoy the New England ambiance with opportunities for hiking, sailing, golf and tennis to create an outstanding conference that will help you network with colleagues, and make long lasting connections.

  8. Geek-Up[3.11.2011]: Energy Efficiency, Catalysis and Open Source Tools |

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

    Department of Energy 11.2011]: Energy Efficiency, Catalysis and Open Source Tools Geek-Up[3.11.2011]: Energy Efficiency, Catalysis and Open Source Tools March 11, 2011 - 4:37pm Addthis L. Keith Woo | Photo courtesy of Ames National Laboratory L. Keith Woo | Photo courtesy of Ames National Laboratory Niketa Kumar Niketa Kumar Public Affairs Specialist, Office of Public Affairs Ames Laboratory researcher and Iowa State University professor L. Keith Woo is on the search for catalysts that lead

  9. Growth mechanism of graphene on platinum: Surface catalysis and carbon segregation

    SciTech Connect (OSTI)

    Sun, Jie Lindvall, Niclas; Yurgens, August; Nam, Youngwoo; Cole, Matthew T.; Teo, Kenneth B. K.; Woo Park, Yung

    2014-04-14

    A model of the graphene growth mechanism of chemical vapor deposition on platinum is proposed and verified by experiments. Surface catalysis and carbon segregation occur, respectively, at high and low temperatures in the process, representing the so-called balance and segregation regimes. Catalysis leads to self-limiting formation of large area monolayer graphene, whereas segregation results in multilayers, which evidently grow from below. By controlling kinetic factors, dominantly monolayer graphene whose high quality has been confirmed by quantum Hall measurement can be deposited on platinum with hydrogen-rich environment, quench cooling, tiny but continuous methane flow and about 1000?C growth temperature.

  10. Physics Topics - Plasma Couette Experiment - Cary Forest Group...

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

    Physics Topics UW Madison Plasma Couette Experiment Physics Topics PCX HomeResearch MissionPhysics TopicsDeviceDiagnosticsContacts LinksPCX People CPLA Home Directory Publications ...

  11. Physics Topics - Rotating Wall Machine - UW Plasma Physics

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

    Physics Topics UW Madison Line Tied Reconnection Experiment Physics Topics LTRX HomeResearch MissionLTRX DevicePhysics TopicsDiagnosticsLTRX GalleryLTRX People CPLA Home Directory ...

  12. Smart Grid Investment Grant Topic Areas | Department of Energy

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

    Topic Areas Smart Grid Investment Grant Topic Areas A description of the topic areas for projects selected for award under the Smart Grid Investment Grant project of the American ...

  13. Webtrends Archives by Fiscal Year - Topic Landing Pages | Department of

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

    Energy Topic Landing Pages Webtrends Archives by Fiscal Year - Topic Landing Pages From the EERE Web Statistics Archive: Corporate sites, Webtrends archives for the topic landing pages by fiscal year. Microsoft Office document icon Topic Landing Pages FY10 Microsoft Office document icon Topic Landing Pages FY11 PDF icon Topic Landing Pages FY12-FY13 More Documents & Publications Webtrends Archives by Fiscal Year - Commercialization Webtrends Archives by Fiscal Year - Social Media Site

  14. Quark-gluon plasma (Selected Topics)

    SciTech Connect (OSTI)

    Zakharov, V. I.

    2012-09-15

    Introductory lectures to the theory of (strongly interacting) quark-gluon plasma given at the Winter School of Physics of ITEP (Moscow, February 2010). We emphasize theoretical issues highlighted by the discovery of the low viscosity of the plasma. The topics include relativistic hydrodynamics, manifestations of chiral anomaly in hydrodynamics, superfluidity, relativistic superfluid hydrodynamics, effective stringy scalars, holographic models of Yang-Mills theories.

  15. Manufacturing Innovation Multi-Topic Workshop Report

    Broader source: Energy.gov [DOE]

    The U.S. Department of Energy (DOE) and Department of Defense (DoD) held a Manufacturing Innovation Topics Workshop on October 8 and 9, 2014. Representatives from industry, academia, DOE national laboratories, and DoD centers gathered in Fort Worth TX to hear keynote addresses and participate in workshop breakout sessions.

  16. Funding Topics for Small Business Innovation Research and Small...

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

    Topics for Small Business Innovation Research and Small Business Technology Transfer Programs Funding Topics for Small Business Innovation Research and Small Business Technology ...

  17. Events & Topics in Renewable Energy & the Environment | Photosynthetic...

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

    Events & Topics in Renewable Energy & the Environment Events & Topics in Renewable Energy & the Environment Donald Danforth Plant Science Center April 9, 2015 - 3:15pm Donald...

  18. Events & Topics in Renewable Energy & the Environment | Photosynthetic...

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

    Events & Topics in Renewable Energy & the Environment Events & Topics in Renewable Energy & the Environment MIssouri Botanical Garden | Earthways Center - October 6th, 3:15 -...

  19. Events & Topics in Renewable Energy & the Environment | Photosynthetic...

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

    Events & Topics in Renewable Energy & the Environment Events & Topics in Renewable Energy & the Environment Tyson Living Learning Center tour November 18, 2014 - 4:00pm Tyson...

  20. List of Topics for Interagency Performance & Risk Assessment...

    Energy Savers [EERE]

    List of Topics for Interagency Performance & Risk Assessment Community of Practice (P&RA CoP) Discussion List of Topics for Interagency Performance & Risk Assessment Community of ...

  1. Public Perception of 13 Different Energy Topics analyzed in new...

    Open Energy Info (EERE)

    and unfavorability energy topics such as transportation, renewable technology, nuclear, clean coal, and smart grid topics. Some of the highlights of the study are as...

  2. Microsoft Word - 20111012_RAP Dec_Mtg_Topics.doc

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

    12 Potential December RAP Committee Meeting Agenda Topics TopicPurpose (incl. any framing questions) 2012 Priority? Issue Managers (* denotes lead) Agency Lead (s) Time...

  3. TEC Working Group Topic Groups Routing Key Documents | Department...

    Office of Environmental Management (EM)

    Key Documents TEC Working Group Topic Groups Routing Key Documents KEY DOCUMENTS PDF icon Proposed Task Plan - Routing Topic Group More Documents & Publications TEC Working Group...

  4. TEC Working Group Topic Groups Routing Meeting Summaries | Department...

    Office of Environmental Management (EM)

    Routing Meeting Summaries TEC Working Group Topic Groups Routing Meeting Summaries MEETING SUMMARIES PDF icon Atlanta TEC Meeting, Routing Topic Group Summary More Documents &...

  5. TEC Working Group Topic Groups Rail Conference Call Summaries...

    Office of Environmental Management (EM)

    Rail Conference Call Summaries TEC Working Group Topic Groups Rail Conference Call Summaries CONFERENCE CALL SUMMARIES Rail Topic Group Inspections Subgroup Planning Subgroup...

  6. TEC Working Group Topic Groups Archives Protocols Meeting Summaries...

    Office of Environmental Management (EM)

    Protocols Meeting Summaries TEC Working Group Topic Groups Archives Protocols Meeting Summaries Meeting Summaries PDF icon Philadelphia TEC Meeting, Protocols Topic Group Summary -...

  7. TEC Working Group Topic Groups Rail Meeting Summaries | Department...

    Office of Environmental Management (EM)

    TEC Working Group Topic Groups Rail Meeting Summaries MEETING SUMMARIES PDF icon Kansas City TEC Meeting, Rail Topic Group Summary - July 25, 2007 PDF icon Atlanta TEC...

  8. Solvation and Acid Strength Effects on Catalysis by Faujasite Zeolites

    SciTech Connect (OSTI)

    Gounder, Rajamani P.; Jones, Andrew J.; Carr, Robert T.; Iglesia, Enrique

    2012-02-01

    Kinetic, spectroscopic, and chemical titration data indicate that differences in monomolecular isobutane cracking and dehydrogenation and methanol dehydration turnover rates (per H+) among FAU zeolites treated thermally with steam (H-USY) and then chemically with ammonium hexafluorosilicate (CDHUSY) predominantly reflect differences in the size and solvating properties of their supercage voids rather than differences in acid strength. The number of protons on a given sample was measured consistently by titrations with Na+, with CH3 groups via reactions of dimethyl ether, and with 2,6-di-tert-butylpyridine during methanol dehydration catalysis; these titration values were also supported by commensurate changes in acidic OH infrared band areas upon exposure to titrant molecules. The number of protons, taken as the average of the three titration methods, was significantly smaller than the number of framework Al atoms (Alf) obtained from X-ray diffraction and 27Al magic angle spinning nuclear magnetic resonance spectroscopy on H-USY (0.35 H+/Alf) and CD-HUSY (0.69 H+/Alf). These data demonstrate that the ubiquitous use of Alf sites as structural proxies for active H+ sites in zeolites can be imprecise, apparently because distorted Al structures that are not associated with acidic protons are sometimes detected as Alf sites. Monomolecular isobutane cracking and dehydrogenation rate constants, normalized non-rigorously by the number of Alf species, decreased with increasing Na+ content on both H-USY and CD-HUSY samples and became undetectable at sub-stoichiometric exchange levels (0.32 and 0.72 Na+/Alf ratios, respectively), an unexpected finding attributed incorrectly in previous studies to the presence of minority ‘‘super-acidic’’ sites. These rate constants, when normalized rigorously by the number of residual H+ sites were independent of Na+ content on both H-USY and CD-HUSY samples, reflecting the stoichiometric replacement of protons that are uniform in reactivity by Na+ cations. Monomolecular isobutane cracking and dehydrogenation rate constants (per H+; 763 K), however, were higher on H-USY than CD-HUSY (by a factor of 1.4). Equilibrium constants for the formation of protonated methanol dimers via adsorption of gaseous methanol onto adsorbed methanol monomers, determined from kinetic studies of methanol dehydration to dimethyl ether (433 K), were also higher on H-USY than CD-HUSY (by a factor of 2.1). These larger constants predominantly reflect stronger dispersive interactions in H-USY, consistent with its smaller supercage voids that result from the occlusion of void space by extraframework Al (Alex) residues. These findings appear to clarify enduring controversies about the mechanistic interpretation of the effects of Na+ and Alex species on the catalytic reactivity of FAU zeolites. They also illustrate the need to normalize rates by the number of active sites instead of more convenient but less accurate structural proxies for such sites.

  9. More About "Topic A" and "Topic B" Awards | Department of Energy

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

    More About "Topic A" and "Topic B" Awards More About "Topic A" and "Topic B" Awards The awards pursuant to the Department of Energy's Interconnection-wide Transmission Planning Initiative cover two broad topics. "Topic A" covers Interconnection-Level Analysis and Planning. "Topic B" covers Cooperation Among States on Electric Resource Planning and Priorities, where the states will develop input to the Topic A analyses and perform other

  10. At tank Low Activity Feed Homogeneity Analysis Verification

    SciTech Connect (OSTI)

    DOUGLAS, J.G.

    2000-09-28

    This report evaluates the merit of selecting sodium, aluminum, and cesium-137 as analytes to indicate homogeneity of soluble species in low-activity waste (LAW) feed and recommends possible analytes and physical properties that could serve as rapid screening indicators for LAW feed homogeneity. The three analytes are adequate as screening indicators of soluble species homogeneity for tank waste when a mixing pump is used to thoroughly mix the waste in the waste feed staging tank and when all dissolved species are present at concentrations well below their solubility limits. If either of these conditions is violated, then the three indicators may not be sufficiently chemically representative of other waste constituents to reliably indicate homogeneity in the feed supernatant. Additional homogeneity indicators that should be considered are anions such as fluoride, sulfate, and phosphate, total organic carbon/total inorganic carbon, and total alpha to estimate the transuranic species. Physical property measurements such as gamma profiling, conductivity, specific gravity, and total suspended solids are recommended as possible at-tank methods for indicating homogeneity. Indicators of LAW feed homogeneity are needed to reduce the U.S. Department of Energy, Office of River Protection (ORP) Program's contractual risk by assuring that the waste feed is within the contractual composition and can be supplied to the waste treatment plant within the schedule requirements.

  11. Hydrogen storage materials and method of making by dry homogenation

    DOE Patents [OSTI]

    Jensen, Craig M.; Zidan, Ragaiy A.

    2002-01-01

    Dry homogenized metal hydrides, in particular aluminum hydride compounds, as a material for reversible hydrogen storage is provided. The reversible hydrogen storage material comprises a dry homogenized material having transition metal catalytic sites on a metal aluminum hydride compound, or mixtures of metal aluminum hydride compounds. A method of making such reversible hydrogen storage materials by dry doping is also provided and comprises the steps of dry homogenizing metal hydrides by mechanical mixing, such as be crushing or ball milling a powder, of a metal aluminum hydride with a transition metal catalyst. In another aspect of the invention, a method of powering a vehicle apparatus with the reversible hydrogen storage material is provided.

  12. Topic A Awardee: Eastern Interconnection Planning Collaborative |

    Energy Savers [EERE]

    Department of Energy Eastern Interconnection Planning Collaborative Topic A Awardee: Eastern Interconnection Planning Collaborative Eastern Interconnection Planning Collaborative The Eastern Interconnection Planning Collaborative (EIPC) was initiated by a coalition of regional Planning Authorities. These Planning Authorities are entities listed on the NERC compliance registry as Planning Authorities and represent the entire Eastern Interconnection. The EIPC was founded to be a broad-based,

  13. Renewable Energy Project Development: Advanced Concept Topics

    Energy Savers [EERE]

    Concept Topics An Introduction to Risk, Tribal Roles, and Support Policies in the Renewable Energy Project Development Process Course Outline What we will cover...  About the DOE Office of Indian Energy Education Initiative  Concepts and Policies for Understanding Renewable Energy Projects on Tribal Lands - Risk and Uncertainty - Tribal Project Roles - Policies and Incentives  Additional Information and Resources 2 Introduction The U.S. Department of Energy (DOE) Office of Indian Energy

  14. Renewable Energy Project Development: Advanced Process Topics

    Energy Savers [EERE]

    Process Topics Understanding Energy Markets, Project Scale Decision Factors, Procurement Options, and the Role of the Project Team Course Outline What we will cover...  About the DOE Office of Indian Energy Education Initiative  Processes for Developing Renewable Energy Projects on Tribal Lands - Understanding the Energy Market and Project Scale - Project Scale and Ownership Options - Procurement Process - Project Team  Additional Information and Resources 2 Introduction The U.S.

  15. TEC/WG Tribal Topic Group

    Office of Environmental Management (EM)

    Meeting September 22, 2005 - Pueblo, CO Group Chair: Jay Jones (DOE/OCRWM) Tribal Topic Group Members Present: Richard Arnold (Southern Paiute/CGTO), Vicki Best (Bechtel SAIC-YMP), Kevin Blackwell (DOT/FRA), Sandra Covi (UPRR), Barbara Durham (Timbisha Shoshone Tribe), Greg Fasano (Bechtel SAIC-YMP), Elizabeth Helvey (BSC), Angela Hill (DOE/OCRWM), Judith Holm (DOE/OCRWM), Marsha Keister (INL), Dan King (Oneida Nation), Gary Lanthrum (DOE/OCRWM), Corinne Macaluso (DOE/OCRWM), Calvin Meyers

  16. Tritium Technology Program TTP-1-3089 TPBAR Homogenized Composition

    SciTech Connect (OSTI)

    Love, Edward F.

    2014-10-12

    Homogenized TPBAR number densities contained herein have been derived for unclassified core physics calculations. The use of this information may not provide accurate, conservative or representative results and must be evaluated for applicability to the specific problem.

  17. Distribution of Radiation Density in a Homogeneous Cloudy Laye

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

    of Radiation Density in a Homogeneous Cloudy Layer S. V. Dvoryashin, K. A. Shukorov, A. H. Shukurov, and G. S. Golitsyn A. M. Obukhov Institute of Atmospheric Physics Russian...

  18. Surface functionalization of metal-organic polyhedron for homogeneous...

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

    reactions with linear alkyl anhydrides lead to new MOPs with enhanced solubility. As a result, the surface-modified MOP 4 was demonstrated as a homogeneous Lewis-acid catalyst...

  19. TEC Working Group Topic Groups | Department of Energy

    Energy Savers [EERE]

    Topic Groups TEC Working Group Topic Groups TEC Topic Groups were formed in 1991 following an evaluation of the TEC program. Interested members, DOE and other federal agency staff meet to examine specific issues related to radioactive materials transportation. TEC Topic Groups enable a small number of participants to focus intensively on key issues at a level of detail that is unattainable during the TEC semiannual meetings due to time and group size constraints. Topic Groups meet individually

  20. Homogeneously dispersed, multimetal oxygen-evolving catalysts (Journal

    Office of Scientific and Technical Information (OSTI)

    Article) | SciTech Connect Homogeneously dispersed, multimetal oxygen-evolving catalysts Citation Details In-Document Search This content will become publicly available on March 24, 2017 Title: Homogeneously dispersed, multimetal oxygen-evolving catalysts Earth-abundant first-row (3d) transition-metal-based catalysts have been developed for the oxygen-evolution reaction (OER); however, they operate at overpotentials significantly above thermodynamic requirements. Density functional theory

  1. Preface to Special Topic: Marine Renewable Energy

    SciTech Connect (OSTI)

    Pinto, F. T.; Iglesias, G.; Santos, P. R.; Deng, Zhiqun

    2015-12-30

    Marine renewable energy (MRE) is generates from waves, currents, tides, and thermal resources in the ocean. MRE has been identified as a potential commercial-scale source of renewable energy. This special topic presents a compilation of works selected from the 3rd IAHR Europe Congress, held in Porto, Portugal, in 2014. It covers different subjects relevant to MRE, including resource assessment, marine energy sector policies, energy source comparisons based on levelized cost, proof-of-concept and new-technology development for wave and tidal energy exploitation, and assessment of possible inference between wave energy converters (WEC).

  2. TEC/WG Tribal Topic Group

    Office of Environmental Management (EM)

    April 4, 2005 - Phoenix, AZ Group Chair: Jay Jones (DOE/OCRWM) Tribal Topic Group Members Present: Nancy Bennett (UNM/ATRI), Kevin Blackwell (DOT/FRA), Kristen Ellis (DOE/CI), Ed Gonzales (ELG), Elizabeth Helvey (BSC), Jeff Hepting (Pueblo of Acoma), Robert Holden (NCAI), Judith Holm (DOE/OCRWM), Dan King (Oneida Nation), Gary Lanthrum (DOE/OCRWM), Bob Lupton (DOE/ORD/IR), Corinne Macaluso (DOE/OCRWM), Ellen Ott (DOE/GC), Jennifer Patric (BAH), Stanley Paytiamo (Pueblo of Acoma), Wilda Portner

  3. Fuel Synthesis Catalysis Laboratory: Catalytic Testing for Thermochemical Transformations of Molecules (Fact Sheet), NREL (National Renewable Energy Laboratory)

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

    Synthesis Catalysis Laboratory Catalytic testing for thermochemical transformations of molecules NREL is a national laboratory of the U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, operated by the Alliance for Sustainable Energy, LLC. NREL's Fuel Synthesis Catalysis Laboratory (FSCL) provides a wide range of capabilities in heterogeneous catalyst testing. Current research areas of emphasis include the transformation of biomass pyrolysis and gasification products to

  4. This research was supported as part of the Catalysis Center for Energy Innovatio

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

    This research was supported as part of the Catalysis Center for Energy Innovation, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Improving Efficiencies in Fuel, Chemical and Pharmaceutical Industries Repetitive branching, a novel and simple synthesis method, produces zeolite crystals with large-pore "highways" that improve transport and utilization of chemicals within the crystal This research was

  5. Theoretical/Computational Tools for Energy-Relevant Catalysis | The Ames

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

    Laboratory Theoretical/Computational Tools for Energy-Relevant Catalysis FWP/Project Description: Project Leader(s): James Evans, Mark Gordon Principal Investigators: James Evans, Mark Gordon This project will develop new strategies for and integrated combinations of electronic structure analysis and statistical mechanical, coarse-grained, and multi-scale modeling approaches to treat energy-relevant heterogeneous catalytic systems. Currently, there is a lack of effective molecular-level

  6. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support of HCCI

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

    Emission Control | Department of Energy Presentation given at the 2007 Diesel Engine-Efficiency & Emissions Research Conference (DEER 2007). 13-16 August, 2007, Detroit, Michigan. Sponsored by the U.S. Department of Energy's (DOE) Office of FreedomCAR and Vehicle Technologies (OFCVT). PDF icon deer07_rappe.pdf More Documents & Publications Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support of HCCI Emission Control Selectlive Catalytic Reducution of NOx wilth Diesel-Based

  7. Kokes Awards for the 22nd North American Catalysis Society Meeting, June 5-10, 2011

    SciTech Connect (OSTI)

    Fabio H. Ribeiro

    2011-06-05

    The biennial North American Catalysis Society (NACS) Meetings are the premiere conferences in the area of catalysis, surface science, and reaction engineering. The 22nd meeting will be held the week of June 5-10, 2011 in Detroit, Michigan. The objective of the Meetings is to bring together leading researchers for intensive scientific exchange and interactions. Financial support that offsets some of the associated costs (specifically, registration fee, airline tickets, and hotel accommodations) would encourage graduate students, and for the first time undergraduate students, to attend and participate meaningfully in this conference. The funds sought in this proposal will help support the Richard J. Kokes Travel Award program. Graduate students eligible for these merit-based Awards are those who study at a North American university and who will present at the Meeting. We have currently 209 applications and we expect to be able to fund about half of them. The NACS has traditionally sought to encourage graduate student, and this year for the first time undergraduate studies, participation at the National Meetings and providing financial support is the most effective means to do so. Their attendance would contribute significantly to their scientific training and communication and presentation skills. They would be exposed to the leading researchers from the US and abroad; they would meet their peers from other universities; they would learn about cutting-edge results that could benefit their research projects; and they may become interested in becoming active participants in the catalysis community. These young investigators represent the next generation of scientists and engineers, and their proper training will lead to future scientific breakthroughs and technological innovations that benefit the US economy. Advances in catalysis can come in the form of more energy-efficient and environmentally-friendly chemical processes, improved fuel cell performance, efficient hydrogen production, and a cleaner environment.

  8. Kokes Awards for the 23rd North American Catalysis Society Meeting

    SciTech Connect (OSTI)

    Jacobs, Gary

    2014-01-31

    The Tri-State Catalysis Society awarded 107 Kokes Travel Awards. The program was very successful and to date this was the most Kokes Travel Awards ever awarded at a North American Catalysis Society Meeting. It provided students who merited an award the opportunity to attend the meeting, present a paper in the form of either an oral presentation or a poster presentation, and to serve the North American Catalysis Society by participating in the organization of the meeting. Students worked very hard during the week of the meeting to make it a success. Financial support for the Kokes awards was provided by DOE, NSF, NACS, as well as the Tri-State Catalysis Society, the latter through fund raising activities, and other donations. AT the meeting, each student received over $1050 in kind to offset the costs of registration fees ($260), hotel accommodations ($295.7), transportation ($400 travel allowance), as well as T-shirts ($20), and banquet tickets ($95 provided by donations from society members). In addition, for the first time, students received certificates that were signed by the President of NACS, Professor Enrique Iglesia, and by the Kokes Awards Chair, Gary Jacobs (see last page). A list of meeting co-chairs (i.e., Uschi M. Graham, Umit S. Ozkan, and Madan Bhassin) and the honorary chair (Burtron H. Davis) was also included on the certificate, along with the name of the recipient. The awardees were chosen on a merit-based guideline which also included the requirements of having a presentation accepted at the meeting and being a student at a North American University. The Richard J. Kokes Student Travel Award Committee (Gary Jacobs, Rodney Andrews, and Peter Smirniotis) with help from the Organizing Committee were able to secure money from four sources as detailed in Table 1. As detailed by our Treasurer, Dr. Helge Toufar of Clariant, the total amount spent was $105,000.

  9. Catalysis by Design: Bridging the Gap Between Theory and Experiments at

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

    Nanoscale Level | Department of Energy Studies on a simple platinum-alumina system constitute a first step toward a "catalyst by design" approach. PDF icon deer08_narula.pdf More Documents & Publications Catalysis by Design: Bridging the Gap between Theory and Experiments Catalyst by Design - Theoretical, Nanostructural, and Experimental Studies of Oxidation Catalyst for Diesel Engine Emission Treatment

  10. NMR Computational Studies of Solid Acidity/Fundamental Studies of Catalysis by Solid Acids

    SciTech Connect (OSTI)

    James F. Haw

    2008-06-28

    This project focused on catalysis by zeolites and the synergy of spectroscopic characterization and theoretical modeling. In collaboration with the Waroquier group in Belgium we used state-of-the-art quantum chemical simulations on a supramolecular model of both the HZSM-5 zeolite and the co-catalytic hydrocarbon pool species and calculated a full catalytic cycle (including all rate constants) for methanol-to-olefin (MTO) catalysis involving a hydrocarbon pool species. This work not only represents the most robust computational analysis of a successful MTO route to date, but it also succeeds in tying together the many experimental clues. That work was featured on the cover of Angewandte Chemie. More recently we elucidated several unsuspected roles for formaldehyde in methanol to olefin catalysis. Formaldehyde proves to be a key species responsible for both the growth of the catalytically active hydrocarbon pool and its inevitable aging into deactivated polycyclic aromatic species. The apparent inevitability of formaldehyde formation at high temperatures, in particular in contact with active metal or metal oxide surfaces, may put some fundamental limitations on the economic potential of conversion of methanol to olefins.

  11. Variable valve timing in a homogenous charge compression ignition engine

    DOE Patents [OSTI]

    Lawrence, Keith E.; Faletti, James J.; Funke, Steven J.; Maloney, Ronald P.

    2004-08-03

    The present invention relates generally to the field of homogenous charge compression ignition engines, in which fuel is injected when the cylinder piston is relatively close to the bottom dead center position for its compression stroke. The fuel mixes with air in the cylinder during the compression stroke to create a relatively lean homogeneous mixture that preferably ignites when the piston is relatively close to the top dead center position. However, if the ignition event occurs either earlier or later than desired, lowered performance, engine misfire, or even engine damage, can result. The present invention utilizes internal exhaust gas recirculation and/or compression ratio control to control the timing of ignition events and combustion duration in homogeneous charge compression ignition engines. Thus, at least one electro-hydraulic assist actuator is provided that is capable of mechanically engaging at least one cam actuated intake and/or exhaust valve.

  12. A Computationally Based Approach to Homogenizing Advanced Alloys

    SciTech Connect (OSTI)

    Jablonski, P D; Cowen, C J

    2011-02-27

    We have developed a computationally based approach to optimizing the homogenization heat treatment of complex alloys. The Scheil module within the Thermo-Calc software is used to predict the as-cast segregation present within alloys, and DICTRA (Diffusion Controlled TRAnsformations) is used to model the homogenization kinetics as a function of time, temperature and microstructural scale. We will discuss this approach as it is applied to both Ni based superalloys as well as the more complex (computationally) case of alloys that solidify with more than one matrix phase as a result of segregation. Such is the case typically observed in martensitic steels. With these alloys it is doubly important to homogenize them correctly, especially at the laboratory scale, since they are austenitic at high temperature and thus constituent elements will diffuse slowly. The computationally designed heat treatment and the subsequent verification real castings are presented.

  13. Cryogenic homogenization and sampling of heterogeneous multi-phase feedstock

    DOE Patents [OSTI]

    Doyle, Glenn Michael (Lakewood, CO); Ideker, Virgene Linda (Arvada, CO); Siegwarth, James David (Boulder, CO)

    2002-01-01

    An apparatus and process for producing a homogeneous analytical sample from a heterogenous feedstock by: providing the mixed feedstock, reducing the temperature of the feedstock to a temperature below a critical temperature, reducing the size of the feedstock components, blending the reduced size feedstock to form a homogeneous mixture; and obtaining a representative sample of the homogeneous mixture. The size reduction and blending steps are performed at temperatures below the critical temperature in order to retain organic compounds in the form of solvents, oils, or liquids that may be adsorbed onto or absorbed into the solid components of the mixture, while also improving the efficiency of the size reduction. Preferably, the critical temperature is less than 77 K (-196.degree. C.). Further, with the process of this invention the representative sample may be maintained below the critical temperature until being analyzed.

  14. Hot Topics Workshop - February 2015 | Photosynthetic Antenna Research

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

    Center - February 2015 Hot Topics Workshop - February 2015 Shots from our Hot Topics Workshop: Energy and the Environment for Secondary Science Teachers. Original Event Info found here

  15. Probing oxygen vacancy concentration and homogeneity in solid-oxide

    Office of Scientific and Technical Information (OSTI)

    fuel-cell cathode materials on the subunit-cell level (Journal Article) | SciTech Connect Probing oxygen vacancy concentration and homogeneity in solid-oxide fuel-cell cathode materials on the subunit-cell level Citation Details In-Document Search Title: Probing oxygen vacancy concentration and homogeneity in solid-oxide fuel-cell cathode materials on the subunit-cell level Oxygen vacancy distributions and dynamics directly control the operation of solid-oxide fuel cells and are

  16. SBIR and STTR: Topics, FY 2015 Phase I Release 2

    Broader source: Energy.gov [DOE]

    Small Business Innovation Research (SBIR) and Small Business Technology Transfer (STTR) Programs: Topics, FY 2015, Phase I, Release 2.

  17. TEC Working Group Topic Groups Archives Communications Meeting Summaries |

    Office of Environmental Management (EM)

    Department of Energy Archives Communications Meeting Summaries TEC Working Group Topic Groups Archives Communications Meeting Summaries Meeting Summaries PDF icon Milwaukee TEC Meeting, Communications Topic Group Summary - July 1998 PDF icon Inaugural Group Meeting - April 1998 More Documents & Publications TEC Working Group Topic Groups Archives Communications Conference Call Summaries TEC Meeting Summaries - January 1997 TEC Working Group Topic Groups Tribal Conference Call

  18. TEC Working Group Topic Groups Rail Conference Call Summaries Inspections

    Office of Environmental Management (EM)

    Subgroup | Department of Energy Summaries Inspections Subgroup TEC Working Group Topic Groups Rail Conference Call Summaries Inspections Subgroup Inspections Subgroup PDF icon April 6, 2006 PDF icon February 23, 2006 Draft PDF icon January 24, 2006 More Documents & Publications TEC Working Group Topic Groups Rail Conference Call Summaries Planning Subgroup TEC Working Group Topic Groups Rail Conference Call Summaries Tracking Subgroup TEC Working Group Topic Groups Rail Conference Call

  19. TEC Working Group Topic Groups Rail Key Documents Radiation Monitoring

    Office of Environmental Management (EM)

    Subgroup | Department of Energy Radiation Monitoring Subgroup TEC Working Group Topic Groups Rail Key Documents Radiation Monitoring Subgroup Radiation Monitoring Subgroup PDF icon Draft Work Plan - February 4, 2008 More Documents & Publications TEC Working Group Topic Groups Rail Meeting Summaries TEC Working Group Topic Groups Rail Conference Call Summaries Radiation Monitoring Subgroup TEC Working Group Topic Groups Rail Key Documents Intermodal Subgroup

  20. TEC Working Group Topic Groups Archives Protocols Conference Call Summaries

    Office of Environmental Management (EM)

    | Department of Energy Conference Call Summaries TEC Working Group Topic Groups Archives Protocols Conference Call Summaries Conference Call Summaries PDF icon May 13, 1999 PDF icon April 8, 1999 PDF icon March 1, 1999 More Documents & Publications TEC Working Group Topic Groups Archives Protocols Meeting Summaries TEC Working Group Topic Groups Archives Communications Conference Call Summaries

  1. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support of HCCI Emission Control

    Broader source: Energy.gov [DOE]

    Development of catalyst materials to facilitate the low-temperature oxidation of hydrocarbons and CO in homogeneous charge compression ignition (HCCI) emissions.

  2. Search tool plug-in: imploements latent topic feedback

    Energy Science and Technology Software Center (OSTI)

    2011-09-23

    IRIS is a search tool plug-in that is used to implement latent topic feedback for enhancing text navigation. It accepts a list of returned documents from an information retrieval wywtem that is generated from keyword search queries. Data is pulled directly from a topic information database and processed by IRIS to determine the most prominent and relevant topics, along with topic-ngrams, associated with the list of returned documents. User selected topics are then used tomore » expand the query and presumabley refine the search results.« less

  3. Application of lidar to current atmospheric topics

    SciTech Connect (OSTI)

    Sedlacek, A.J. III

    1996-12-31

    The goal of the conference was to address the various applications of lidar to topics of interest in the atmospheric community. Specifically, with the development of frequency-agile, all solid state laser systems, high-quantum-efficiency detectors, increased computational power along with new and more powerful algorithms, and novel detection schemes, the application of lidar to both old and new problems has expanded. This expansion is evidenced by the contributions to the proceedings, which demonstrate the progress made on a variety of atmospheric remote sensing problems, both theoretically and experimentally. The first session focused on aerosol, ozone, and temperature profile measurements from ground-based units. The second session, Chemical Detection, provided applications of lidar to the detection of atmospheric pollutants. Papers in the third session, Wind and Turbulence Measurements, described the Multi-center Airborne Coherent Atmospheric Wind Sensor (MACAWS) experiments, Doppler techniques for ground-based wind profiling and mesopause radial wind and temperature measurements utilizing a frequency-agile lidar system. The papers in the last two sessions, Recent Advanced in Lidar Technology and Techniques and Advanced Operational Lidars, provided insights into novel approaches, materials, and techniques that would be of value to the lidar community. Papers have been processed separately for inclusion on the data base.

  4. Electric-field enhanced performance in catalysis and solid-state devices involving gases

    DOE Patents [OSTI]

    Blackburn, Bryan M.; Wachsman, Eric D.; Van Assche, IV, Frederick Martin

    2015-05-19

    Electrode configurations for electric-field enhanced performance in catalysis and solid-state devices involving gases are provided. According to an embodiment, electric-field electrodes can be incorporated in devices such as gas sensors and fuel cells to shape an electric field provided with respect to sensing electrodes for the gas sensors and surfaces of the fuel cells. The shaped electric fields can alter surface dynamics, system thermodynamics, reaction kinetics, and adsorption/desorption processes. In one embodiment, ring-shaped electric-field electrodes can be provided around sensing electrodes of a planar gas sensor.

  5. Homogeneous charge engines -- Basis of cyclic variations. Final report

    SciTech Connect (OSTI)

    Whitelaw, J.H.

    1997-06-30

    The objectives of the Grant required investigations of cyclic variations in a homogeneous-charge engine initially with gas combustion and the air from ranging from near quiescent to the incorporation of swirl and tumble by valve inserts. Later experiments were performed with unleaded gasoline. The measurements included local velocity and cylinder pressure through the four strokes of a single-cylinder engine, under motored and firing conditions and with examination of the flame kernel growth by combinations of photography and flame-ionization gauges. In all cases, the measurements of in-cylinder characteristics were linked to performance as measured in terms of speed and its variability, load and emissions. The experiments progressed to consider deviations from homogeneous charge and included consideration of stratified charge with local injection of a rich mixture in the vicinity of the spark gap so as to establish a flame kernel which would propagate securely into an overall weak mixture.

  6. Apparatus for unilateral generation of a homogeneous magnetic field

    DOE Patents [OSTI]

    Fukushima, E.; Rath, A.R.; Roeder, S.B.W.

    1984-05-01

    An apparatus for unilaterally producing a substantially homogeneous magnetic field. The apparatus includes two circular electromagnet coils, a small coil and a large coil, which are coaxial with one another and which are separated by a distance equal to one-half the difference in the radius of the two coils. By appropriate selection of electrical currents, which are passed through the coils in opposite directions, a region of homogeneous magnetic field is formed. This region is centered on the common axis of the two coils, at a point on the axis which is at a distance from the small coil equal to one-half the radius of the small coil, and which is on the opposite side of the small coil from the large coil. The apparatus has particular application in the field of diagnostic medical NMR and other NMR applications.

  7. Apparatus for unilateral generation of a homogeneous magnetic field

    DOE Patents [OSTI]

    Fukushima, Eiichi; Rath, Alan R.; Roeder, Stephen B. W.

    1988-01-01

    An apparatus for unilaterally producing a substantially homogeneous magnetic field. The apparatus includes two circular electromagnet coils, a small coil and a large coil, which are coaxial with one another and which are separated by a distance equal to one-half the difference in the radius of the two coils. By appropriate selection of electrical currents, which are passed through the coil in opposite directions, a region of homogeneous magnetic field is formed. This region is centered on the common axis of the two coils, at a point on the axis which is at a distance from the small coil equal to one-half the radius of the small coil, and which is on the opposite side of the small coil from the large coil. The apparatus has particular application in the field of diagnostic medical NMR and other NMR applications.

  8. Simulator for SUPO, a Benchmark Aqueous Homogeneous Reactor (AHR)

    SciTech Connect (OSTI)

    Klein, Steven Karl; Determan, John C.

    2015-10-14

    A simulator has been developed for SUPO (Super Power) an aqueous homogeneous reactor (AHR) that operated at Los Alamos National Laboratory (LANL) from 1951 to 1974. During that period SUPO accumulated approximately 600,000 kWh of operation. It is considered the benchmark for steady-state operation of an AHR. The SUPO simulator was developed using the process that resulted in a simulator for an accelerator-driven subcritical system, which has been previously reported.

  9. High load operation in a homogeneous charge compression ignition engine

    DOE Patents [OSTI]

    Duffy, Kevin P.; Kieser, Andrew J.; Liechty, Michael P.; Hardy, William L.; Rodman, Anthony; Hergart, Carl-Anders

    2008-12-23

    A homogeneous charge compression ignition engine is set up by first identifying combinations of compression ratio and exhaust gas percentages for each speed and load across the engines operating range. These identified ratios and exhaust gas percentages can then be converted into geometric compression ratio controller settings and exhaust gas recirculation rate controller settings that are mapped against speed and load, and made available to the electronic

  10. Multicomponent homogeneous alloys and method for making same

    DOE Patents [OSTI]

    Dutta, Partha S.; Miller, Thomas R.

    2003-09-02

    The present application discloses a method for preparing a homogeneous ternary or quaternary alloy from a quaternary melt. The method includes providing a family of phase diagrams for the quaternary melt which shows (i) composition/temperature data, (ii) tie lines connecting equilibrium liquid and solid compositions, and (iii) isotherms representing boundaries of a miscibility gap. Based on the family of phase diagrams, a quaternary melt composition and an alloy growth temperature is selected. A quaternary melt having the selected quaternary melt composition is provided and a ternary or quaternary alloy is grown from the quaternary melt at the selected alloy growth temperature. A method for making homogeneous ternary or quaternary alloy from a ternary or quaternary melt is also disclosed, as are homogeneous quaternary single-crystal alloys which are substantially free from crystal defects and which have the formula A.sub.x B.sub.1-x C.sub.y D.sub.1-y, x and y being the same or different and in the range of 0.001 to 0.999.

  11. Interconnection-Wide Transmission Planning Initiative: Topic A,

    Energy Savers [EERE]

    Interconnection-Level Analysis and Planning | Department of Energy A, Interconnection-Level Analysis and Planning Interconnection-Wide Transmission Planning Initiative: Topic A, Interconnection-Level Analysis and Planning A description of the requirements for Topic A for all Interconnections under the Interconnection-Wide Transmission Planning Initiative, part of the American Recovery and Reinvestment Act. PDF icon Interconnection-Wide Transmission Planning Initiative: Topic A,

  12. 2013 February POTENTIAL COMMITTEE MEETING TOPICS HAB Committee: RAP

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

    Page 1 of 3 2013 February POTENTIAL COMMITTEE MEETING TOPICS HAB Committee: RAP Committee meeting: Tuesday, February 12 from 9 a.m. - 4 p.m. Agenda Topic When is HAB input needed? Issue Managers (* = lead) Agency Lead(s) Time to Allocate (minutes) Title: Framing Discussion: Central Plateau Groundwater and Vadose Zone Modeling (JOINT TOPIC W/ TWC) 2013 Priority: Groundwater Modeling Purpose: To hear a report-out from issue managers on their work regarding Central Plateau groundwater and vadose

  13. TEC Working Group Topic Groups Archives Communications Conference Call

    Office of Environmental Management (EM)

    Summaries | Department of Energy Communications Conference Call Summaries TEC Working Group Topic Groups Archives Communications Conference Call Summaries Conference Call Summaries PDF icon Conference Call Summary April 2000 PDF icon Conference Call Summary February 1999 PDF icon Conference Call Summary November 1998 More Documents & Publications TEC Working Group Topic Groups Archives Communications Meeting Summaries TEC Working Group Topic Groups Tribal Conference Call Summaries TEC

  14. TEC Working Group Topic Groups Archives Training - Medical Training |

    Office of Environmental Management (EM)

    Department of Energy Training - Medical Training TEC Working Group Topic Groups Archives Training - Medical Training The TEC Training and Medical Training Issues Topic Group was formed to address the training issues for emergency responders in the event of a radioactive material transportation incident. The Topic Group first met in 1996 to assist DOE in developing an approach to address radiological emergency response training needs and to avoid redundancy of existing training materials. The

  15. TRIBAL ISSUES TOPIC GROUP MEETING SUMMARY Milwaukee, WI July 1998

    Office of Environmental Management (EM)

    Milwaukee, WI July 1998 The Topic Group is developing a process to identify appropriate Topic Group membership, and will be working on a protocol for identifying and inviting individual tribes to participate he group identified five actions: (1) catalogue tribal transportation issues; (2) identify a level of tribal awareness of DOE transportation issues; (3) examine funding and tribal support; (4) develop a process for Tribal Topic Group membership; and (5) review the best channels to

  16. Small Business Innovation Research Program Topics- October 28, 2013

    Broader source: Energy.gov [DOE]

    This document outlines the topics covered by the 2013-14 SBIR funding opportunity announcement and show the details of how to apply for the program.

  17. Focus Group Meeting (Topical Wrap-Up) | Department of Energy

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

    Wrap-Up) Focus Group Meeting (Topical Wrap-Up) Meeting Date: December 4, 2008 Meeting ... More Documents & Publications Focus Group Meeting (Activities Status) Focus Group Meeting ...

  18. Focus Group Meeting (Topical Meeting) | Department of Energy

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

    Enforcement Inspection Schedule More Documents & Publications Focus Group Meeting (Activities Status) Focus Group Meeting (Activities Status) Focus Group Meeting (Topical Wrap-Up)

  19. TEC Working Group Topic Groups Rail Key Documents Radiation Monitoring...

    Office of Environmental Management (EM)

    Radiation Monitoring Subgroup TEC Working Group Topic Groups Rail Key Documents Radiation Monitoring Subgroup Radiation Monitoring Subgroup PDF icon Draft Work Plan - February 4,...

  20. Topic A and B Awardee: Electric Reliability Council of Texas...

    Office of Environmental Management (EM)

    and B Awardee: Electric Reliability Council of Texas Topic A and B Awardee: Electric Reliability Council of Texas The Electric Reliability Council of Texas (ERCOT) manages the flow ...

  1. TEC Working Group Topic Groups Section 180(c) Meeting Summaries...

    Office of Environmental Management (EM)

    Meeting Summaries TEC Working Group Topic Groups Section 180(c) Meeting Summaries Meeting Summaries PDF icon Washington, DC TEC Meeting - 180(c) Group Summary - March 15, 2006 More...

  2. TEC Working Group Topic Groups Rail Conference Call Summaries...

    Office of Environmental Management (EM)

    Summaries Inspections Subgroup TEC Working Group Topic Groups Rail Conference Call Summaries Inspections Subgroup Inspections Subgroup PDF icon April 6, 2006 PDF icon February 23,...

  3. TEC Working Group Topic Groups Routing Conference Call Summaries...

    Office of Environmental Management (EM)

    Routing Conference Call Summaries TEC Working Group Topic Groups Routing Conference Call Summaries CONFERENCE CALL SUMMARIES PDF icon January 31, 2008 PDF icon December 6, 2007 PDF...

  4. TEC Working Group Topic Groups Security Meeting Summaries | Department...

    Office of Environmental Management (EM)

    Meeting Summaries TEC Working Group Topic Groups Security Meeting Summaries Meeting Summaries PDF icon Green Bay STG Meeting Summary- September 14, 2006 PDF icon Washington STG...

  5. TEC Working Group Topic Groups Archives Mechanics of Funding...

    Office of Environmental Management (EM)

    Mechanics of Funding and Techical Assistance TEC Working Group Topic Groups Archives Mechanics of Funding and Techical Assistance Mechanics of Funding and Techical Assistance Items...

  6. TEC Working Group Topic Groups Rail Archived Documents | Department...

    Office of Environmental Management (EM)

    Archived Documents TEC Working Group Topic Groups Rail Archived Documents ARCHIVED DOCUMENTS PDF icon Inspections Summary Matrix PDF icon TEC Transportation Safety WIPP-PIG Rail...

  7. TEC Working Group Topic Groups Tribal Conference Call Summaries...

    Office of Environmental Management (EM)

    Conference Call Summaries TEC Working Group Topic Groups Tribal Conference Call Summaries Conference Call Summaries PDF icon March 12, 2008 PDF icon October 3, 2007 PDF icon...

  8. TEC Working Group Topic Groups Archives Communications Conference...

    Office of Environmental Management (EM)

    Communications Conference Call Summaries TEC Working Group Topic Groups Archives Communications Conference Call Summaries Conference Call Summaries PDF icon Conference Call Summary...

  9. TEC Working Group Topic Groups Archives Communications Meeting...

    Office of Environmental Management (EM)

    Archives Communications Meeting Summaries TEC Working Group Topic Groups Archives Communications Meeting Summaries Meeting Summaries PDF icon Milwaukee TEC Meeting, Communications...

  10. TEC Working Group Topic Groups Section 180(c) Key Documents ...

    Office of Environmental Management (EM)

    Key Documents TEC Working Group Topic Groups Section 180(c) Key Documents Key Documents Briefing Package for Section 180(c) Implementation - July 2005 PDF icon Executive Summary...

  11. TEC Working Group Topic Groups Security Conference Call Summaries...

    Office of Environmental Management (EM)

    Security Conference Call Summaries TEC Working Group Topic Groups Security Conference Call Summaries Conference Call Summaries PDF icon August 17, 2006 (Draft) PDF icon July 18,...

  12. TEC Working Group Topic Groups Rail Key Documents | Department...

    Office of Environmental Management (EM)

    Rail Key Documents TEC Working Group Topic Groups Rail Key Documents KEY DOCUMENTS Radiation Monitoring Subgroup Intermodal Subgroup Planning Subgroup PDF icon Current FRA State...

  13. TEC Working Group Topic Groups Rail Key Documents Intermodal...

    Office of Environmental Management (EM)

    Intermodal Subgroup TEC Working Group Topic Groups Rail Key Documents Intermodal Subgroup Intermodal Subgroup PDF icon Draft Work Plan More Documents & Publications TEC Working...

  14. AMO Requests Technical Topics Suitable for a Manufacturing Innovation...

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

    Innovation Institute AMO Requests Technical Topics Suitable for a Manufacturing Innovation Institute April 17, 2014 - 12:23pm Addthis The Advanced Manufacturing Office...

  15. Microsoft PowerPoint - Chairs Round Robin Presentation- Topics...

    Energy Savers [EERE]

    April 22, 2015 www.energy.govEM 2 Savannah River Citizens' Advisory Board Topic: * Liquid ... Board Issues: * Waste Isolation Pilot Plant (WIPP): The status of recovery efforts ...

  16. Microsoft Word - Tribal Topic Group Summary March 06 final _3...

    Office of Environmental Management (EM)

    TEC Tribal Topic Group Meeting Tuesday, March 14, 2006 Washington, DC Participants: Jay Jones, Department of Energy (DOE)Office of Civilian Radioactive Waste Management (OCRWM),...

  17. Topic B Awardee: Eastern Interconnection States' Planning Council...

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

    Eastern Interconnection States' Planning Council Topic B Awardee: Eastern Interconnection States' Planning Council The Eastern Interconnection States' Planning Council (EISPC) is ...

  18. Events & Topics in Renewable Energy & the Environment | Photosynthetic...

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

    Technologies campus, followed by a brief presentation. Topics will include home automation, the internet of things, wireless sensor networks and other smart technologies. The...

  19. TEC Working Group Topic Groups Tribal Meeting Summaries | Department...

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

    Tribal Meeting Summaries TEC Working Group Topic Groups Tribal Meeting Summaries Meeting Summaries PDF icon Kansas City TEC Meeting - Tribal Group Summary - July 25, 2007 PDF icon ...

  20. Understanding catalysis in a multiphasic two-dimensional transition metal dichalcogenide.

    SciTech Connect (OSTI)

    Chou, Stanley Shihyao; Sai, Na; Lu, Ping; Coker, Eric Nicholas; Liu, Sheng; Artyushkova, Kateryna; Luk, Ting S.; Kaehr, Bryan James; Brinker, C. Jeffrey

    2015-10-07

    Establishing processing–structure–property relationships for monolayer materials is crucial for a range of applications spanning optics, catalysis, electronics and energy. Presently, for molybdenum disulfide, a promising catalyst for artificial photosynthesis, considerable debate surrounds the structure/property relationships of its various allotropes. Here we unambiguously solve the structure of molybdenum disulfide monolayers using high-resolution transmission electron microscopy supported by density functional theory and show lithium intercalation to direct a preferential transformation of the basal plane from 2H (trigonal prismatic) to 1T' (clustered Mo). These changes alter the energetics of molybdenum disulfide interactions with hydrogen (ΔGH), and, with respect to catalysis, the 1T' transformation renders the normally inert basal plane amenable towards hydrogen adsorption and hydrogen evolution. Furthermore, we show basal plane activation of 1T' molybdenum disulfide and a lowering of ΔGH from +1.6 eV for 2H to +0.18 eV for 1T', comparable to 2H molybdenum disulfide edges on Au(111), one of the most active hydrogen evolution catalysts known.

  1. Understanding catalysis in a multiphasic two-dimensional transition metal dichalcogenide.

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

    Chou, Stanley Shihyao; Sai, Na; Lu, Ping; Coker, Eric Nicholas; Liu, Sheng; Artyushkova, Kateryna; Luk, Ting S.; Kaehr, Bryan James; Brinker, C. Jeffrey

    2015-10-07

    Establishing processing–structure–property relationships for monolayer materials is crucial for a range of applications spanning optics, catalysis, electronics and energy. Presently, for molybdenum disulfide, a promising catalyst for artificial photosynthesis, considerable debate surrounds the structure/property relationships of its various allotropes. Here we unambiguously solve the structure of molybdenum disulfide monolayers using high-resolution transmission electron microscopy supported by density functional theory and show lithium intercalation to direct a preferential transformation of the basal plane from 2H (trigonal prismatic) to 1T' (clustered Mo). These changes alter the energetics of molybdenum disulfide interactions with hydrogen (ΔGH), and, with respect to catalysis, the 1T' transformationmore » renders the normally inert basal plane amenable towards hydrogen adsorption and hydrogen evolution. Furthermore, we show basal plane activation of 1T' molybdenum disulfide and a lowering of ΔGH from +1.6 eV for 2H to +0.18 eV for 1T', comparable to 2H molybdenum disulfide edges on Au(111), one of the most active hydrogen evolution catalysts known.« less

  2. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    catalysis (heterogeneous), solar (photovoltaic), solar (fuels), photosynthesis ... (4) catalysis (homogeneous), solar (photovoltaic), bio-inspired, charge transport, ...

  3. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    ... catalysis (heterogeneous), solar (photovoltaic), solar (fuels), photosynthesis ... (27) catalysis (homogeneous), solar (photovoltaic), bio-inspired, charge transport, ...

  4. Multiferroicity of Carbon-Based Charge-Transfer Magnets (Journal...

    Office of Scientific and Technical Information (OSTI)

    Research Org: Energy Frontier Research Centers (EFRC); Argonne-Northwestern Solar Energy ... Subject: catalysis (homogeneous), catalysis (heterogeneous), solar (photovoltaic), solar ...

  5. A bioinspired redox relay that mimics radical interactions of...

    Office of Scientific and Technical Information (OSTI)

    Subject: catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), photosynthesis (natural and artificial), bio-inspired, hydrogen and fuel cells, electrodes - solar, ...

  6. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), photosynthesis (natural and artificial), bio-inspired, hydrogen and fuel cells, electrodes - solar, charge ...

  7. Mimicking the electron transfer chain in photosystem II with...

    Office of Scientific and Technical Information (OSTI)

    Subject: catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), photosynthesis (natural and artificial), bio-inspired, hydrogen and fuel cells, electrodes - solar, ...

  8. Optical and electrochemical properties of hydrogen-bondedphenol...

    Office of Scientific and Technical Information (OSTI)

    Subject: catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), photosynthesis (natural and artificial), bio-inspired, hydrogen and fuel cells, electrodes - solar, ...

  9. Nanoscale Imaging of Lithium Ion Distribution During In Situ...

    Office of Scientific and Technical Information (OSTI)

    Subject: catalysis (homogeneous), catalysis (heterogeneous), energy storage (including batteries and capacitors), hydrogen and fuel cells, defects, charge transport, membrane, ...

  10. In Situ Electron Energy-Loss Spectroscopy in Liquids (Journal...

    Office of Scientific and Technical Information (OSTI)

    Subject: catalysis (homogeneous), catalysis (heterogeneous), energy storage (including batteries and capacitors), hydrogen and fuel cells, defects, charge transport, membrane, ...

  11. Controlling And Operating Homogeneous Charge Compression Ignition (Hcci) Engines

    DOE Patents [OSTI]

    Flowers, Daniel L. (San Leandro, CA)

    2005-08-02

    A Homogeneous Charge Compression Ignition (HCCI) engine system includes an engine that produces exhaust gas. A vaporization means vaporizes fuel for the engine an air induction means provides air for the engine. An exhaust gas recirculation means recirculates the exhaust gas. A blending means blends the vaporized fuel, the exhaust gas, and the air. An induction means inducts the blended vaporized fuel, exhaust gas, and air into the engine. A control means controls the blending of the vaporized fuel, the exhaust gas, and the air and for controls the inducting the blended vaporized fuel, exhaust gas, and air into the engine.

  12. Exhaust gas recirculation in a homogeneous charge compression ignition engine

    DOE Patents [OSTI]

    Duffy, Kevin P.; Kieser, Andrew J.; Rodman, Anthony; Liechty, Michael P.; Hergart, Carl-Anders; Hardy, William L.

    2008-05-27

    A homogeneous charge compression ignition engine operates by injecting liquid fuel directly in a combustion chamber, and mixing the fuel with recirculated exhaust and fresh air through an auto ignition condition of the fuel. The engine includes at least one turbocharger for extracting energy from the engine exhaust and using that energy to boost intake pressure of recirculated exhaust gas and fresh air. Elevated proportions of exhaust gas recirculated to the engine are attained by throttling the fresh air inlet supply. These elevated exhaust gas recirculation rates allow the HCCI engine to be operated at higher speeds and loads rendering the HCCI engine a more viable alternative to a conventional diesel engine.

  13. Design, Synthesis and Mechanistic Evaluation of Iron-Based Catalysis for Synthesis Gas Conversion to Fuels and Chemicals

    SciTech Connect (OSTI)

    Akio Ishikawa; Manuel Ojeda; Nan Yao; Enrique Iglesia

    2007-03-31

    This project extends previously discovered Fe-based catalysts to hydrogen-poor synthesis gas streams derived from coal and biomass sources. These catalysts have shown unprecedented Fischer-Tropsch synthesis rates and selectivities for synthesis gas derived from methane. During the first reporting period, we certified a microreactor, installed required analytical equipment, and reproduced synthetic protocols and catalytic results previously reported. During the second reporting period, we prepared several Fe-based compositions for Fischer-Tropsch Synthesis and tested the effects of product recycle under both subcritical and supercritical conditions. During the third and fourth reporting periods, we improved the catalysts preparation method, which led to Fe-based materials with the highest FTS reaction rates and selectivities so far reported, a finding that allowed their operation at lower temperatures and pressures with high selectivity to desired products (C{sub 5+}, olefins). During the fifth and sixth reporting period, we studied the effects of different promoters on catalytic performance, specifically how their sequence of addition dramatically influenced the performance of these materials in the Fischer-Tropsch synthesis. We also continued our studies of the kinetic behavior of these materials during the sixth reporting period. Specifically, the effects of H{sub 2}, CO, and CO{sub 2} on the rates and selectivities of Fischer-Tropsch Synthesis reactions led us to propose a new sequence of elementary steps on Fe and Co Fischer-Tropsch catalysts. Finally, we also started a study of the use of colloidal precipitation methods for the synthesis small Co clusters using recently developed methods to explore possible further improvements in FTS rates and selectivities. We found that colloidal synthesis makes possible the preparation of small cobalt particles, although large amount of cobalt silicate species, which are difficult to reduce, were formed. During this seventh reporting period, we have explored several methods to modify the silanol groups on SiO{sub 2} by using either a homogeneous deposition-precipitation method or surface titration of Si-OH on SiO{sub 2} with zirconium (IV) ethoxide to prevent the formation of unreducible and unreactive CoO{sub x} species during synthesis and FTS catalysis. We have synthesized monometallic Co/ZrO{sub 2}/SiO{sub 2} catalysts with different Co loadings (11-20 wt%) by incipient wetness impregnation methods and characterized the prepared Co supported catalysts by H{sub 2} temperature-programmed reduction (H{sub 2}-TPR) and H{sub 2}-chemisorption. We have measured the catalytic performance in FTS reactions and shown that although the hydroxyl groups on the SiO{sub 2} surface are difficult to be fully titrated by ZrO{sub 2}, modification of ZrO{sub 2} on SiO{sub 2} surface can improve the Co clusters dispersion and lead to a larger number of exposed Co surface atoms after reduction and during FTS reactions. During this seventh reporting period, we have also advanced our development of the reaction mechanism proposed in the previous reporting period. Specifically, we have shown that our novel proposal for the pathways involved in CO activation on Fe and Co catalysts is consistent with state-of-the-art theoretical calculations carried out in collaboration with Prof. Manos Mavrikakis (University of Wisconsin-Madison). Finally, we have also worked on the preparation of several manuscripts describing our findings about the preparation, activation and mechanism of the FTS with Fe-based catalysts and we have started redacting the final report for this project.

  14. Wavelet-based surrogate time series for multiscale simulation of heterogeneous catalysis

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

    Savara, Aditya Ashi; Daw, C. Stuart; Xiong, Qingang; Gur, Sourav; Danielson, Thomas L.; Hin, Celine N.; Pannala, Sreekanth; Frantziskonis, George N.

    2016-01-28

    We propose a wavelet-based scheme that encodes the essential dynamics of discrete microscale surface reactions in a form that can be coupled with continuum macroscale flow simulations with high computational efficiency. This makes it possible to simulate the dynamic behavior of reactor-scale heterogeneous catalysis without requiring detailed concurrent simulations at both the surface and continuum scales using different models. Our scheme is based on the application of wavelet-based surrogate time series that encodes the essential temporal and/or spatial fine-scale dynamics at the catalyst surface. The encoded dynamics are then used to generate statistically equivalent, randomized surrogate time series, which canmore » be linked to the continuum scale simulation. As a result, we illustrate an application of this approach using two different kinetic Monte Carlo simulations with different characteristic behaviors typical for heterogeneous chemical reactions.« less

  15. Homogenization limit for a multiband effective mass model in heterostructures

    SciTech Connect (OSTI)

    Morandi, O.

    2014-06-15

    We study the homogenization limit of a multiband model that describes the quantum mechanical motion of an electron in a quasi-periodic crystal. In this approach, the distance among the atoms that constitute the material (lattice parameter) is considered a small quantity. Our model include the description of materials with variable chemical composition, intergrowth compounds, and heterostructures. We derive the effective multiband evolution system in the framework of the kp approach. We study the well posedness of the mathematical problem. We compare the effective mass model with the standard kp models for uniform and non-uniforms crystals. We show that in the limit of vanishing lattice parameter, the particle density obtained by the effective mass model, converges to the exact probability density of the particle.

  16. Crystallization in supercooled liquid Cu: Homogeneous nucleation and growth

    SciTech Connect (OSTI)

    E, J. C.; Wang, L.; Luo, S. N.; Cai, Y.; Wu, H. A.

    2015-02-14

    Homogeneous nucleation and growth during crystallization of supercooled liquid Cu are investigated with molecular dynamics simulations, and the microstructure is characterized with one- and two-dimensional x-ray diffraction. The resulting solids are single-crystal or nanocrystalline, containing various defects such as stacking faults, twins, fivefold twins, and grain boundaries; the microstructure is subject to thermal fluctuations and extent of supercooling. Fivefold twins form via sequential twinning from the solid-liquid interfaces. Critical nucleus size and nucleation rate at 31% supercooling are obtained from statistical runs with the mean first-passage time and survival probability methods, and are about 14 atoms and 10{sup 32} m{sup −3}s{sup −1}, respectively. The bulk growth dynamics are analyzed with the Johnson-Mehl-Avrami law and manifest three stages; the Avrami exponent varies in the range of 1–19, which also depends on thermal fluctuations and supercooling.

  17. The manufacture and performance of homogeneous microstructure SBR MOX fuel

    SciTech Connect (OSTI)

    Barker, Matthew A.; Stephenson, Keith; Weston, Rebecca

    2007-07-01

    In the early 1980's, British experience in the manufacture of mixed-oxide fast reactor fuel was used to develop a new thermal MOX manufacturing route called the Short Binder-less Route (SBR). Laboratory- scale development led to the manufacture of commercial PWR fuel in a small pilot plant, and the construction of the full-scale dual-line Sellafield MOX Plant (SMP). SMP's first MOX assemblies are now under irradiation. SBR MOX is manufactured with 100% co-milled feedstock, leading to a microstructure dominated by a solid solution of (U,Pu)O{sub 2} at the nominal enrichment. A comprehensive fuel performance research programme has demonstrated the benign performance of SBR MOX up to 54 MWd/kgHM. In particular, the homogeneous microstructure is believed to be instrumental in the favourable fission gas retention and PCI resistance properties. (authors)

  18. Hot Topics Workshop-Summer 2014 | Photosynthetic Antenna Research Center

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

    Workshop-Summer 2014 Hot Topics Workshop-Summer 2014 Teachers from St. Louis area schools were welcomed to Washington University in St. Louis to learn about new, exciting classroom activities centered around Solar, Wind, and Biomass energy.

  19. CANCELED - Events & Topics in Renewable Energy & the Environment...

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

    Environment CANCELED - Events & Topics in Renewable Energy & the Environment Midwest Biodiesel Products LLC November 3, 2015 - 4:00pm Please join us for a tour of the Midwest...

  20. EAC Presentation (March 10, 2011): Potential Study Topics | Department...

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

    or whether it should limit itself to providing recommendations to DOE about how the topic should be framed and analyzed by the national laboratories or other parties. PDF icon...

  1. TEC Working Group Topic Groups Security Key Documents | Department...

    Office of Environmental Management (EM)

    Key Documents TEC Working Group Topic Groups Security Key Documents Key Documents PDF icon Security TG Work Plan August 7, 2006 PDF icon Security Lessons Learned Document August 2,...

  2. Proposed Work Scope for the Rail Topic Group

    Office of Environmental Management (EM)

    (TEC) Working Group's Rail Topic Group (RTG) is to provide stakeholder perspectives and ... or as necessary, reporting back to the full RTG on the bimonthly calls and at meetings. ...

  3. Application of cryogenic grinding to achieve homogenization of transuranic wastes

    SciTech Connect (OSTI)

    Atkins, W.H.; Hill, D.D.; Lucero, M.E.; Jaramillo, L.; Martinez, H.E.

    1996-08-01

    This paper describes work done at Los Alamos National Laboratory (LANL) in collaboration with the Department of Energy Rocky Flats Field Office (DOE/RFFO) and with the National Institute of Standards and Technology (NIST), Boulder, Colorado. Researchers on this project have developed a method for cryogenic grinding of mixed wastes to homogenize and, thereby, to acquire a representative sample of the materials. There are approximately 220,000 waste drums owned by the Rocky Flats Environmental Technology Site (RFETS)-50,000 at RFETS and 170,000 at the Idaho National Engineering Laboratory. The cost of sampling the heterogeneous distribution of waste in each drum is prohibitive. In an attempt to produce a homogeneous mixture of waste that would reduce greatly the cost of sampling, researchers at NIST and RFETS are developing a cryogenic grinder. The Los Alamos work herein described addresses the implementation issues of the task. The first issue was to ascertain whether samples of the {open_quotes}small particle{close_quotes} mixtures of materials present in the waste drums at RFETS were representative of actual drum contents. Second, it was necessary to determine at what temperature the grinding operation must be performed in order to minimize or to eliminate the release of volatile organic compounds present in the waste. Last, it was essential to evaluate any effect the liquid cryogen might have on the structural integrity and ventilation capacity of the glovebox system. Results of this study showed that representative samples could be and had been obtained, that some release of organics occurred below freezing because of sublimation, and that operation of the cryogenic grinding equipment inside the glovebox was feasible.

  4. Topics: Determining the Beta Limit - MST - UW Plasma Physics

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

    Determining the Beta Limit UW Madison Madison Symmetric Torus Topics: Determining the Beta Limit MST HomeGraduate Student InformationLinksTourControl and Auxiliary SystemsPhysics TopicsDeviceResearch MissionMST People mst logo CPLA Home Directory Publications Links Internal University of Wisconsin Physics Department Research funding includes support from: Department of Energy National Science Foundation One of the reasons improved confinement in MST can be described as "tokamak-like"

  5. Events & Topics in Renewable Energy & the Environment | Photosynthetic

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

    Antenna Research Center Events & Topics in Renewable Energy & the Environment Events & Topics in Renewable Energy & the Environment Missouri Botanical Garden- EarthWays Center October 6, 2015 - 4:00pm How "green" are you? Join us as we experience a sustainability-themed visit to the Missouri Botanical Garden led by a representative from the EarthWays Center, including an interpretive tour that illustrates the importance of waste minimization, energy, energy

  6. Topical Collaboration "Neutrinos and Nucleosynthesis in Hot and Dense Matter"

    SciTech Connect (OSTI)

    Allahverdi, Rouzbeh

    2015-09-18

    This is the final technical report describing contributions from the University of New Mexico to Topical Collaboration on "Neutrinos and Nucleosynthesis in Hot and Dense Matter" in the period June 2010 through May 2015. During the funding period, the University of New Mexico successfully hired Huaiyu Duan as a new faculty member with the support from DOE, who has contributed to the Topical Collaboration through his research and collaborations.

  7. Manufacturing Innovation Multi-Topic Workshop | Department of Energy

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

    Innovation Multi-Topic Workshop Manufacturing Innovation Multi-Topic Workshop DOE's Advanced Manufacturing Office (AMO) and the Office of Secretary of Defense Manufacturing Technology Program (OSD ManTech) held a joint workshop October 8 and 9, 2014 in Fort Worth, TX. This workshop identified mid-Technology Readiness Level (TRL) research and development (R&D) needs, market and supply chain challenges, and shared facility needs for advanced manufacturing. The workshop complemented a recently

  8. Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation

    Energy Savers [EERE]

    Among States in the Eastern Interconnection on Electric Resource Planning and Priorities | Department of Energy Eastern Interconnection on Electric Resource Planning and Priorities Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation Among States in the Eastern Interconnection on Electric Resource Planning and Priorities A description of the requirements for Topic B for the Eastern Interconnection under the Interconnection-Wide Transmission Planning Initiative, part of

  9. Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation

    Energy Savers [EERE]

    Among States in the Western Interconnection on Electric Resource Planning and Priorities | Department of Energy Western Interconnection on Electric Resource Planning and Priorities Interconnection-Wide Transmission Planning Initiative: Topic B, Cooperation Among States in the Western Interconnection on Electric Resource Planning and Priorities A description of the requirements for Topic B for the Western Interconnection under the Interconnection-Wide Transmission Planning Initiative, part of

  10. Interconnection-Wide Transmission Planning Initiative: Topic B, State

    Energy Savers [EERE]

    Agency Input Regarding Electric Resource and Transmission Planning in the Texas Interconnection | Department of Energy State Agency Input Regarding Electric Resource and Transmission Planning in the Texas Interconnection Interconnection-Wide Transmission Planning Initiative: Topic B, State Agency Input Regarding Electric Resource and Transmission Planning in the Texas Interconnection A description of the requirements for Topic B for the Texas Interconnect under the Interconnection-Wide

  11. Topic B Awardee: Western Governors' Association | Department of Energy

    Energy Savers [EERE]

    Western Governors' Association Topic B Awardee: Western Governors' Association For the Topic A input requirements of the award, the states and provinces in the Western Interconnection have formed a new committee -- the State and Provincial Steering Committee -- to provide input in regional transmission planning and analysis in the interconnection. The Committee will consist of representatives from each state and province in the Western Interconnection. Pending formal announcement, the Committee

  12. Events & Topics In Bioenergy | Photosynthetic Antenna Research Center

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

    Events & Topics In Bioenergy Events & Topics In Bioenergy Dr. Chenyang Lu Smart Building with Wireless Sensor Networks Dr. Joseph Cullen "Measuring the Environmental Benefits of Wind Power" Dr. Pratim Biswas "Aerosol nanoparticle technology enabling solar energy applications: Biohybrid and biomimetic solar devices" Dr. Dewey Holten "Bioinspired and Biohybrid photosynthetic antenna systems for energy applications" Mark Henson "Modeling the Production of

  13. Funding Topics for Small Business Innovation Research and Small Business

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

    Technology Transfer Programs | Department of Energy Topics for Small Business Innovation Research and Small Business Technology Transfer Programs Funding Topics for Small Business Innovation Research and Small Business Technology Transfer Programs Each year, the Office of Energy Efficiency and Renewable Energy's (EERE's) Small Business Innovation Research (SBIR) and Small Business Technology Transfer (STTR) programs issue Funding Opportunity Announcements (FOAs), which invite established or

  14. Request for Information (RFI): Clean Energy Manufacturing Topics Suitable

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

    for a Manufacturing Innovation Institute | Department of Energy Clean Energy Manufacturing Topics Suitable for a Manufacturing Innovation Institute Request for Information (RFI): Clean Energy Manufacturing Topics Suitable for a Manufacturing Innovation Institute April 17, 2014 - 11:04am Addthis Funding: This RFI is not a Funding Opportunity Announcement (FOA); therefore, EERE is not accepting applications at this time. Open Date: 04/17/2014 Close Date: 05/20/2014 Funding Organization: The

  15. 18th Topical Conference High-Temperature Plasma Diagnostics (HTPD) |

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

    Princeton Plasma Physics Lab May 16, 2010, 9:00am to May 20, 2010, 5:00pm Conference Wildwood, New Jersey 18th Topical Conference High-Temperature Plasma Diagnostics (HTPD) The 18th Topical Conference on High-Temperature Plasma Diagnostics will be held May 16-20, 2010 in Wildwood, New Jersey. This biennial conference brings together plasma physicists from a variety of fields including magnetic confinement fusion, inertial confinement fusion, space plasmas, astrophysics, and industrial

  16. SBIR/STTR Phase I Release 2 Technical Topics Announced for FY14 Fuel Cell Topics Included

    Broader source: Energy.gov [DOE]

    Phase I Release 2 technical topics include prototype fuel cell-battery electric hybrid trucks for waste transportation and novel membranes and non-platinum group metal catalysts for direct methanol as well as hydrogen fuel cells.

  17. Dynamic control of a homogeneous charge compression ignition engine

    DOE Patents [OSTI]

    Duffy, Kevin P.; Mehresh, Parag; Schuh, David; Kieser, Andrew J.; Hergart, Carl-Anders; Hardy, William L.; Rodman, Anthony; Liechty, Michael P.

    2008-06-03

    A homogenous charge compression ignition engine is operated by compressing a charge mixture of air, exhaust and fuel in a combustion chamber to an autoignition condition of the fuel. The engine may facilitate a transition from a first combination of speed and load to a second combination of speed and load by changing the charge mixture and compression ratio. This may be accomplished in a consecutive engine cycle by adjusting both a fuel injector control signal and a variable valve control signal away from a nominal variable valve control signal. Thereafter in one or more subsequent engine cycles, more sluggish adjustments are made to at least one of a geometric compression ratio control signal and an exhaust gas recirculation control signal to allow the variable valve control signal to be readjusted back toward its nominal variable valve control signal setting. By readjusting the variable valve control signal back toward its nominal setting, the engine will be ready for another transition to a new combination of engine speed and load.

  18. Events & Topics in Renewable Energy & the Environment | Photosynthetic

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

    Antenna Research Center Events & Topics in Renewable Energy & the Environment Events & Topics in Renewable Energy & the Environment Missouri MetroLink Facility April 12, 2016 - 4:00pm 700 S. Ewing, St. Louis, MO 63103 Event flyer RSVP here Free bus will depart from the front of Brookings Hall at 3:30 pm sharp and will return to the same location following the tour. If you plan to drive yourself, please contact Erin Plut (eplut@wustl.edu) for parking information and meet up

  19. Topic Index to the DOE Administrative Records Disposition Schedules

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

    5/21/07 TOPICINDEXTODOEADMINSCHEDULES Topic Index to the DOE Administrative Records Disposition Schedules (excluding the GRS Schedules) Topic Schedule Item [A] [B] [C] [D] [E] [F] [G] [H] [I] [J] [K] [L] [M] [N] [O] [P] [Q] [R] [S] [T] [U] [V] [W] [X] [Y] [Z] A Academic/Outreach Program 1 44 Access Request Files 18 6 Accountable Officers' Files 6 1 Accounting Administrative Files 6 5 Administrative Claims Files 6 10 Administrative Training Records 1 29.2 Administrative Issuances 16 1

  20. Acoustics topic of upcoming Frontiers in Science series

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

    Acoustics topic of upcoming Frontiers in Science Acoustics topic of upcoming Frontiers in Science series Dipen Sinha will discuss acoustics and its applications, including how it is possible to use sound to solve problems in health, national security and for industry. July 24, 2014 Whenever an object vibrates, it creates sound, vibrations can 0:19 be detected. Besides just listening to it, we can detect it with various sensors. We 0:25 can tell what's inside a single container from the sound or

  1. Sulfation of metal-organic framework: Opportunities for acid catalysis and proton conductivity

    SciTech Connect (OSTI)

    Goesten, M.G.; Stavitski, E.; Juan-Alcaniz, J.; Ramos-Fernandez, E.V.; Sai Sankar Gupta, K.B.; van Bekkum, H.; Gascon, J. and Kapteijn, F.

    2011-05-24

    A new post-functionalization method for metal-organic frameworks (MOFs) has been developed to introduce acidity for catalysis. Upon treatment with a mixture of triflic anhydride and sulfuric acid, chemically stable MOF structures MIL-101(Cr) and MIL-53(Al) can be sulfated, resulting in a Broensted sulfoxy acid group attached to up to 50% of the aromatic terephthalate linkers of the structure. The sulfated samples have been extensively characterized by solid-state NMR, XANES, and FTIR spectroscopy. The functionalized acidic frameworks show catalytic activity similar to that of acidic polymers like Nafion{reg_sign} display in the esterification of n-butanol with acetic acid (TOF {approx} 1 min{sup -1} {at} 343 K). Water adsorbs strongly up to 4 molecules per sulfoxy acid group, and an additional 2 molecules are taken up at lower temperatures in the 1-D pore channels of S-MIL-53(Al). The high water content and Broensted acidity provide the structure S-MIL-53(Al) a high proton conductivity up to moderate temperatures.

  2. Studies of Immobilized Homogeneous Metal Catalysts on Silica Supports

    SciTech Connect (OSTI)

    Keith James Stanger

    2003-05-31

    The tethered, chiral, chelating diphosphine rhodium complex, which catalyzes the enantioselective hydrogenation of methyl-{alpha}-acetamidocinnamate (MAC), has the illustrated structure as established by {sup 31}P NMR and IR studies. Spectral and catalytic investigations also suggest that the mechanism of action of the tethered complex is the same as that of the untethered complex in solution. The rhodium complexes, [Rh(COD)H]{sub 4}, [Rh(COD){sub 2}]{sup +}BF{sub 4}{sup -}, [Rh(COD)Cl]{sub 2}, and RhCl{sub 3} {center_dot} 3H{sub 2}O, adsorbed on SiO{sub 2} are optimally activated for toluene hydrogenation by pretreatment with H{sub 2} at 200 C. The same complexes on Pd-SiO{sub 2} are equally active without pretreatments. The active species in all cases is rhodium metal. The catalysts were characterized by XPS, TEM, DRIFTS, and mercury poisoning experiments. Rhodium on silica catalyzes the hydrogenation of fluorobenzene to produce predominantly fluorocyclohexane in heptane and 1,2-dichloroethane solvents. In heptane/methanol and heptane/water solvents, hydrodefluorination to benzene and subsequent hydrogenation to cyclohexane occurs exclusively. Benzene inhibits the hydrodefluorination of fluorobenzene. In DCE or heptane solvents, fluorocyclohexane reacts with hydrogen fluoride to form cyclohexene. Reaction conditions can be chosen to selectively yield fluorocyclohexane, cyclohexene, benzene, or cyclohexane. The oxorhenium(V) dithiolate catalyst [-S(CH{sub 2}){sub 3}s-]Re(O)(Me)(PPh{sub 3}) was modified by linking it to a tether that could be attached to a silica support. Spectroscopic investigation and catalytic oxidation reactivity showed the heterogenized catalyst's structure and reactivity to be similar to its homogeneous analog. However, the immobilized catalyst offered additional advantages of recyclability, extended stability, and increased resistance to deactivation.

  3. Method of Producing Ultra-heavy Homogeneous Aerosol of Sub-micron Particles

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

    Ernest J. Valeo and Nathaniel J. Fisch | Princeton Plasma Physics Lab Method of Producing Ultra-heavy Homogeneous Aerosol of Sub-micron Particles Ernest J. Valeo and Nathaniel J. Fisch This invention forms a heavy homogeneous aerosol by agitating sub-micron particles throughacoustic forces and then releasing the aerosol into a low-pressure reservoir. Through this method, the aerosol particulates comprise the dominant mass of the aerosol to produce plasma of the requisite homogeneity,

  4. Method of fabricating a homogeneous wire of inter-metallic alloy

    DOE Patents [OSTI]

    Ohriner, Evan Keith (Knoxville, TN); Blue, Craig Alan (Knoxville, TN)

    2001-01-01

    A method for fabricating a homogeneous wire of inter-metallic alloy comprising the steps of providing a base-metal wire bundle comprising a metal, an alloy or a combination thereof; working the wire bundle through at least one die to obtain a desired dimension and to form a precursor wire; and, controllably heating the precursor wire such that a portion of the wire will become liquid while simultaneously maintaining its desired shape, whereby substantial homogenization of the wire occurs in the liquid state and additional homogenization occurs in the solid state resulting in a homogenous alloy product.

  5. SU-E-T-76: Comparing Homogeneity Between Gafchromic Film EBT2 and EBT3

    Office of Scientific and Technical Information (OSTI)

    (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: SU-E-T-76: Comparing Homogeneity Between Gafchromic Film EBT2 and EBT3 Citation Details In-Document Search Title: SU-E-T-76: Comparing Homogeneity Between Gafchromic Film EBT2 and EBT3 Purpose: We found out that homogeneity of EBT2 was different among lot numbers in previous study. Variation in local homogeneity of EBT3 among several lot numbers has not been reported. In this study, we investigated film

  6. Preface: Special Topic on Interfacial and Confined Water

    SciTech Connect (OSTI)

    Molinero, Valeria; Kay, Bruce D.

    2014-11-14

    This Special Topic on the Chemical Physics of Interfacial and Confined Water contains a collection of original research papers that showcase recent theoretical and experimental advances in the field. These papers provide a timely discussion of fundamental aspects of interfacial and confined water that are important in both natural environments and engineered applications.

  7. Accelerators, Beams And Physical Review Special Topics - Accelerators And Beams

    SciTech Connect (OSTI)

    Siemann, R.H.; /SLAC

    2011-10-24

    Accelerator science and technology have evolved as accelerators became larger and important to a broad range of science. Physical Review Special Topics - Accelerators and Beams was established to serve the accelerator community as a timely, widely circulated, international journal covering the full breadth of accelerators and beams. The history of the journal and the innovations associated with it are reviewed.

  8. TEC Working Group Topic Groups Archives Route Identification Process |

    Office of Environmental Management (EM)

    Department of Energy Route Identification Process TEC Working Group Topic Groups Archives Route Identification Process Route Identification Process Items Available for Download PDF icon Routing Discussion Paper (April 1998) More Documents & Publications TEC Meeting Summaries - January 1997 TEC Meeting Summaries - July 1997 TEC Meeting Summaries - January 1998

  9. Tritium R&D at AECL Selected Topics

    Office of Environmental Management (EM)

    Tritium R&D at AECL Selected Topics Tritium Focus Group Meeting, Savannah River Site 2014 April 22-24 Hugh Boniface Chalk River Laboratories, Ontario, CANADA Outline of Presentation * Introduction & Background * Tritium Facilities: Laboratories, old and new * Tritium Separations: CECE process * Tritium Properties: Materials * Tritium Exploitation: Batteries, Helium-3 * Other work: Education, environment, biology, fusion, hydrogen UNRESTRICTED / ILLIMITÉ 2 Background UNRESTRICTED /

  10. Chemistry {ampersand} Materials Science progress report summary of selected research and development topics, FY97

    SciTech Connect (OSTI)

    Newkirk, L.

    1997-12-01

    This report contains summaries of research performed in the Chemistry and Materials Science division. Topics include Metals and Ceramics, High Explosives, Organic Synthesis, Instrument Development, and other topics.

  11. SBIR and STTR: Topics, FY 2015 Phase I Release 2 | Department...

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

    SBIR and STTR: Topics, FY 2015 Phase I Release 2 Small Business Innovation Research (SBIR) and Small Business Technology Transfer (STTR) Programs: Topics, FY 2015, Phase I, Release ...

  12. 2015 DOE SSL R&D Workshop LED Topic Table Questions to Consider

    Broader source: Energy.gov [DOE]

    This document was distributed during the LED Topic Table portion of the DOE SSL R&D Workshop and aimed to prompt discussion on the following topics:

  13. High Efficiency, Low Emissions Homogeneous Charge Compression Ignition (HCCI) Engines

    SciTech Connect (OSTI)

    2011-01-31

    This is the final report of the High Efficiency Clean Combustion (HECC) Research Program for the U.S. Department of Energy. Work under this co-funded program began in August 2005 and finished in July 2010. The objective of this program was to develop and demonstrate a low emission, high thermal efficiency engine system that met 2010 EPA heavy-duty on-highway truck emissions requirements (0.2g/bhp-hr NOx, 0.14g/bhp-hr HC and 0.01g/bhp-hr PM) with a thermal efficiency of 46%. To achieve this goal, development of diesel homogenous charge compression ignition (HCCI) combustion was the chosen approach. This report summarizes the development of diesel HCCI combustion and associated enabling technologies that occurred during the HECC program between August 2005 and July 2010. This program showed that although diesel HCCI with conventional US diesel fuel was not a feasible means to achieve the program objectives, the HCCI load range could be increased with a higher volatility, lower cetane number fuel, such as gasoline, if the combustion rate could be moderated to avoid excessive cylinder pressure rise rates. Given the potential efficiency and emissions benefits, continued research of combustion with low cetane number fuels and the effects of fuel distillation are recommended. The operation of diesel HCCI was only feasible at part-load due to a limited fuel injection window. A 4% fuel consumption benefit versus conventional, low-temperature combustion was realized over the achievable operating range. Several enabling technologies were developed under this program that also benefited non-HCCI combustion. The development of a 300MPa fuel injector enabled the development of extended lifted flame combustion. A design methodology for minimizing the heat transfer to jacket water, known as precision cooling, will benefit conventional combustion engines, as well as HCCI engines. An advanced combustion control system based on cylinder pressure measurements was developed. A Well-to-wheels analysis of the energy flows in a mobile vehicle system and a 2nd Law thermodynamic analysis of the engine system were also completed under this program.

  14. SBIR/STTR FY16 Phase 1 Release 1 Topics Announced—Includes Hydrogen Production and Fuel Cell Membrane Topics

    Broader source: Energy.gov [DOE]

    The U.S. Department of Energy has announced the 2016 Small Business Innovation Research and Small Business Technology Transfer (SBIR/STTR) Phase I Release 1 Topics, including hydrogen production from organic waste streams and fuel cell membranes, through the Office of Basic Energy Sciences.

  15. Damping of linear waves via ionization and recombination in homogeneous plasmas

    SciTech Connect (OSTI)

    Dodin, I. Y.; Fisch, N. J.

    2010-11-15

    An oscillation-center model is proposed that analytically describes transformation of an arbitrary homogeneous linear wave at gradual ionization and recombination in homogeneous plasma. For the case when either of the processes dominates, general adiabatic invariants are found, from which the wave energy is derived as a function of the frequency.

  16. Homogeneous, dual layer, solid state, thin film deposition for structural and/or electrochemical characteristics

    DOE Patents [OSTI]

    Pitts, J. Roland; Lee, Se-Hee; Tracy, C. Edwin; Li, Wenming

    2014-04-08

    Solid state, thin film, electrochemical devices (10) and methods of making the same are disclosed. An exemplary device 10 includes at least one electrode (14) and an electrolyte (16) deposited on the electrode (14). The electrolyte (16) includes at least two homogenous layers of discrete physical properties. The two homogenous layers comprise a first dense layer (15) and a second porous layer (16).

  17. Structures of trihydroxynaphthalene reductase-fungicide complexes: implications for structure-based design and catalysis

    SciTech Connect (OSTI)

    Liao, D.-I.; Basarab, G.S.; Gatenby, A.A.; Valent, B.; Jordan, D.B.

    2010-03-08

    Trihydroxynaphthalene reductase catalyzes two intermediate steps in the fungal melanin biosynthetic pathway. The enzyme, a typical short-chain dehydrogenase, is the biochemical target of three commercial fungicides. The fungicides bind preferentially to the NADPH form of the enzyme. Three X-ray structures of the Magnaporthe grisea enzyme complexed with NADPH and two commercial and one experimental fungicide were determined at 1.7 {angstrom} (pyroquilon), 2.0 {angstrom} (2,3-dihydro-4-nitro-1H-inden-1-one, 1), and 2.1 {angstrom} (phthalide) resolutions. The chemically distinct inhibitors occupy similar space within the enzyme's active site. The three inhibitors share hydrogen bonds with the side chain hydroxyls of Ser-164 and Tyr-178 via a carbonyl oxygen (pyroquilon and 1) or via a carbonyl oxygen and a ring oxygen (phthalide). Active site residues occupy similar positions among the three structures. A buried water molecule that is hydrogen bonded to the NZ nitrogen of Lys-182 in each of the three structures likely serves to stabilize the cationic form of the residue for participation in catalysis. The pro S hydrogen of NADPH (which is transferred as a hydride to the enzyme's naphthol substrates) is directed toward the carbonyl carbon of the inhibitors that mimic an intermediate along the reaction coordinate. Modeling tetrahydroxynaphthalene and trihydroxynaphthalene in the active site shows steric and electrostatic repulsion between the extra hydroxyl oxygen of the former substrate and the sulfur atom of Met-283 (the C-terminal residue), which accounts, in part, for the 4-fold greater substrate specificity for trihydroxynaphthalene over tetrahydroxynaphthalene.

  18. Preface: Special Topic on Advances in Density Functional Theory

    SciTech Connect (OSTI)

    Yang, Weitao

    2014-05-14

    This Special Topic Issue on the Advances in Density Functional Theory, published as a celebration of the fifty years of density functional theory, contains a retrospective article, a perspective article, and a collection of original research articles that showcase recent theoretical advances in the field. It provides a timely discussion reflecting a cross section of our understanding, and the theoretical and computational developments, which have significant implications in broad areas of sciences and engineering.

  19. Topic A Awardee: Western Electricity Coordinating Council | Department of

    Energy Savers [EERE]

    Energy Western Electricity Coordinating Council Topic A Awardee: Western Electricity Coordinating Council Regional Transmission Expansion Planning (RTEP) The America Recovery and Reinvestment Act (ARRA) directs the Department of Energy (DOE) to provide assistance for the development of interconnection-based transmission plans for the Eastern and Western Interconnections, and for ERCOT. WECC received notification from the U.S. Department of Energy (DOE) on December 18, 2009 that it has been

  20. Topic B Awardee: Eastern Interconnection States' Planning Council |

    Energy Savers [EERE]

    Department of Energy Eastern Interconnection States' Planning Council Topic B Awardee: Eastern Interconnection States' Planning Council The Eastern Interconnection States' Planning Council (EISPC) is an historic endeavor initially funded by an award from the United States Department of Energy (DOE) pursuant to a provision of the American Recovery and Reinvestment Act (ARRA). The goal is to create an unprecedented collaborative among the states in the Eastern Interconnection. Comprised of

  1. Focus Group Meeting (Topical Meeting) | Department of Energy

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

    Training Meeting Date: April 30, 2008 Documents Available for Download PDF icon Meeting Agenda PDF icon Meeting Summary PDF icon Meeting Participants PDF icon Executive Summary/Actions PDF icon Information Package - Part I PDF icon Information Package - Part II More Documents & Publications Focus Group Meeting (Topical Wrap-Up) Training Work Group Charter 2012 National Trainers' Exchange for Department of Energy Safety and Health Trainers

  2. Mat. Sci. Training More Advanced Topics Jack Deslippe

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

    Mat. Sci. Training More Advanced Topics Jack Deslippe Part 1: Building Applications at NERSC Jack Deslippe Applications Already Available Did you know that NERSC offers precompiled executables for more than 100 applications? Applications Already Available Did you know that NERSC offers precompiled executables for more than 100 applications? Example, Materials Science: VASP, NAMD, LAMMPS, NWCHEM, Quantum ESPRESSO, BerkeleyGW, SIESTA, Abinit, Gamess, GROMACS, GPAW MEEP, cpmd, libxc, etsf_io,

  3. Topic Group Reports  DOE Program Summaries

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

    Philadelphia 1999 Meeting  Topic Group Reports  DOE Program Summaries  Discussion of SNF Storage Initiatives & Transportations Issues  Discussion of WIPP Opening  Summary of Breakout Sessions The Transportation External Coordination (TEC) Working Group held its 15th semi-annual meeting July 14-15, 1999 in Philadelphia, Pennsylvania. Over 150 members, participants, and observers representing state, tribal, and local governments, regional groups, industry and professional

  4. Regulatory cross-cutting topics for fuel cycle facilities.

    SciTech Connect (OSTI)

    Denman, Matthew R.; Brown, Jason; Goldmann, Andrew Scott; Louie, David

    2013-10-01

    This report overviews crosscutting regulatory topics for nuclear fuel cycle facilities for use in the Fuel Cycle Research&Development Nuclear Fuel Cycle Evaluation and Screening study. In particular, the regulatory infrastructure and analysis capability is assessed for the following topical areas:Fire Regulations (i.e., how applicable are current Nuclear Regulatory Commission (NRC) and/or International Atomic Energy Agency (IAEA) fire regulations to advance fuel cycle facilities)Consequence Assessment (i.e., how applicable are current radionuclide transportation tools to support risk-informed regulations and Level 2 and/or 3 PRA) While not addressed in detail, the following regulatory topic is also discussed:Integrated Security, Safeguard and Safety Requirement (i.e., how applicable are current Nuclear Regulatory Commission (NRC) regulations to future fuel cycle facilities which will likely be required to balance the sometimes conflicting Material Accountability, Security, and Safety requirements.)

  5. Discussion series on PURPA related topics: load management

    SciTech Connect (OSTI)

    Sturgeon, J I

    1980-08-01

    The Discussion Series on PURPA Related Topics is composed of five volumes: Metering, Billing, Information to Customers, Load Management Techniques and Master Metering. These reports are based on twenty-five Demonstration and Implementation projects sponsored and directed during the past five years by the US Department of Energy, Office of Utility Systems. Each of the topics bears directly on one or more of the federal standards contained in the Public Utilities Regulatory Policies Act of 1978 (PURPA). This volume, Load Management Techniques, relates primarily to the Time-of-Day rates standard, PURPA IB(d)3. The experiences related in this report deal, in part, with the procedures and equipment which are affected when time-of-day rates are implemented. One goal of this report is to describe how people in a variety of settings have dealt with the many practical issues in load management. Another is to highlight the lessons and summarize the experiences of the Project participants. This report does not stand as a manual nor provide prescriptive guidelines on how to deal with the topic. Rather it offers an account for those charged with the responsibility of implementing PURPA requirements to learn from the insights and problems which occurred during the Rate Demonstration projects.

  6. Opportunities for Catalysis in The 21st Century. A report from the Basic Energy Sciences Advisory Committee

    SciTech Connect (OSTI)

    White, J. M.; Bercaw, J.

    2002-05-16

    Chemical catalysis affects our lives in myriad ways. Catalysis provides a means of changing the rates at which chemical bonds are formed and broken and of controlling the yields of chemical reactions to increase the amounts of desirable products from these reactions and reduce the amounts of undesirable ones. Thus, it lies at the heart of our quality of life: The reduced emissions of modern cars, the abundance of fresh food at our stores, and the new pharmaceuticals that improve our health are made possible by chemical reactions controlled by catalysts. Catalysis is also essential to a healthy economy: The petroleum, chemical, and pharmaceutical industries, contributors of $500 billion to the gross national product of the United States, rely on catalysts to produce everything from fuels to ''wonder drugs'' to paints to cosmetics. Today, our Nation faces a variety of challenges in creating alternative fuels, reducing harmful by-products in manufacturing, cleaning up the environment and preventing future pollution, dealing with the causes of global warming, protecting citizens from the release of toxic substances and infectious agents, and creating safe pharmaceuticals. Catalysts are needed to meet these challenges, but their complexity and diversity demand a revolution in the way catalysts are designed and used. This revolution can become reality through the application of new methods for synthesizing and characterizing molecular and material systems. Opportunities to understand and predict how catalysts work at the atomic scale and the nanoscale are now appearing, made possible by breakthroughs in the last decade in computation, measurement techniques, and imaging and by new developments in catalyst design, synthesis, and evaluation.

  7. 11th Topical conference high-temperature plasma diagnostics. Book of abstracts

    SciTech Connect (OSTI)

    1996-06-01

    This report contains abstracts from the 11th topical conference on high-temperature plasma diagnostics.

  8. Topic: Cesium Management and Disposition Alternatives for the Low Activity Waste Pre-Treatment

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

    Department of Energy Topic Index to the DOE Administrative Records Disposition Schedules Topic Index to the DOE Administrative Records Disposition Schedules Topic Index to the DOE Administrative Records Disposition Schedules PDF icon Topic Index to the DOE Administrative Records Disposition Schedules More Documents & Publications ADMINISTRATIVE RECORDS SCHEDULE 20: ELECTRONIC RECORDS ADMINISTRATIVE RECORDS SCHEDULE 20: ELECTRONIC RECORDS ADMINISTRATIVE RECORDS SCHEDULE 12: COMMUNICATIONS

  9. DOE-TSPP-11, Technical Standards Program Topical Committees- July 1, 2009

    Broader source: Energy.gov [DOE]

    This procedure describes how topical committees are organized and recognized under the Technical Standards Program.

  10. DOE-TSPP-9-2013, DOE Technical Standards Program Topical Committees

    Broader source: Energy.gov [DOE]

    This procedure describes how topical committees are organized and recognized under the Technical Standards Program (TSP).

  11. DOE-TSPP-11, Technical Standards Program Topical Committees- August 1, 2000

    Broader source: Energy.gov [DOE]

    This procedure describes how topical committees are organized and recognized under the Technical Standards Program.

  12. Contact: Paul Dauenhauer (hauer@umn.edu) UD's Catalysis Center for Energy Innovation Invents New Chemical Detector

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

    Information Contact (If you're a human, don't change the following field) Enter your name: 8c7f598568c7f Your first name. Please enable Javascript to use this form. Your name: * Your e-mail address: * Subject: * Category: * - Please choose - STIP Website Subscribe to the OSTI.gov Newsletter Message: * Send message

    immediate release Contact: Paul Dauenhauer (hauer@umn.edu) UD's Catalysis Center for Energy Innovation Invents New Chemical Detector (NEWARK, DE) January 12, 2015 -- A team of

  13. Support for Speakers and Attendees at 2008 GRC Conference Catalysis (to be held at Colby Sawyer College, New London, New Hampshire on June 22-27, 2008)

    SciTech Connect (OSTI)

    Stuart L. Soled and Nancy Ryan Gray

    2009-01-01

    The GRC on Catalysis is one of the most prestigious catalysis conferences as it brings together leading researchers from around the world to discuss their latest, most exciting work in catalysis. The 2008 conference will continue this tradition. The conference will cover a variety of themes including new catalytic materials, theoretical and experimental approaches to improve understanding of kinetics and transport phenomena, and state of the art nanoscale characterization probes to monitor active sites. The conference promotes interactions among established researchers and young scientists. It provides a venue for students to meet, talk to and learn from some of the world leading researchers in the area. It also gives them a platform for displaying their own work during the poster sessions. The informal nature of the meeting, excellent quality of the presentations and posters, and ability to meet many outstanding colleagues makes this an excellent conference.

  14. Recent advances in automotive catalysis for NOx emission control by small-pore microporous materials

    SciTech Connect (OSTI)

    Beale, Andrew M.; Gao, Feng; Lezcano-Gonzalez, Ines; Peden, Charles HF; Szanyi, Janos

    2015-10-05

    The ever increasing demand to develop highly fuel efficient engines coincides with the need to minimize air pollution originating from the exhaust gases of internal combustion engines. Dramatically improved fuel efficiency can be achieved at air-to-fuel ratios much higher than stoichiometric. In the presence of oxygen in large excess, however, traditional three-way catalysts are unable to reduce NOx. Among the number of lean-NOx reduction technologies, selective catalytic reduction (SCR) of NOx by NH3 over Cu- and Fe-ion exchanged zeolite catalysts has been extensively studied over the past 30+ years. Despite the significant advances in developing a viable practical zeolite-based catalyst for lean NOx reduction, the insufficient hydrothermal stabilities of the zeolite structures considered cast doubts about their real-world applicability. During the past decade a renewed interest in zeolite-based lean NOx reduction was spurred by the discovery of the very high activity of Cu-SSZ-13 (and the isostructural Cu-SAPO-34) in the NH3 SCR of NOx. These new, small-pore zeolite-based catalysts not only exhibited very high NOx conversion and N2 selectivity, but also exhibited exceptional high hydrothermal stability at high temperatures. In this review we summarize the key discoveries of the past ~5 years that lead to the introduction of these catalysts into practical application. The review first briefly discusses the structure and preparation of the CHA structure-based zeolite catalysts, and then summarizes the key learnings of the rather extensive (but not complete) characterisation work. Then we summarize the key findings of reaction kinetics studies, and provide some mechanistic details emerging from these investigations. At the end of the review we highlight some of the issues that are still need to be addressed in automotive exhaust control catalysis. Funding A.M.B. and I.L.G. would like to thank EPSRC for funding. F.G., C.H.F.P. and J.Sz. gratefully acknowledge financial support from the US Department of Energy (DOE), Office of Energy Efficiency and Renewable Energy, Vehicle Technologies Program.

  15. WTP Safety Culture Advice Joint Topic (HSEP/TWC)

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

    January 2012 v1 Page 1 of 2 Note: The views expressed in committee meetings should not be considered a substitute for full HAB consensus on any particular issue. WTP Safety Culture Advice Joint Topic (HSEP/TWC) Framing questions for discussion regarding DOE's recently released Implementation Plan: Re: Secretary Chu's response to the DNFSB with the Implementation Plan for Recommendation 2011-1 (December 27, 2011) Note: The ORP coordinator for the DOE Response to DNFSB 2011-1 is Steve Pfaff. o

  16. TRIBAL ISSUES TOPIC GROUP MEETING SUMMARY JACKSONVILLE, FL

    Office of Environmental Management (EM)

    JACKSONVILLE, FL JANUARY 20, 1999 Mr. Kevin Blackwell (USDOT/FRA) updated the group on the status of the DOT response to DOE's inquiry about the tribal right to inspect rail shipments. The response was in the final stages of review in the General Counsel's office and is expected by July 1999. The Group has added a representative from the NRC General Counsel's office, as a topic group member, to help keep abreast of developments in the NRC's upcoming draft rulemaking regarding tribes and advanced

  17. TRIBAL ISSUES TOPIC GROUP MEETING SUMMARY JULY 13, 1999 Crowne

    Office of Environmental Management (EM)

    JULY 13, 1999 Crowne Plaza Center City Hotel, Philadelphia, PA Kevin Blackwell (U.S. Department of Transportation/Federal Rail Administration) (DOT/FRA) presented an overview of the topic group's discussion. The status of the DOT/FRA's response to DOE's inquiry about the tribal right to inspect rail shipments is still an open issue. At the time of the July meeting, the response was in the final stages of review in the Secretary of Transportation's Legal Division. The response will be forwarded

  18. Organo-Lewis acid as cocatalyst for cationic homogenous metallocene Ziegler-Natta olefin polymerizations

    DOE Patents [OSTI]

    Marks, Tobin J.; Chen, You-Xian

    2000-01-01

    The synthesis of the organo-Lewis acid perfluorobiphenylborane (PBB) and the activation of metallocenes for the formation of a variety of highly active homogeneous Ziegler-Natta metallocene olefin polymerization, copolymerization and ring-opening polymerization catalysts is described.

  19. SU-E-T-76: Comparing Homogeneity Between Gafchromic Film EBT2...

    Office of Scientific and Technical Information (OSTI)

    SciTech Connect Search Results Journal Article: SU-E-T-76: Comparing Homogeneity Between Gafchromic Film EBT2 and EBT3 Citation Details In-Document Search Title: SU-E-T-76: ...

  20. A novel approach to make homogeneous protease-stable monovalent streptavidin

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

    Zhang, M.; Shao, J; Xiao, J.; Deng, W.; Yu, H.

    2015-06-11

    The interaction between the tetramer streptavidin and biotin is recognized as one of the strongest non-covalent associations. Owing to the tight and specific binding, the streptavidin-biotin system has been used widely for bimolecular labeling, purification, immobilization, and even for targeted delivery of therapeutics drugs. Here, we report a novel approach to make homogeneous monovalent tetramer streptavidin. The purified monovalent protein showed both thermal stability and protease stability. Unexpectedly, we found that two proteases, Proteinase K (PK) and Subtilisin (SU), can efficiently remove the His8-tag from the wild-type subunit without affecting the tetramer architecture of monovalent streptavidin, thus making it moremore » homogeneous. In addition, crystallization was performed to assure the homogeneity of the monovalent protein prepared. Overall, monovalent streptavidin shows increased homogeneity and will likely be valuable for many future applications in a wide range of research areas.« less

  1. Direct current dielectric barrier assistant discharge to get homogeneous plasma in capacitive coupled discharge

    SciTech Connect (OSTI)

    Du, Yinchang; Li, Yangfang; Cao, Jinxiang; Liu, Yu; Wang, Jian; Zheng, Zhe

    2014-06-15

    In this paper, we propose a method to get more homogeneous plasma in the geometrically asymmetric capacitive coupled plasma (CCP) discharge. The dielectric barrier discharge (DBD) is used for the auxiliary discharge system to improve the homogeneity of the geometrically asymmetric CCP discharge. The single Langmuir probe measurement shows that the DBD can increase the electron density in the low density volume, where the DBD electrodes are mounted, when the pressure is higher than 5?Pa. By this manner, we are able to improve the homogeneity of the plasma production and increase the overall density in the target volume. At last, the finite element simulation results show that the DC bias, applied to the DBD electrodes, can increase the homogeneity of the electron density in the CCP discharge. The simulation results show a good agreement with the experiment results.

  2. New Homogeneous Chromophore/Catalyst Concepts for the Solar-Driven

    Office of Scientific and Technical Information (OSTI)

    Reduction of Carbon Dioxide (Technical Report) | SciTech Connect New Homogeneous Chromophore/Catalyst Concepts for the Solar-Driven Reduction of Carbon Dioxide Citation Details In-Document Search Title: New Homogeneous Chromophore/Catalyst Concepts for the Solar-Driven Reduction of Carbon Dioxide One of the major scientific and technical challenges of this century is to develop chemical means to store solar energy in the form of fuels. This can be accomplished by developing light-absorbing

  3. Simultaneous dual mode combustion engine operating on spark ignition and homogenous charge compression ignition

    DOE Patents [OSTI]

    Fiveland, Scott B.; Wiggers, Timothy E.

    2004-06-22

    An engine particularly suited to single speed operation environments, such as stationary power generators. The engine includes a plurality of combustion cylinders operable under homogenous charge compression ignition, and at least one combustion cylinder operable on spark ignition concepts. The cylinder operable on spark ignition concepts can be convertible to operate under homogenous charge compression ignition. The engine is started using the cylinders operable under spark ignition concepts.

  4. Effects of H{sub 2}O, SO{sub 2}, and NO on homogeneous Hg oxidation...

    Office of Scientific and Technical Information (OSTI)

    Effects of Hsub 2O, SOsub 2, and NO on homogeneous Hg oxidation by Clsub 2 Citation Details In-Document Search Title: Effects of Hsub 2O, SOsub 2, and NO on homogeneous Hg ...

  5. FY16 SBIR Phase II Release 1 Awards Announced: Includes Hydrogen Contaminants Detection, Fuel Cell and Hydrogen Catalysis, and Alkaline Membrane Electrolysis

    Broader source: Energy.gov [DOE]

    The Energy Department has announced the 2016 Small Business Innovation Research and Small Business Technology Transfer (SBIR/STTR) Phase II Release 1 awards, including three projects focused on catalysis for fuel cell and hydrogen production as well as hydrogen contaminants detection.

  6. Additional EIPC Study Analysis: Interim Report on High Priority Topics

    SciTech Connect (OSTI)

    Hadley, Stanton W

    2013-11-01

    Between 2010 and 2012 the Eastern Interconnection Planning Collaborative (EIPC) conducted a major long-term resource and transmission study of the Eastern Interconnection (EI). With guidance from a Stakeholder Steering Committee (SSC) that included representatives from the Eastern Interconnection States Planning Council (EISPC) among others, the project was conducted in two phases. Phase 1 involved a long-term capacity expansion analysis that involved creation of eight major futures plus 72 sensitivities. Three scenarios were selected for more extensive transmission- focused evaluation in Phase 2. Five power flow analyses, nine production cost model runs (including six sensitivities), and three capital cost estimations were developed during this second phase. The results from Phase 1 and 2 provided a wealth of data that could be examined further to address energy-related questions. A list of 13 topics was developed for further analysis; this paper discusses the first five.

  7. TEC Working Group Topic Groups Manual Review Key Documents | Department of

    Energy Savers [EERE]

    Energy Manual Review Key Documents TEC Working Group Topic Groups Manual Review Key Documents Key Documents PDF icon Transportation Practices Manual (DOE M 460) - March 8, 2006 More Documents & Publications DOE Shipment Activities: What We Accomplished and a Look Forward TEC Working Group Topic Groups Section 180(c) Key Documents TEC Working Group Topic Groups Rail Key Documents

  8. Operando X-ray absorption and EPR evidence for a single electron redox process in copper catalysis

    SciTech Connect (OSTI)

    Lu, Qingquan; Zhang, Jian; Peng, Pan; Zhang, Guanghui; Huang, Zhiliang; Yi, Hong; Miller, Jeffrey T.; Lei, Aiwen

    2015-05-26

    An unprecedented single electron redox process in copper catalysis is confirmed using operando X-ray absorption and EPR spectroscopies. The oxidation state of the copper species in the interaction between Cu(II) and a sulfinic acid at room temperature, and the accurate characterization of the formed Cu(I) are clearly shown using operando X-ray absorption and EPR evidence. Further investigation of anion effects on Cu(II) discloses that bromine ions can dramatically increase the rate of the redox process. Moreover, it is proven that the sulfinic acids are converted into sulfonyl radicals, which can be trapped by 2-arylacrylic acids and various valuable β-keto sulfones are synthesized with good to excellent yields under mild conditions.

  9. Operando X-ray absorption and EPR evidence for a single electron redox process in copper catalysis

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

    Lu, Qingquan; Zhang, Jian; Peng, Pan; Zhang, Guanghui; Huang, Zhiliang; Yi, Hong; Miller, Jeffrey T.; Lei, Aiwen

    2015-05-26

    An unprecedented single electron redox process in copper catalysis is confirmed using operando X-ray absorption and EPR spectroscopies. The oxidation state of the copper species in the interaction between Cu(II) and a sulfinic acid at room temperature, and the accurate characterization of the formed Cu(I) are clearly shown using operando X-ray absorption and EPR evidence. Further investigation of anion effects on Cu(II) discloses that bromine ions can dramatically increase the rate of the redox process. Moreover, it is proven that the sulfinic acids are converted into sulfonyl radicals, which can be trapped by 2-arylacrylic acids and various valuable β-keto sulfonesmore » are synthesized with good to excellent yields under mild conditions.« less

  10. Crystal Structure of 12-Lipoxygenase Catalytic-Domain-Inhibitor Complex Identifies a Substrate-Binding Channel for Catalysis

    SciTech Connect (OSTI)

    Xu, Shu; Mueser, Timothy C.; Marnett, Lawrence J.; Funk, Jr., Max O.

    2014-10-02

    Lipoxygenases are critical enzymes in the biosynthesis of families of bioactive lipids including compounds with important roles in the initiation and resolution of inflammation and in associated diseases such as diabetes, cardiovascular disease, and cancer. Crystals diffracting to high resolution (1.9 {angstrom}) were obtained for a complex between the catalytic domain of leukocyte 12-lipoxygenase and the isoform-specific inhibitor, 4-(2-oxapentadeca-4-yne)phenylpropanoic acid (OPP). In the three-dimensional structure of the complex, the inhibitor occupied a new U-shaped channel open at one end to the surface of the protein and extending past the redox-active iron site that is essential for catalysis. In models, the channel accommodated arachidonic acid, defining the binding site for the substrate of the catalyzed reaction. There was a void adjacent to the OPP binding site connecting to the surface of the enzyme and providing a plausible access channel for the other substrate, oxygen.

  11. Organusulfur Catalysis With Reduced Molybdenum Sulfides Containing the Mo6S8 Cluster

    SciTech Connect (OSTI)

    Thomas Jay Paskach

    2002-08-27

    Industrial synthesis of sulfur-containing organic chemicals basically focuses on the broad categories of mercaptans (thiols), alkylsulfides (thioethers), polysulfides, and thiophenes. Of the organo-sulfur compounds produced, by far the most important in terms of quantities produced is methyl mercaptan (methanethiol or MeSH), which is produced mainly for the downstream production of methionine and methanesulfonyl chloride. Higher thiols are also used in the manufacture of rubber and plastics as polymerization regulators, chain transfer agents, or initiators. Other important organosulfur chemicals are dimethyl sulfide (DMS) and dimethyl disulfide (DMDS), both of which are used extensively for presulfiding of industrial hydroprocessing catalysts, and substituted thiophenes which are used as intermediates for production of agrochemicals, dyes, and pharmaceuticals. Thiols are produced commercially at the rate of about 10{sup 4} ton/yr from hydrogen sulfide (H{sub 2}S) and alcohols or olefins, using homogeneous free-radical synthesis, or heterogeneous catalysts based on solid acids or supported metal oxides and/or sulfides. Despite this large production rate, and the industrial importance of the organosulfur compounds, only limited research has been devoted to the development of new catalytic materials for their synthesis. Additionally, for most organosulfur catalytic reactions, only limited information exists about reaction mechanisms, active sites, adsorbed surface species, and especially the nature of the catalysts under reaction conditions.

  12. Point matching: A new electronic method for homogenizing the phase characteristics of giant magnetoimpedance sensors

    SciTech Connect (OSTI)

    Silva, E. Costa Gusmo, L. A. P.; Barbosa, C. R. Hall; Leipner, Y.; Fortaleza, L. G. S.; Monteiro, E. Costa

    2014-08-15

    Recently, our research group at PUC-Rio discovered that magnetic transducers based on the impedance phase characteristics of GMI sensors have the potential to multiply by one hundred the sensitivity values when compared to magnitude-based GMI transducers. Those GMI sensors can be employed in the measurement of ultra-weak magnetic fields, which intensities are even lower than the environmental magnetic noise. A traditional solution for cancelling the electromagnetic noise and interference makes use of gradiometric configurations, but the performance is strongly tied to the homogeneity of the sensing elements. This paper presents a new method that uses electronic circuits to modify the equivalent impedance of the GMI samples, aiming at homogenizing their phase characteristics and, consequently, improving the performance of gradiometric configurations based on GMI samples. It is also shown a performance comparison between this new method and another homogenization method previously developed.

  13. Homogenous charge compression ignition engine having a cylinder including a high compression space

    DOE Patents [OSTI]

    Agama, Jorge R.; Fiveland, Scott B.; Maloney, Ronald P.; Faletti, James J.; Clarke, John M.

    2003-12-30

    The present invention relates generally to the field of homogeneous charge compression engines. In these engines, fuel is injected upstream or directly into the cylinder when the power piston is relatively close to its bottom dead center position. The fuel mixes with air in the cylinder as the power piston advances to create a relatively lean homogeneous mixture that preferably ignites when the power piston is relatively close to the top dead center position. However, if the ignition event occurs either earlier or later than desired, lowered performance, engine misfire, or even engine damage, can result. Thus, the present invention divides the homogeneous charge between a controlled volume higher compression space and a lower compression space to better control the start of ignition.

  14. Error Assessment of Homogenized Cross Sections Generation for Whole Core Neutronic Calculation

    SciTech Connect (OSTI)

    Hursin, Mathieu; Kochunas, Brendan; Downar, Thomas J.

    2007-10-26

    The objective of the work here was to assess the errors introduced by using 2D, few group homogenized cross sections to perform neutronic analysis of BWR problems with significant axial heterogeneities. The 3D method of characteristics code DeCART is used to generate 2-group assembly homogenized cross sections first using a conventional 2D lattice model and then using a full 3D solution of the assembly. A single BWR fuel assembly model based on an advanced BWR lattice design is used with a typical void distribution applied to the fuel channel coolant. This model is validated against an MCNP model. A comparison of the cross sections is performed for the assembly homogenized planar cross sections from the DeCART 3D and DeCART 2D solutions.

  15. Enhancement of crystal homogeneity of protein crystals under application of an external alternating current electric field

    SciTech Connect (OSTI)

    Koizumi, H.; Uda, S.; Fujiwara, K.; Nozawa, J.; Tachibana, M.; Kojima, K.

    2014-10-06

    X-ray diffraction rocking-curve measurements were performed on tetragonal hen egg white (HEW) lysozyme crystals grown with and without the application of an external alternating current (AC) electric field. The crystal quality was assessed by the full width at half maximum (FWHM) value for each rocking curve. For two-dimensional maps of the FWHMs measured on the 440 and the 12 12 0 reflection, the crystal homogeneity was improved under application of an external electric field at 1 MHz, compared with that without. In particular, the significant improvement of the crystal homogeneity was observed for the 12 12 0 reflection.

  16. Two stroke homogenous charge compression ignition engine with pulsed air supplier

    DOE Patents [OSTI]

    Clarke, John M.

    2003-08-05

    A two stroke homogenous charge compression ignition engine includes a volume pulsed air supplier, such as a piston driven pump, for efficient scavenging. The usage of a homogenous charge tends to decrease emissions. The use of a volume pulsed air supplier in conjunction with conventional poppet type intake and exhaust valves results in a relatively efficient scavenging mode for the engine. The engine preferably includes features that permit valving event timing, air pulse event timing and injection event timing to be varied relative to engine crankshaft angle. The principle use of the invention lies in improving diesel engines.

  17. Determining whether metals nucleate homogeneously on graphite: A case study with copper

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

    Appy, David; Lei, Huaping; Han, Yong; Wang, Cai -Zhuang; Tringides, Michael C.; Shao, Dahai; Kwolek, Emma J.; Evans, J. W.; Thiel, P. A.

    2014-11-05

    In this study, we observe that Cu clusters grow on surface terraces of graphite as a result of physical vapor deposition in ultrahigh vacuum. We show that the observation is incompatible with a variety of models incorporating homogeneous nucleation and calculations of atomic-scale energetics. An alternative explanation, ion-mediated heterogeneous nucleation, is proposed and validated, both with theory and experiment. This serves as a case study in identifying when and whether the simple, common observation of metal clusters on carbon-rich surfaces can be interpreted in terms of homogeneous nucleation. We describe a general approach for making system-specific and laboratory-specific predictions.

  18. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    Filter Results Filter by Subject materials science (2) air conditioning (1) alloys (1) austenite (1) catalysis (homogeneous), catalysis (heterogeneous), solar (photovoltaic), solar ...

  19. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    Filter Results Filter by Subject absorption spectroscopy (1) aging (1) air (1) anisotropy (1) armor (1) catalysis (homogeneous), catalysis (heterogeneous), solar (photovoltaic), ...

  20. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    ... Filter Results Filter by Subject materials science (23) catalysis (homogeneous), catalysis (heterogeneous), solar (fuels), photosynthesis (natural and artificial), bio-inspired, ...

  1. Vehicle Technologies Office Issues Notice of Intent for Multi-Topic Funding

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

    Opportunity Announcement | Department of Energy Multi-Topic Funding Opportunity Announcement Vehicle Technologies Office Issues Notice of Intent for Multi-Topic Funding Opportunity Announcement April 26, 2016 - 10:16am Addthis The Vehicle Technologies Office has issued a Notice of Intent (No. DE-FOA-0001534) to make interested parties aware of its plan to issue a Funding Opportunity Announcement (FOA) entitled "FY 2016 Vehicle Technologies Multi-Topic Funding Opportunity

  2. Classification of Distributed Data Using Topic Modeling and Maximum Variation Sampling

    SciTech Connect (OSTI)

    Patton, Robert M; Beaver, Justin M; Potok, Thomas E

    2011-01-01

    From a management perspective, understanding the information that exists on a network and how it is distributed provides a critical advantage. This work explores the use of topic modeling as an approach to automatically determine the classes of information that exist on an organization's network, and then use the resultant topics as centroid vectors for the classification of individual documents in order to understand the distribution of information topics across the enterprise network. The approach is tested using the 20 Newsgroups dataset.

  3. Energy Department Announces Topics and New Approaches for Grants to Small

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

    Businesses in Clean Energy Technologies | Department of Energy Topics and New Approaches for Grants to Small Businesses in Clean Energy Technologies Energy Department Announces Topics and New Approaches for Grants to Small Businesses in Clean Energy Technologies October 31, 2013 - 1:10pm Addthis The Energy Department's Office of Energy Efficiency and Renewable Energy (EERE) today announced new topics under its Small Business Innovation Research (SBIR) and Technology Transfer (STTR) program

  4. TEC Working Group Topic Groups Archives Mechanics of Funding and Techical

    Office of Environmental Management (EM)

    Assistance | Department of Energy Mechanics of Funding and Techical Assistance TEC Working Group Topic Groups Archives Mechanics of Funding and Techical Assistance Mechanics of Funding and Techical Assistance Items Available for Download PDF icon Funding Mechanisms Comparison Matrix More Documents & Publications TEC Working Group Topic Groups Section 180(c) Key Documents Implementation of Section 180(c) of the Nuclear Waste Policy Act TEC Working Group Topic Groups Tribal Conference Call

  5. List of Topics for Interagency Performance & Risk Assessment Community of

    Energy Savers [EERE]

    Practice (P&RA CoP) Discussion | Department of Energy List of Topics for Interagency Performance & Risk Assessment Community of Practice (P&RA CoP) Discussion List of Topics for Interagency Performance & Risk Assessment Community of Practice (P&RA CoP) Discussion List of Topics for Interagency Performance & Risk Assessment Community of Practice (P&RA CoP) Discussion PDF icon List of Topics - February 24, 2016 More Documents & Publications Status Updates on the

  6. High-Potential Electrocatalytic O2 Reduction with Nitroxyl / NOx Mediators: Implications for Fuel Cells and Aerobic Oxidation Catalysis

    SciTech Connect (OSTI)

    Gerken, James B.; Stahl, Shannon S.

    2015-07-15

    Efficient reduction of O2 to water is a central challenge in energy conversion and aerobic oxidation catalysis. In the present study, we investigate the electrochemical reduction of O2 with soluble organic nitroxyl and nitrogen oxide (NOx) mediators. When used alone, neither organic nitroxyls, such as TEMPO (2,2,6,6-tetramethyl-1-piperidinyl-N-oxyl), nor NOx species, such as sodium nitrite, are effective mediators of electrochemical O2 reduction. The combination of nitroxyl/NOx species, however, mediates sustained O2 reduction at electrochemical potentials of 0.19–0.33 V (vs. Fc/Fc+) in acetonitrile containing trifluoroacetic acid. Mechanistic analysis of the coupled redox reactions supports a process in which the nitrogen oxide catalyst drives aerobic oxidation of a nitroxyl mediator to an oxoammonium species, which then is reduced back to the nitroxyl at the cathode. The electrolysis potential is dictated by the oxoammonium/nitroxyl reduction potential. The high potentials observed with this ORR system benefit from the mechanism-based specificity for four-electron reduction of oxygen to water mediated by NOx species, together with kinetically efficient reduction of oxidized NOx species by TEMPO and other organic nitroxyls. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center, funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences.

  7. MFT homogeneity study at TNX: Final report on the low weight percent solids concentration

    SciTech Connect (OSTI)

    Jenkins, W.J.

    1993-09-21

    A statistical design and analysis of both elemental analyses and weight percent solids analyses data was utilized to evaluate the MFT homogeneity at low heel levels and low agitator speed at both high and low solids feed concentrations. The homogeneity was also evaluated at both low and high agitator speed at the 6000+ gallons static level. The dynamic level portion of the test simulated feeding the Melter from the MFT to evaluate the uniformity of the solids slurry composition (Frit-PHA-Sludge) entering the melter from the MFT. This final report provides the results and conclusions from the second half of the study, the low weight percent solids concentration portion, as well as a comparison with the results from the first half of the study, the high weight percent solids portion.

  8. Impact of heterogeneous ice nuclei on homogeneous freezing events in cirrus clouds

    SciTech Connect (OSTI)

    Spichtinger, Peter; Cziczo, Daniel J.

    2010-07-29

    The influence of initial heterogeneous nucleation on subsequent homogeneous nucleation events in cirrus clouds is investigated using a box model which includes the explicit impact of aerosols on the nucleation of ice crystals and sedimentation. Different effects are discussed, namely the impact of external mixtures of heterogeneous ice nuclei and the influence of size-dependent freezing thresholds. Several idealized experiments are carried out, which show that the treatment of external mixtures of ice nuclei can strongly change later homogeneous nucleation events (i.e., the ice crystal number densities) in different matters. The use of size-dependent freezing thresholds can also change the cloud prop erties when compared to more simple parameterizations. This size effect is most important for large IN concentrations. Based upon these findings, recommendations for future modeling and measurement efforts are presented.

  9. Characterization of the homogeneous tissue mixture approximation in breast imaging dosimetry

    SciTech Connect (OSTI)

    Sechopoulos, Ioannis; Bliznakova, Kristina; Qin Xulei; Fei Baowei; Feng, Steve Si Jia

    2012-08-15

    Purpose: To compare the estimate of normalized glandular dose in mammography and breast CT imaging obtained using the actual glandular tissue distribution in the breast to that obtained using the homogeneous tissue mixture approximation. Methods: Twenty volumetric images of patient breasts were acquired with a dedicated breast CT prototype system and the voxels in the breast CT images were automatically classified into skin, adipose, and glandular tissue. The breasts in the classified images underwent simulated mechanical compression to mimic the conditions present during mammographic acquisition. The compressed thickness for each breast was set to that achieved during each patient's last screening cranio-caudal (CC) acquisition. The volumetric glandular density of each breast was computed using both the compressed and uncompressed classified images, and additional images were created in which all voxels representing adipose and glandular tissue were replaced by a homogeneous mixture of these two tissues in a proportion corresponding to each breast's volumetric glandular density. All four breast images (compressed and uncompressed; heterogeneous and homogeneous tissue) were input into Monte Carlo simulations to estimate the normalized glandular dose during mammography (compressed breasts) and dedicated breast CT (uncompressed breasts). For the mammography simulations the x-ray spectra used was that used during each patient's last screening CC acquisition. For the breast CT simulations, two x-ray spectra were used, corresponding to the x-ray spectra with the lowest and highest energies currently being used in dedicated breast CT prototype systems under clinical investigation. The resulting normalized glandular dose for the heterogeneous and homogeneous versions of each breast for each modality was compared. Results: For mammography, the normalized glandular dose based on the homogeneous tissue approximation was, on average, 27% higher than that estimated using the true heterogeneous glandular tissue distribution (Wilcoxon Signed Rank Test p= 0.00046). For dedicated breast CT, the overestimation of normalized glandular dose was, on average, 8% (49 kVp spectrum, p= 0.00045) and 4% (80 kVp spectrum, p= 0.000089). Only two cases in mammography and two cases in dedicated breast CT with a tube voltage of 49 kVp resulted in lower dose estimates for the homogeneous tissue approximation compared to the heterogeneous tissue distribution. Conclusions: The normalized glandular dose based on the homogeneous tissue mixture approximation results in a significant overestimation of dose to the imaged breast. This overestimation impacts the use of dose estimates in absolute terms, such as for risk estimates, and may impact some comparative studies, such as when modalities or techniques with different x-ray energies are used. The error introduced by the homogeneous tissue mixture approximation in higher energy x-ray modalities, such as dedicated breast CT, although statistically significant, may not be of clinical concern. Further work is required to better characterize this overestimation and potentially develop new metrics or correction factors to better estimate the true glandular dose to breasts undergoing imaging with ionizing radiation.

  10. Method for preparing homogeneous single crystal ternary III-V alloys

    DOE Patents [OSTI]

    Ciszek, Theodore F.

    1991-01-01

    A method for producing homogeneous, single-crystal III-V ternary alloys of high crystal perfection using a floating crucible system in which the outer crucible holds a ternary alloy of the composition desired to be produced in the crystal and an inner floating crucible having a narrow, melt-passing channel in its bottom wall holds a small quantity of melt of a pseudo-binary liquidus composition that would freeze into the desired crystal composition. The alloy of the floating crucilbe is maintained at a predetermined lower temperature than the alloy of the outer crucible, and a single crystal of the desired homogeneous alloy is pulled out of the floating crucible melt, as melt from the outer crucible flows into a bottom channel of the floating crucible at a rate that corresponds to the rate of growth of the crystal.

  11. Some mismatches occurred when simulating fractured reservoirs as homogeneous porous media

    SciTech Connect (OSTI)

    Mario Cesar Suarez Arriaga; Fernando Samaniego V.; Fernando Rodriguez

    1996-01-24

    The understanding of transport processes that occur in naturally fractured geothermal systems is far from being complete. Often, evaluation and numerical simulations of fractured geothermal reservoirs, are carried out by assuming equivalent porous media and homogeneous petrophysical properties within big matrix blocks. The purpose of this paper, is to present a comparison between results obtained from numerical studies of a naturally fractured reservoir treated as a simple porous medium and the simulation of some real aspects of the fractured reservoir. A general conclusion outlines the great practical importance of considering even approximately, the true nature of such systems. Our results show that the homogeneous simplified evaluation of the energy resource in a fractured system, could result in unrealistic estimates of the reservoir capacity to generate electricity.

  12. Closely spaced mirror pair for reshaping and homogenizing pump beams in laser amplifiers

    SciTech Connect (OSTI)

    Bass, I.L.

    1992-12-01

    Channeling a laser beam by multiple reflections between two closely-spaced, parallel or nearly parallel mirrors, serves to reshape and homogenize the beam at the output gap between the mirrors. Application of this device to improve the spatial overlap of a copper laser pump beam with the signal beam in a dye laser amplifier is described. This technique has been applied to the AVLIS program at the Lawrence Livermore National Laboratory.

  13. Homogeneous piecewise polynomial Lyapunov function for robust stability of uncertain piecewise linear system

    SciTech Connect (OSTI)

    BenAbdallah, Abdallah; Hammami, Mohamed Ali; Kallel, Jalel

    2009-03-05

    In this paper we present some sufficient conditions for the robust stability and stabilization of time invariant uncertain piecewise linear system using homogenous piecewise polynomial Lyapunov function. The proposed conditions are given in terms of linear matrix inequalities which can be numerically solved. An application of the obtained result is given. It consists in resolving the stabilization of piecewise uncertain linear control systems by using a state piecewise linear feedback.

  14. Beam Homogeneity Dependence on the Magnetic Filter Field at the IPP Test Facility MANITU

    SciTech Connect (OSTI)

    Franzen, P.; Fantz, U.

    2011-09-26

    The homogeneity of the extracted current density from the large RF driven negative hydrogen ion sources of the ITER neutral beam system is a critical issue for the transmission of the negative ion beam through the accelerator and the beamline components. As a first test, the beam homogeneity at the IPP long pulse test facility MANITU is measured by means of the divergence and the stripping profiles obtained with a spatially resolved Doppler-shift spectroscopy system. Since MANITU is typically operating below the optimum perveance, an increase in the divergence corresponds to a lower local extracted negative ion current density if the extraction voltage is constant. The beam H{sub {alpha}} Doppler-shift spectroscopy is a rather simple tool, as no absolute calibration - both for the wavelength and the emission - is necessary. Even no relative calibration of the different used lines of sight is necessary for divergence and stripping profiles as these quantities can be obtained by the line broadening of the Doppler-shifted peak and the ratio of the integral of the stripping peak to the integral of the Doppler-shifted peak, respectively. The paper describes the H{sub {alpha}} MANITU Doppler-shift spectroscopy system which is now operating routinely and the evaluation methods of the divergence and the stripping profiles. Beam homogeneity measurements are presented for different extraction areas and magnetic filter field configurations both for Hydrogen and Deuterium operation; the results are compared with homogeneity measurements of the source plasma. The stripping loss measurements are compared with model calculations.

  15. The performance of 3500 MWth homogeneous and heterogeneous metal fueled core designs

    SciTech Connect (OSTI)

    Turski, R.; Yang, Shi-tien

    1987-11-01

    Performance parameters are calculated for a representative 3500 MWth homogeneous and a heterogeneous metal fueled reactor design. The equilibrium cycle neutronic characteristics, safety coefficients, control system requirements, and control rod worths are evaluated. The thermal-hydraulic characteristics for both configurations are also compared. The heavy metal fuel loading requirements and neutronic performance characteristics are also evaluated for the uranium startup option. 14 refs., 14 figs., 20 tabs.

  16. Scalar and tensor spherical harmonics expansion of the velocity correlation in homogeneous anisotropic turbulence

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

    Rubinstein, Robert; Kurien, Susan; Cambon, Claude

    2015-06-22

    The representation theory of the rotation group is applied to construct a series expansion of the correlation tensor in homogeneous anisotropic turbulence. The resolution of angular dependence is the main analytical difficulty posed by anisotropic turbulence; representation theory parametrises this dependence by a tensor analogue of the standard spherical harmonics expansion of a scalar. As a result, the series expansion is formulated in terms of explicitly constructed tensor bases with scalar coefficients determined by angular moments of the correlation tensor.

  17. Non-homogeneous solutions of a Coulomb Schrdinger equation as basis set for scattering problems

    SciTech Connect (OSTI)

    Del Punta, J. A.; Ambrosio, M. J.; Gasaneo, G.; Zaytsev, S. A.; Ancarani, L. U.

    2014-05-15

    We introduce and study two-body Quasi Sturmian functions which are proposed as basis functions for applications in three-body scattering problems. They are solutions of a two-body non-homogeneous Schrdinger equation. We present different analytic expressions, including asymptotic behaviors, for the pure Coulomb potential with a driven term involving either Slater-type or Laguerre-type orbitals. The efficiency of Quasi Sturmian functions as basis set is numerically illustrated through a two-body scattering problem.

  18. Effect of high pressure homogenization on aqueous phase solvent extraction of lipids from Nannochloris Oculata microalgae

    SciTech Connect (OSTI)

    Samarasinghe, Nalin; Fernando, Sandun; Faulkner, William B.

    2012-12-01

    The ability to extract lipids from high-moisture Nannochloris Oculata algal biomass disrupted with high pressure homogenization was investigated. During the first phase, the effect of high pressure homogenization (system pressure and number of passes) on disrupting aqueous algae (of different concentrations and degree of stress) was investigated. Secondly, the effect of degree of cell wall disruption on the amount of lipids extracted with three solvents, namely: hexane, dichloromethane and chloroform, were compared. Studies reveled that high pressure homogenization is effective on cell disruption while the amount of system pressure being the most significant factor affecting the degree of cell breakage. Although the number of passes had some impact, the level of disruption seemed to level-off after a certain number of passes. The study revealed that slightly polar solvents (such as chloroform and dichloromethane) performed better in aqueous-phase lipid extractions as compared to hexane. Also, it was revealed that it was not necessary to disrupt the algal cells completely to achieve appreciable levels of lipid yields. In fact, conditions that exerted only 20% of the cells to completely disrupt, allowed sufficient damage to liberate most of the lipids contained in the remainder of the cells.

  19. Effect of high pressure homogenization on aqueous phase solvent extraction of lipids from Nannochloris Oculata microalgae

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

    Samarasinghe, Nalin; Fernando, Sandun; Faulkner, William B.

    2012-12-01

    The ability to extract lipids from high-moisture Nannochloris Oculata algal biomass disrupted with high pressure homogenization was investigated. During the first phase, the effect of high pressure homogenization (system pressure and number of passes) on disrupting aqueous algae (of different concentrations and degree of stress) was investigated. Secondly, the effect of degree of cell wall disruption on the amount of lipids extracted with three solvents, namely: hexane, dichloromethane and chloroform, were compared. Studies reveled that high pressure homogenization is effective on cell disruption while the amount of system pressure being the most significant factor affecting the degree of cell breakage.more » Although the number of passes had some impact, the level of disruption seemed to level-off after a certain number of passes. The study revealed that slightly polar solvents (such as chloroform and dichloromethane) performed better in aqueous-phase lipid extractions as compared to hexane. Also, it was revealed that it was not necessary to disrupt the algal cells completely to achieve appreciable levels of lipid yields. In fact, conditions that exerted only 20% of the cells to completely disrupt, allowed sufficient damage to liberate most of the lipids contained in the remainder of the cells.« less

  20. Superacid catalysis of light hydrocarbon conversion. DOE PETC third quarterly report, February 25, 1994--May 24, 1994

    SciTech Connect (OSTI)

    Gates, B.C.

    1995-12-31

    Environmental concerns are leading to the replacement of aromatic hydrocarbons in gasoline by high-octane-number branched paraffins and oxygenated compounds such as methyl t-butyl ether. The ether is produced from methanol and isobutylene, and the latter can be formed from n-butane by isomerization followed by dehydrogenation. Paraffin isomerization reactions are catalyzed by very strong acids such as aluminum chloride supported on alumina. The aluminum chloride-containing catalysts are corrosive, and their disposal is expensive. Alternatively, hydroisomerization is catalyzed by zeolite-supported metals at high temperatures, but high temperatures do not favor branched products at equilibrium. Thus there is a need for improved catalysts and processes for the isomerization of n-butane and other straight-chain paraffins. Consequently, researchers have sought for solid acids that are noncorrosive and active enough to catalyze isomerization of paraffins at low temperatures. For example, sulfated zirconia catalyzes isomerization of n-butane at temperatures as low as 25{degrees}C. The addition of iron and manganese promoters has been reported to increase the activity of sulfated zirconia for n-butane isomerization by three orders of magnitude. Although the high activity of this catalyst is now established, the reaction network is not known, and the mechanism has not been investigated. The goal of this work is to investigate low-temperature reactions of light paraffins catalyzed by solid superacids of the sulfated zirconia type. The present report is concerned with catalysis of n-butane conversion catalyzed by the Fe- and Mn- promoted sulfated zirconia described in the previous report in this series.

  1. Impact of homogeneous strain on uranium vacancy diffusion in uranium dioxide

    SciTech Connect (OSTI)

    Goyal, Anuj; Phillpot, Simon R.; Subramanian, Gopinath; Andersson, David A.; Stanek, Chris R.; Uberuaga, Blas P.

    2015-03-03

    We present a detailed mechanism of, and the effect of homogeneous strains on, the migration of uranium vacancies in UO2. Vacancy migration pathways and barriers are identified using density functional theory and the effect of uniform strain fields are accounted for using the dipole tensor approach. We report complex migration pathways and noncubic symmetry associated with the uranium vacancy in UO2 and show that these complexities need to be carefully accounted for to predict the correct diffusion behavior of uranium vacancies. We show that under homogeneous strain fields, only the dipole tensor of the saddle with respect to the minimum is required to correctly predict the change in the energy barrier between the strained and the unstrained case. Diffusivities are computed using kinetic Monte Carlo simulations for both neutral and fully charged state of uranium single and divacancies. We calculate the effect of strain on migration barriers in the temperature range 800–1800 K for both vacancy types. Homogeneous strains as small as 2% have a considerable effect on diffusivity of both single and divacancies of uranium, with the effect of strain being more pronounced for single vacancies than divacancies. In contrast, the response of a given defect to strain is less sensitive to changes in the charge state of the defect. Further, strain leads to anisotropies in the mobility of the vacancy and the degree of anisotropy is very sensitive to the nature of the applied strain field for strain of equal magnitude. Our results indicate that the influence of strain on vacancy diffusivity will be significantly greater when single vacancies dominate the defect structure, such as sintering, while the effects will be much less substantial under irradiation conditions where divacancies dominate.

  2. Impact of homogeneous strain on uranium vacancy diffusion in uranium dioxide

    SciTech Connect (OSTI)

    Goyal, Anuj; Phillpot, Simon R.; Subramanian, Gopinath; Andersson, David A.; Stanek, Chris R.; Uberuaga, Blas P.

    2015-03-03

    We present a detailed mechanism of, and the effect of homogeneous strains on, the migration of uranium vacancies in UO2. Vacancy migration pathways and barriers are identified using density functional theory and the effect of uniform strain fields are accounted for using the dipole tensor approach. We report complex migration pathways and noncubic symmetry associated with the uranium vacancy in UO2 and show that these complexities need to be carefully accounted for to predict the correct diffusion behavior of uranium vacancies. We show that under homogeneous strain fields, only the dipole tensor of the saddle with respect to the minimum is required to correctly predict the change in the energy barrier between the strained and the unstrained case. Diffusivities are computed using kinetic Monte Carlo simulations for both neutral and fully charged state of uranium single and divacancies. We calculate the effect of strain on migration barriers in the temperature range 8001800 K for both vacancy types. Homogeneous strains as small as 2% have a considerable effect on diffusivity of both single and divacancies of uranium, with the effect of strain being more pronounced for single vacancies than divacancies. In contrast, the response of a given defect to strain is less sensitive to changes in the charge state of the defect. Further, strain leads to anisotropies in the mobility of the vacancy and the degree of anisotropy is very sensitive to the nature of the applied strain field for strain of equal magnitude. Our results indicate that the influence of strain on vacancy diffusivity will be significantly greater when single vacancies dominate the defect structure, such as sintering, while the effects will be much less substantial under irradiation conditions where divacancies dominate.

  3. Impact of homogeneous strain on uranium vacancy diffusion in uranium dioxide

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

    Goyal, Anuj; Phillpot, Simon R.; Subramanian, Gopinath; Andersson, David A.; Stanek, Chris R.; Uberuaga, Blas P.

    2015-03-03

    We present a detailed mechanism of, and the effect of homogeneous strains on, the migration of uranium vacancies in UO2. Vacancy migration pathways and barriers are identified using density functional theory and the effect of uniform strain fields are accounted for using the dipole tensor approach. We report complex migration pathways and noncubic symmetry associated with the uranium vacancy in UO2 and show that these complexities need to be carefully accounted for to predict the correct diffusion behavior of uranium vacancies. We show that under homogeneous strain fields, only the dipole tensor of the saddle with respect to the minimummore » is required to correctly predict the change in the energy barrier between the strained and the unstrained case. Diffusivities are computed using kinetic Monte Carlo simulations for both neutral and fully charged state of uranium single and divacancies. We calculate the effect of strain on migration barriers in the temperature range 800–1800 K for both vacancy types. Homogeneous strains as small as 2% have a considerable effect on diffusivity of both single and divacancies of uranium, with the effect of strain being more pronounced for single vacancies than divacancies. In contrast, the response of a given defect to strain is less sensitive to changes in the charge state of the defect. Further, strain leads to anisotropies in the mobility of the vacancy and the degree of anisotropy is very sensitive to the nature of the applied strain field for strain of equal magnitude. Our results indicate that the influence of strain on vacancy diffusivity will be significantly greater when single vacancies dominate the defect structure, such as sintering, while the effects will be much less substantial under irradiation conditions where divacancies dominate.« less

  4. High-throughput method for optimum solubility screening for homogeneity and crystallization of proteins

    DOE Patents [OSTI]

    Kim, Sung-Hou; Kim, Rosalind; Jancarik, Jamila

    2012-01-31

    An optimum solubility screen in which a panel of buffers and many additives are provided in order to obtain the most homogeneous and monodisperse protein condition for protein crystallization. The present methods are useful for proteins that aggregate and cannot be concentrated prior to setting up crystallization screens. A high-throughput method using the hanging-drop method and vapor diffusion equilibrium and a panel of twenty-four buffers is further provided. Using the present methods, 14 poorly behaving proteins have been screened, resulting in 11 of the proteins having highly improved dynamic light scattering results allowing concentration of the proteins, and 9 were crystallized.

  5. Homogeneous versus spiral phases of hole-doped antiferromagnets: A systematic effective field theory investigation

    SciTech Connect (OSTI)

    Bruegger, C.; Kaempfer, F.; Wiese, U.-J.; Hofmann, C. P.; Pepe, M.

    2007-01-01

    Using the low-energy effective field theory for magnons and holes--the condensed matter analog of baryon chiral perturbation theory for pions and nucleons in QCD--we study different phases of doped antiferromagnets. We systematically investigate configurations of the staggered magnetization that provide a constant background field for doped holes. The most general configuration of this type is either constant itself or represents a spiral in the staggered magnetization. Depending on the values of the low-energy parameters, a homogeneous phase, a spiral phase, or an inhomogeneous phase is energetically favored. The reduction of the staggered magnetization upon doping is also investigated.

  6. Method of producing homogeneous mixed metal oxides and metal-metal oxide mixtures

    DOE Patents [OSTI]

    Quinby, Thomas C.

    1978-01-01

    Metal powders, metal oxide powders, and mixtures thereof of controlled particle size are provided by reacting an aqueous solution containing dissolved metal values with excess urea. Upon heating, urea reacts with water from the solution leaving a molten urea solution containing the metal values. The molten urea solution is heated to above about 180.degree. C. whereupon metal values precipitate homogeneously as a powder. The powder is reduced to metal or calcined to form oxide particles. One or more metal oxides in a mixture can be selectively reduced to produce metal particles or a mixture of metal and metal oxide particles.

  7. Conceptual design of a new homogeneous reactor for medical radioisotope Mo-99/Tc-99m production

    SciTech Connect (OSTI)

    Liem, Peng Hong [Nippon Advanced Information Service (NAIS Co., Inc.) Scientific Computational Division, 416 Muramatsu, Tokaimura, Ibaraki (Japan); Tran, Hoai Nam [Chalmers University of Technology, Dept. of Applied Physics, Div. of Nuclear Engineering, SE-412 96 Gothenburg (Sweden); Sembiring, Tagor Malem [National Nuclear Energy Agency (BATAN), Center for Reactor Technology and Nuclear Safety, Kawasan Puspiptek, Serpong, Tangerang Selatan, Banten (Indonesia); Arbie, Bakri [PT MOTAB Technology, Kedoya Elok Plaza Blok DA 12, Jl. Panjang, Kebun Jeruk, Jakarta Barat (Indonesia)

    2014-09-30

    To partly solve the global and regional shortages of Mo-99 supply, a conceptual design of a nitrate-fuel-solution based homogeneous reactor dedicated for Mo-99/Tc-99m medical radioisotope production is proposed. The modified LEU Cintichem process for Mo-99 extraction which has been licensed and demonstrated commercially for decades by BATAN is taken into account as a key design consideration. The design characteristics and main parameters are identified and the advantageous aspects are shown by comparing with the BATAN's existing Mo-99 supply chain which uses a heterogeneous reactor (RSG GAS multipurpose reactor)

  8. Fuel mixture stratification as a method for improving homogeneous charge compression ignition engine operation

    DOE Patents [OSTI]

    Dec, John E.; Sjoberg, Carl-Magnus G.

    2006-10-31

    A method for slowing the heat-release rate in homogeneous charge compression ignition ("HCCI") engines that allows operation without excessive knock at higher engine loads than are possible with conventional HCCI. This method comprises injecting a fuel charge in a manner that creates a stratified fuel charge in the engine cylinder to provide a range of fuel concentrations in the in-cylinder gases (typically with enough oxygen for complete combustion) using a fuel with two-stage ignition fuel having appropriate cool-flame chemistry so that regions of different fuel concentrations autoignite sequentially.

  9. Cohesive Modeling of Dynamic Crack Growth in Homogeneous and Functionally Graded Materials

    SciTech Connect (OSTI)

    Zhang Zhengyu; Paulino, Glaucio H.; Celes, Waldemar

    2008-02-15

    This paper presents a Cohesive Zone Model (CZM) approach for investigating dynamic crack propagation in homogeneous and Functionally Graded Materials (FGMs). The failure criterion is incorporated in the CZM using both a finite cohesive strength and work to fracture in the material description. A novel CZM for FGMs is explored and incorporated into a finite element framework. The material gradation is approximated at the element level using a graded element formulation. A numerical example is provided to demonstrate the efficacy of the CZM approach, in which the influence of the material gradation on the crack growth pattern is studied.

  10. Bioinspired design of redox-active ligands for multielectron catalysis: Effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water

    SciTech Connect (OSTI)

    Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J.

    2015-06-09

    Mononuclear metalloenzymes in nature can function in cooperation with precisely positioned redox-active organic cofactors in order to carry out multielectron catalysis. Inspired by the finely tuned redox management of these bioinorganic systems, we present the design, synthesis, and experimental and theoretical characterization of a homologous series of cobalt complexes bearing redox-active pyrazines. These donor moieties are locked into key positions within a pentadentate ligand scaffold in order to evaluate the effects of positioning redox non-innocent ligands on hydrogen evolution catalysis. Both metal- and ligand-centered redox features are observed in organic as well as aqueous solutions over a range of pH values, and comparison with analogs bearing redox-inactive zinc(II) allows for assignments of ligand-based redox events. Varying the geometric placement of redox non-innocent pyrazine donors on isostructural pentadentate ligand platforms results in marked effects on observed cobalt-catalyzed proton reduction activity. Electrocatalytic hydrogen evolution from weak acids in acetonitrile solution, under diffusion-limited conditions, reveals that the pyrazine donor of axial isomer 1-Co behaves as an unproductive electron sink, resulting in high overpotentials for proton reduction, whereas the equatorial pyrazine isomer complex 2-Co is significantly more active for hydrogen generation at lower voltages. Addition of a second equatorial pyrazine in complex 3-Co further minimizes overpotentials required for catalysis. The equatorial derivative 2-Co is also superior to its axial 1-Co congener for electrocatalytic and visible-light photocatalytic hydrogen generation in biologically relevant, neutral pH aqueous media. Density functional theory calculations (B3LYP-D2) indicate that the first reduction of catalyst isomers 1-Co, 2-Co, and 3-Co is largely metal-centered while the second reduction occurs at pyrazine. Taken together, the data establish that proper positioning of non-innocent pyrazine ligands on a single cobalt center is indeed critical for promoting efficient hydrogen catalysis in aqueous media, akin to optimally positioned redox-active cofactors in metalloenzymes. In a broader sense, these findings highlight the significance of electronic structure considerations in the design of effective electron–hole reservoirs for multielectron transformations.

  11. Bioinspired design of redox-active ligands for multielectron catalysis: Effects of positioning pyrazine reservoirs on cobalt for electro- and photocatalytic generation of hydrogen from water

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

    Jurss, Jonah W.; Khnayzer, Rony S.; Panetier, Julien A.; El Roz, Karim A.; Nichols, Eva M.; Head-Gordon, Martin; Long, Jeffrey R.; Castellano, Felix N.; Chang, Christopher J.

    2015-06-09

    Mononuclear metalloenzymes in nature can function in cooperation with precisely positioned redox-active organic cofactors in order to carry out multielectron catalysis. Inspired by the finely tuned redox management of these bioinorganic systems, we present the design, synthesis, and experimental and theoretical characterization of a homologous series of cobalt complexes bearing redox-active pyrazines. These donor moieties are locked into key positions within a pentadentate ligand scaffold in order to evaluate the effects of positioning redox non-innocent ligands on hydrogen evolution catalysis. Both metal- and ligand-centered redox features are observed in organic as well as aqueous solutions over a range of pHmore » values, and comparison with analogs bearing redox-inactive zinc(II) allows for assignments of ligand-based redox events. Varying the geometric placement of redox non-innocent pyrazine donors on isostructural pentadentate ligand platforms results in marked effects on observed cobalt-catalyzed proton reduction activity. Electrocatalytic hydrogen evolution from weak acids in acetonitrile solution, under diffusion-limited conditions, reveals that the pyrazine donor of axial isomer 1-Co behaves as an unproductive electron sink, resulting in high overpotentials for proton reduction, whereas the equatorial pyrazine isomer complex 2-Co is significantly more active for hydrogen generation at lower voltages. Addition of a second equatorial pyrazine in complex 3-Co further minimizes overpotentials required for catalysis. The equatorial derivative 2-Co is also superior to its axial 1-Co congener for electrocatalytic and visible-light photocatalytic hydrogen generation in biologically relevant, neutral pH aqueous media. Density functional theory calculations (B3LYP-D2) indicate that the first reduction of catalyst isomers 1-Co, 2-Co, and 3-Co is largely metal-centered while the second reduction occurs at pyrazine. Taken together, the data establish that proper positioning of non-innocent pyrazine ligands on a single cobalt center is indeed critical for promoting efficient hydrogen catalysis in aqueous media, akin to optimally positioned redox-active cofactors in metalloenzymes. In a broader sense, these findings highlight the significance of electronic structure considerations in the design of effective electron–hole reservoirs for multielectron transformations.« less

  12. SBIR/STTR Phase I Release 2 Technical Topics Announced for FY14...

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

    Addthis On October 31, the U.S. Department of Energy announced the Fiscal Year 2014 Small ... These topics include prototype fuel cell-battery electric hybrid trucks for waste ...

  13. AMO Issues Request for Information on Clean Energy Manufacturing Topics, Including Fuel Cell and Hydrogen Applications

    Broader source: Energy.gov [DOE]

    The AMO seeks information on mid-Technology Readiness Level R&D needs, market challenges, supply chain challenges, and shared facility needs addressing clean energy manufacturing topics, including the fuel cell and hydrogen sectors.

  14. Groundwater Strategy Document Is Topic of Discussion at November Advisory Board Meeting

    Broader source: Energy.gov [DOE]

    A strategy document developed to address problems with contaminated groundwater on the Department of Energys (DOE) Oak Ridge Reservation (ORR) will be the primary topic of discussion during the November 13 meeting.

  15. Research on Estrogen and Behavior Is a 'Hot Topic' at the 2011 Society for Neuroscience Meeting

    ScienceCinema (OSTI)

    Anat Biegon

    2013-07-19

    The Society for Neuroscience has selected recent research on estrogen and its effect on behavior conducted at BNL for its "hot topics" book distributed to reporters attending the society's 2011 meeting in Washington, D.C., November 12-16.

  16. Memristive behavior and forming mechanism of homogeneous TiO{sub x} device

    SciTech Connect (OSTI)

    Dong, Ruixin; Yan, Xunling; Zhang, Zhang; Wang, Minghong

    2015-01-15

    Highlights: • We fabricated a homogeneity TiO{sub x} device with excellent memristive behavior. • The double-interface conductive filament model is suggested. • The calculated I–V curve is in agreement with the experimental results. • The switching voltage could be adjusted by selecting the proper electrode materials. - Abstract: A homogeneous titanium oxide device is fabricated by Molecular Beam Epitaxy and the excellent memristive behavior could be observed. The resistance ratio between high resistance state and low resistance state increases as the thickness of titanium oxide or the oxygen content reduces. The forming voltage is lower than the previous report. Based on the experimental results, we suggest a double-interface conductive filament model and calculate the current–voltage curve of the device in agreement with experimental measurements. The result indicates that the forming voltage of the device will rise with increasing of the chemical potential differences across the two interfaces. In other words, the switching voltage could be adjusted by selecting a proper electrode and oxide materials.

  17. An Experimental Investigation of Foam Flow in Homogeneous and Heterogeneous Porous Media, SUPRI TR-112

    SciTech Connect (OSTI)

    Apaydin, Osman G.; Bertin, Henri; Castanier, Louis M.; Kovscek, Anthony R.

    1999-08-09

    Foam is used to reduce the high mobility of gas-drive fluids and improve the contact between oil and these injected fluids. We require a better understanding of the effect of surfactant concentration on foam flow in porous media. Besides this, the literature on foam flow and transport in heterogeneous systems is sparse although the field situation is primarily heterogeneous and multidimensional. In this study, foam flow experiments were conducted first in homogeneous sand packs to investigate the effect of surfactant concentration on foam flow and then a heterogeneous experimental setup was prepared to observe heterogeneity and multidimensional flow effects on foam propagation. The homogeneous core experiments were conducted in a cylindrical aluminum core holder that was packed with a uniform Ottawa sand. Sand permeability is about 7.0 Darcy. The experiments were interpreted in terms of evolution of in-situ water saturation as a function of time by the usage of CT scanner, cumulative water, and pressure drop across the core. At very low surfactant concentration, no significant benefit was observed. But when stable foam generation started sweep efficiency (water recovery), breakthrough time, and pressure drop increased as surfactant concentration increased.

  18. Development of a HEX-Z Partially Homogenized Benchmark Model for the FFTF Isothermal Physics Measurements

    SciTech Connect (OSTI)

    John D. Bess

    2012-05-01

    A series of isothermal physics measurements were performed as part of an acceptance testing program for the Fast Flux Test Facility (FFTF). A HEX-Z partially-homogenized benchmark model of the FFTF fully-loaded core configuration was developed for evaluation of these measurements. Evaluated measurements include the critical eigenvalue of the fully-loaded core, two neutron spectra, 32 reactivity effects measurements, an isothermal temperature coefficient, and low-energy gamma and electron spectra. Dominant uncertainties in the critical configuration include the placement of radial shielding around the core, reactor core assembly pitch, composition of the stainless steel components, plutonium content in the fuel pellets, and boron content in the absorber pellets. Calculations of criticality, reactivity effects measurements, and the isothermal temperature coefficient using MCNP5 and ENDF/B-VII.0 cross sections with the benchmark model are in good agreement with the benchmark experiment measurements. There is only some correlation between calculated and measured spectral measurements; homogenization of many of the core components may have impacted computational assessment of these measurements. This benchmark evaluation has been added to the IRPhEP Handbook.

  19. Process for forming a homogeneous oxide solid phase of catalytically active material

    DOE Patents [OSTI]

    Perry, Dale L.; Russo, Richard E.; Mao, Xianglei

    1995-01-01

    A process is disclosed for forming a homogeneous oxide solid phase reaction product of catalytically active material comprising one or more alkali metals, one or more alkaline earth metals, and one or more Group VIII transition metals. The process comprises reacting together one or more alkali metal oxides and/or salts, one or more alkaline earth metal oxides and/or salts, one or more Group VIII transition metal oxides and/or salts, capable of forming a catalytically active reaction product, in the optional presence of an additional source of oxygen, using a laser beam to ablate from a target such metal compound reactants in the form of a vapor in a deposition chamber, resulting in the deposition, on a heated substrate in the chamber, of the desired oxide phase reaction product. The resulting product may be formed in variable, but reproducible, stoichiometric ratios. The homogeneous oxide solid phase product is useful as a catalyst, and can be produced in many physical forms, including thin films, particulate forms, coatings on catalyst support structures, and coatings on structures used in reaction apparatus in which the reaction product of the invention will serve as a catalyst.

  20. Topics: Discovering the lower limit to magnetic transport - MST - UW Plasma

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

    Physics Discovering the lower limit to magnetic transport UW Madison Madison Symmetric Torus Topics: Discovering the lower limit to magnetic transport MST HomeGraduate Student InformationLinksTourControl and Auxiliary SystemsPhysics TopicsDeviceResearch MissionMST People mst logo CPLA Home Directory Publications Links Internal University of Wisconsin Physics Department Research funding includes support from: Department of Energy National Science Foundation Energy transport in conventional

  1. Topics: Uncovering the physics of magnetic self-organization and links to

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

    astrophysics - MST - UW Plasma Physics Uncovering the physics of magnetic self-organization and links to astrophysics UW Madison Madison Symmetric Torus Topics: Uncovering the physics of magnetic self-organization and links to astrophysics MST HomeGraduate Student InformationLinksTourControl and Auxiliary SystemsPhysics TopicsDeviceResearch MissionMST People mst logo CPLA Home Directory Publications Links Internal University of Wisconsin Physics Department Research funding includes support

  2. Final Report (2010-2015) for the Topical Collaboration on Quantitative Jet

    Office of Scientific and Technical Information (OSTI)

    and Electromagnetic Tomography (JET) of Extreme Phases of Matter in Heavy-ion Collisions (Technical Report) | SciTech Connect Technical Report: Final Report (2010-2015) for the Topical Collaboration on Quantitative Jet and Electromagnetic Tomography (JET) of Extreme Phases of Matter in Heavy-ion Collisions Citation Details In-Document Search Title: Final Report (2010-2015) for the Topical Collaboration on Quantitative Jet and Electromagnetic Tomography (JET) of Extreme Phases of Matter in

  3. JLab announces two Spring Science Series events - topics include 'scale of

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

    universe' and 'how things work' | Jefferson Lab announces two Spring Science Series events - topics include 'scale of universe' and 'how things work' Jefferson Lab announces two Spring Science Series events - topics include 'scale of universe' and 'how things work' January 19, 2006 Jefferson Lab's 2006 Spring Science Series kicks off at 7 p.m. on Tuesday, Feb. 21, in the CEBAF Center auditorium with astronomer, teacher and author Jeffrey Bennett from the University of Colorado (Boulder)

  4. Preface: Thin Solid Films Topical Special Issue on ZnO Related Transparent

    Office of Scientific and Technical Information (OSTI)

    Conductive Oxides (Journal Article) | SciTech Connect SciTech Connect Search Results Journal Article: Preface: Thin Solid Films Topical Special Issue on ZnO Related Transparent Conductive Oxides Citation Details In-Document Search Title: Preface: Thin Solid Films Topical Special Issue on ZnO Related Transparent Conductive Oxides World-wide research activities on ZnO and related transparent conductive oxides (TCO) in thin film, nanostructured, and multilayered forms are driven by the vast

  5. 19th Topical Conference on Radio Frequency Power in Plasmas | Princeton

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

    Plasma Physics Lab June 1, 2011, 9:00am to June 3, 2011, 5:00pm Conference Newport, Rhode Island 19th Topical Conference on Radio Frequency Power in Plasmas Target audience Fusion scientists and engineers, plasma physicists, RF engineers, theoretical physicists and specialists of plasma-wave interaction, students. Topics of the conference Wave interaction with plasmas, such as heating, current generation, diagnostics, and confinement and profile control. RF applications in fusion devices,

  6. TEC Working Group Topic Groups Tribal Key Documents | Department of Energy

    Office of Environmental Management (EM)

    Key Documents TEC Working Group Topic Groups Tribal Key Documents Key Documents PDF icon Tribal Discussions on Grant Program PDF icon Native American Map PDF icon Task Plan 1 - Tribal Topic Group (Rev. 07-12-00) PDF icon May 1, 2000 Department of Transportation, Federal Railroad Administration Memorandum PDF icon NRC Advanced Notice of Proposed Rulemaking PDF icon DOE Final Indian Policy PDF icon Department of Transportation (DOT) Tribal Policy Order More Documents & Publications TEC Working

  7. Microsoft Word - Tribal Topic Group Summary March 06 final _3_.doc

    Office of Environmental Management (EM)

    Formatted: Position: Horizontal: Right, Relative to: Margin, Vertical: 0", Relative to: Paragraph, Wrap Around Summary TEC Tribal Topic Group Meeting Tuesday, March 14, 2006 Washington, DC Participants: Jay Jones, Department of Energy (DOE)/Office of Civilian Radioactive Waste Management (OCRWM), chaired the session. Other Topic Group members included Richard Arnold (Pahrump Paiute Tribe/Consolidated Group of Tribes and Organizations), James Baranski (NY State Emergency Management Office),

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

    SciTech Connect (OSTI)

    Not Available

    1992-04-01

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

  9. DESIGN, SYNTHESIS, AND MECHANISTIC EVALUATION OF IRON-BASED CATALYSIS FOR SYNTHESIS GAS CONVERSION TO FUELS AND CHEMICALS

    SciTech Connect (OSTI)

    Akio Ishikawa; Manuel Ojeda; Enrique Iglesia

    2005-03-31

    This project explores the extension of previously discovered Fe-based catalysts to hydrogen-poor synthesis gas streams derived from coal and biomass sources. These catalysts have previously shown unprecedented Fischer-Tropsch synthesis rate, selectivity with synthesis gas derived from methane. During the first reporting period, we certified a microreactor, installed required analytical equipment, and reproduced synthetic protocols and catalytic performance previously reported. During the second reporting period, we prepared several Fe-based compositions for Fischer-Tropsch synthesis and tested the effects of product recycle under both subcritical and supercritical conditions. During this third reporting period, we have prepared a large number of Fe-based catalyst compositions using precipitation and impregnations methods with both supercritical and subcritical drying and with the systematic use of surface active agents to prevent pore collapse during drying steps required in synthetic protocols. These samples were characterized during this period using X-ray diffraction, surface area, and temperature-programmed reduction measurements. These studies have shown that these synthesis methods lead to even higher surface areas than in our previous studies and confirm the crystalline structures of these materials and their reactivity in both oxide-carbide interconversions and in Fischer-Tropsch synthesis catalysis. Fischer-Tropsch synthesis reaction rates and selectivities with low H{sub 2}/CO ratio feeds (H{sub 2}/CO = 1) were the highest reported in the literature at the low-temperature and relatively low pressure in our measurements. Current studies are exploring the optimization of the sequence of impregnation of Cu, K, and Ru promoters, of the activation and reaction conditions, and of the co-addition of light hydrocarbons to increase diffusion rates of primary olefin products so as to increase the selectivity to unsaturated products. Finally, we are also addressing the detailed kinetic response of optimized catalysts to reaction conditions (temperature, partial pressures of H{sub 2}, CO, H{sub 2}O, CO{sub 2}, olefins) in an effort to further increase rates and olefin and C{sub 5+} selectivities.

  10. Superacid catalysis of light hydrocarbon conversion. DOE PETC seventh quarterly progress report, April 1, 1995--July 31, 1995

    SciTech Connect (OSTI)

    Gates, B.C.

    1996-02-01

    Iron- and manganese-promoted sulfated zirconia is a catalyst for the conversion of propane, but the rate of conversion of propane is much less than the rate of conversion of butane. Whereas this catalyst appears to be a good candidate for practical, industrial conversion of butane, it appears to lack sufficient activity for practical conversion of propane. The propane conversion data reported here provide excellent insights into the chemistry of the catalytic conversion. Solid and catalysts, namely, sulfated zirconia, iron- and manganese-promoted sulfated zirconia, and USY zeolite, were tested for conversion of propane at 1 atm, 200-450{degrees}C, and propane partial pressures in the range of 0.01-0.05 atm. Both promoted and unpromoted sulfated zirconia were found to be active for conversion of propane into butanes, pentanes, methane, ethane, ethylene, and propylene in the temperature range of 200-350{degrees}C, but catalyst deactivation was rapid. At the higher temperatures, only cracking and dehydrogenation products were observed. In contrast to the zirconia-supported catalysts, USY zeolite was observed to convert propane (into propylene, methane, and ethylene) only at temperatures {ge}400{degrees}C. The initial (5 min on stream) rates of propane conversion in the presence of iron- and manganese-promoted sulfated zirconia, sulfated zirconia, and USY zeolite at 450{degrees}C and 0.01 atm propane partial pressure were 3.3 x 10{sup -8}, 0.3 x 10{sup -8}, and 0.06 x 10{sup -8} mol/(s{center_dot}g), respectively. The product distributions in the temperature range 200-450{degrees}C are those of acid-base catalysis, being similar to what has been observed in superacid solution chemistry at temperatures <0{degrees}C. If propane conversion at 450{degrees}C can be considered as a probe of acid strength of the catalyst, the activity comparison suggests that the promoted sulfated zirconia is a stronger acid than sulfated zirconia, which is a stronger acid than USY zeolite.

  11. Application of Gold Electrodes for the Study of Nickel Based Homogeneous Catalysts for Hydrogen Oxidation

    SciTech Connect (OSTI)

    Nepomnyashchii, Alexander B.; Liu, Fei; Roberts, John A.; Parkinson, Bruce A.

    2013-08-12

    Gold and glassy carbon working electrode materials are compared as suitable substrates for the hydrogen oxidation reaction with Ni(PCy2Nt-Bu2)2(BF4)2 used as a catalyst. Voltammetric responses showing electrocatalytic hydrogen oxidation mediated by the homogeneous electrocatalyst Ni(PCy2Nt-Bu2)2(BF4)2 are identical at glassy carbon and gold electrodes, which shows that gold electrode can be used for hydrogen oxidation reaction. This work is supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the US Department of Energy, Office of Science, Office of Basic Energy Sciences under FWP 56073.

  12. Homogenization of a thin plate reinforced with periodic families of rigid rods

    SciTech Connect (OSTI)

    Nazarov, Sergei A; Sweers, Guido H; Slutskij, Andrey S

    2011-08-31

    The asymptotics of the solution to the elastic bending problem for a thin plate reinforced with several periodic families of closely spaced but disjoint rods are constructed and justified, the result of homogenization being substantially different from the case when the rods are welded together into a single periodic mesh. The material in the rods is assumed to be appreciably more rigid than that in the plate. An averaged fourth-order differential operator is obtained from summing the nonelliptic operators generated by each of the families of the rods. This operator is shown to be elliptic if and only if the rods from at least two families are nonparallel. As a simplified example, the paper examines a similar stationary heat conduction problem. Bibliography: 24 titles.

  13. Particle dispersion in homogeneous turbulence using the one-dimensional turbulence model

    SciTech Connect (OSTI)

    Sun, Guangyuan; Lignell, David O.; Hewson, John C.; Gin, Craig R.

    2014-10-09

    Lagrangian particle dispersion is studied using the one-dimensional turbulence (ODT) model in homogeneous decaying turbulence configurations. The ODT model has been widely and successfully applied to a number of reacting and nonreacting flow configurations, but only limited application has been made to multiphase flows. We present a version of the particle implementation and interaction with the stochastic and instantaneous ODT eddy events. The model is characterized by comparison to experimental data of particle dispersion for a range of intrinsic particle time scales and body forces. Particle dispersion, velocity, and integral time scale results are presented. Moreover, the particle implementation introduces a single model parameter β p , and sensitivity to this parameter and behavior of the model are discussed. Good agreement is found with experimental data and the ODT model is able to capture the particle inertial and trajectory crossing effects. Our results serve as a validation case of the multiphase implementations of ODT for extensions to other flow configurations.

  14. Effects of non-homogeneous flow on ADCP data processing in a hydroturbine forebay

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

    Harding, S. F.; Richmond, M. C.; Romero-Gomez, P.; Serkowski, J. A.

    2016-01-02

    Accurate modeling of the velocity field in the forebay of a hydroelectric power station is important for both power generation and fish passage, and is able to be increasingly well represented by computational fluid dynamics (CFD) simulations. Acoustic Doppler Current Profiler (ADCP) are investigated herein as a method of validating the numerical flow solutions, particularly in observed and calculated regions of non-homogeneous flow velocity. By using a numerical model of an ADCP operating in a velocity field calculated using CFD, the errors due to the spatial variation of the flow velocity are quantified. Furthermore, the numerical model of the ADCPmore » is referred to herein as a Virtual ADCP (VADCP).« less

  15. 2012 Catalysis Lectures

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

    his sabbatical period at Stanford University and SLAC. (1) "Characterization of Heterogeneous Catalysts: Possibilities and Limitations of In-situ Spectroscopy" (Part I) Monday,...

  16. Topical Report

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

    INL/EXT-12-25347 March 2012 CIPS Validation Data Plan Nam Dinh CASL-U-2012-0044-000 CASL-U-2012-0044-000 INL/EXT-12-25347 CIPS Validation Data Plan Nam Dinh Published March 2012 Idaho National Laboratory Nuclear Science & Engineering Division Idaho Falls, Idaho 83415 Prepared for the U.S. Department of Energy Office of Nuclear Energy Under U.S. Department of Energy-Idaho Operations Office Contract DE-AC07-99ID13727 CASL-U-2012-0044-000 CASL-U-2012-0044-000 ABSTRACT The Consortium for

  17. Other Topics

    Broader source: Energy.gov [DOE]

    1.  As we continue our preparations for the State Energy Efficient Appliance Rebate Program (SEEARP), we have heard that there is a possibility that IRS regulations require States to provide a 1099...

  18. A Light-Stimulated Molecular Switch Driven by Radical-Radical...

    Office of Scientific and Technical Information (OSTI)

    United States Language: English Subject: catalysis (homogeneous), solar (photovoltaic), bio-inspired, charge transport, mesostructured materials, materials and chemistry...

  19. Search for: All records | SciTech Connect

    Office of Scientific and Technical Information (OSTI)

    (2) catalysis (homogeneous), solar (photovoltaic), bio-inspired, charge transport, ... improve both the photovoltaic and mechanical properties of polymeric materials. ...

  20. Theoretical Studies in Heterogenous Catalysis: Towards a Rational Design of Novel Catalysts for Hydrodesulfurization and Hydrogen Production

    SciTech Connect (OSTI)

    Rodriguez,J.A.; Liu, P.

    2008-10-01

    Traditionally, knowledge in heterogeneous catalysis has come through empirical research. Nowadays, there is a clear interest to change this since millions of dollars in products are generated every year in the chemical and petrochemical industries through catalytic processes. To obtain a fundamental knowledge of the factors that determine the activity of heterogeneous catalysts is a challenge for modern science since many of these systems are very complex in nature. In principle, when a molecule adsorbs on the surface of a heterogeneous catalyst, it can interact with a large number of bonding sites. It is known that the chemical properties of these bonding sites depend strongly on the chemical environment around them. Thus, there can be big variations in chemical reactivity when going from one region to another in the surface of a heterogeneous catalyst. A main objective is to understand how the structural and electronic properties of a surface affect the energetics for adsorption processes and the paths for dissociation and chemical reactions. In recent years, advances in instrumentation and experimental procedures have allowed a large series of detailed works on the surface chemistry of heterogeneous catalysts. In many cases, these experimental studies have shown interesting and unique phenomena. Theory is needed to unravel the basic interactions behind these phenomena and to provide a general framework for the interpretation of experimental results. Ideally, theoretical calculations based on density-functional theory have evolved to the point that one should be able to predict patterns in the activity of catalytic surfaces. As in the case of experimental techniques, no single theoretical approach is able to address the large diversity of phenomena occurring on a catalyst. Catalytic surfaces are usually modeled using either a finite cluster or a two-dimensionally periodic slab. Many articles have been published comparing the results of these two approaches. An important advantage of the cluster approach is that one can use the whole spectrum of quantum-chemical methods developed for small molecules with relatively minor modifications. On the other hand, the numerical effort involved in cluster calculations increases rather quickly with the size of the cluster. This problem does not exist when using slab models. Due to the explicit incorporation of the periodicity of the crystal lattice through the Bloch theorem, the actual dimension of a slab calculation depends only on the size of the unit cell. In practical terms, the slab approach is mainly useful for investigating the behavior of adsorbates at medium and high coverages. Very large unit cells are required at the limit of low to zero coverage, or when examining the properties and chemical behavior of isolated defect sites in a surface. In these cases, from a computational viewpoint, the cluster approach can be much more cost effective than the slab approach. Slab and cluster calculations can be performed at different levels of sophistication: semi-empirical methods, simple ab initio Hartree-Fock, ab initio post-Hartree-Fock (CI, MP2, etc), and density functional theory. Density-functional (DF) based calculations frequently give adsorption geometries with a high degree of accuracy and predict reliable trends for the energetics of adsorption reactions. This article provides a review of recent theoretical studies that deal with the behavior of novel catalysts used for hydrodesulfurization (HDS) reactions and the production of hydrogen (i.e. catalytic processes employed in the generation of clean fuels). These studies involve a strong coupling of theory and experiment. A significant fraction of the review is focused on the importance of size-effects and correlations between the electronic and chemical properties of catalytic materials. The article begins with a discussion of results for the desulfurization of thiophene on metal carbides and phosphides, systems which have the potential to become the next generation of industrial HDS catalysts. Then, systematic studies con

  1. Energy & Manufacturing Workforce Training Topics List - Version 1.7

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

    (02.11.14) | Department of Energy & Manufacturing Workforce Training Topics List - Version 1.7 (02.11.14) Energy & Manufacturing Workforce Training Topics List - Version 1.7 (02.11.14) View this searchable list of the training programs in the areas of energy and/or manufacturing. Information provided in this list includes: the subjects being taught, grantee, project title, and state. In some cases the list also shows the certificates provided by the courses. File Energy and

  2. Effective properties of a fly ash geopolymer: Synergistic application of X-ray synchrotron tomography, nanoindentation, and homogenization models

    SciTech Connect (OSTI)

    Das, Sumanta; Yang, Pu; Singh, Sudhanshu S.; Mertens, James C. E.; Xiao, Xianghui; Chawla, Nikhilesh; Neithalath, Narayanan

    2015-09-02

    Microstructural and micromechanical investigation of a fly ash-based geopolymer using: (i) synchrotron x-ray tomography (XRT) to determine the volume fraction and tortuosity of pores that are influential in fluid transport, (ii) mercury intrusion porosimetry (MIP) to capture the volume fraction of smaller pores, (iii) scanning electron microscopy (SEM) combined with multi-label thresholding to identify and characterize the solid phases in the microstructure, and (iv) nanoindentation to determine the component phase elastic properties using statistical deconvolution, is reported in this paper. The phase volume fractions and elastic properties are used in multi-step mean field homogenization (Mori- Tanaka and double inclusion) models to determine the homogenized macroscale elastic modulus of the composite. The homogenized elastic moduli are in good agreement with the flexural elastic modulus determined on macroscale paste beams. As a result, the combined use of microstructural and micromechanical characterization tools at multiple scales provides valuable information towards the material design of fly ash geopolymers.

  3. A quasi-Bohmian approach for a homogeneous spherical solid body based on its geometric structure

    SciTech Connect (OSTI)

    Koupaei, Jalaledin Yousefi; Institutes for Theoretical Physics and Mathematics , Tehran ; Golshani, Mehdi; Department of Physics, Sharif University of Technology, Tehran

    2013-12-15

    In this paper we express the space of rotation as a Riemannian space and try to generalize the classical equations of motion of a homogeneous spherical solid body in the domain of quantum mechanics. This is done within Bohm's view of quantum mechanics, but we do not use the Schrdinger equation. Instead, we assume that in addition to the classical potential there is an extra potential and try to obtain it. In doing this, we start from a classical picture based on Hamilton-Jacobi formalism and statistical mechanics but we use an interpretation which is different from the classical one. Then, we introduce a proper action and extremize it. This procedure gives us a mathematical identity for the extra potential that limits its form. The classical mechanics is a trivial solution of this method. In the simplest cases where the extra potential is not a constant, a mathematical identity determines it uniquely. In fact the first nontrivial potential, apart from some constant coefficients which are determined by experiment, is the usual Bohmian quantum potential.

  4. Structure transitions induced by the Hall term in homogeneous and isotropic magnetohydrodynamic turbulence

    SciTech Connect (OSTI)

    Miura, H., E-mail: miura.hideaki@nifs.ac.jp [Department of Helical Plasma Research, National Institute for Fusion Science, 322-6 Oroshi, Toki, Gifu 509-5292 (Japan); Araki, K. [Faculty of Engineering, Okayama University of Science, 1-1 Ridai-cho, Okayama 700-0005 (Japan)

    2014-07-15

    Hall effects on local structures in homogeneous, isotropic, and incompressible magnetohydrodynamic turbulence are studied numerically. The transition of vortices from sheet-like to tubular structures induced by the Hall term is found, while the kinetic energy spectrum does not distinguish the two types of structures. It is shown by the use of the sharp low-pass filter that the transition occurs not only in the scales smaller than the ion skin depth but also in a larger scale. The transition is related with the forward energy transfer in the spectral space. Analyses by the use of the sharp low-pass filter show that the nonlinear energy transfer associated with the Hall term is dominated by the forward transfer and relatively local in the wave number space. A projection of the simulation data to a Smagorinsky-type sub-grid-scale model shows that the high wave number component of the Hall term may possibly be replaced by the model effectively.

  5. Particle dispersion in homogeneous turbulence using the one-dimensional turbulence model

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

    Sun, Guangyuan; Lignell, David O.; Hewson, John C.; Gin, Craig R.

    2014-10-09

    Lagrangian particle dispersion is studied using the one-dimensional turbulence (ODT) model in homogeneous decaying turbulence configurations. The ODT model has been widely and successfully applied to a number of reacting and nonreacting flow configurations, but only limited application has been made to multiphase flows. We present a version of the particle implementation and interaction with the stochastic and instantaneous ODT eddy events. The model is characterized by comparison to experimental data of particle dispersion for a range of intrinsic particle time scales and body forces. Particle dispersion, velocity, and integral time scale results are presented. Moreover, the particle implementation introducesmore » a single model parameter β p , and sensitivity to this parameter and behavior of the model are discussed. Good agreement is found with experimental data and the ODT model is able to capture the particle inertial and trajectory crossing effects. Our results serve as a validation case of the multiphase implementations of ODT for extensions to other flow configurations.« less

  6. MOX recycling in GEN 3 + EPR Reactor homogeneous and stable full MOX core

    SciTech Connect (OSTI)

    Arslan, M.; Villele, E. de; Gauthier, J.C.; Marincic, A.

    2013-07-01

    In the case of the EPR (European Pressurized Reactor) reactor, 100% MOX core management is possible with simple design adaptations which are not significantly costly. 100% MOX core management offers several highly attractive advantages. First, it is possible to have the same plutonium content in all the rods of a fuel assembly instead of having rods with 3 different plutonium contents, as in MOX assemblies in current PWRs. Secondly, the full MOX core is more homogeneous. Thirdly, the stability of the core is significantly increased due to a large reduction in the Xe effect. Fourthly, there is a potential for the performance of the MOX fuel to match that of new high performance UO{sub 2} fuel (enrichment up to 4.95 %) in terms of increased burn up and cycle length. Fifthly, since there is only one plutonium content, the manufacturing costs are reduced. Sixthly, there is an increase in the operating margins of the reactor, and in the safety margins in accident conditions. The use of 100% MOX core will improve both utilisation of natural uranium resources and reductions in high level radioactive waste inventory.

  7. Homogeneous and Heterogeneous Reaction and Transformation of Hg and Trace Metals in Combustion Systems

    SciTech Connect (OSTI)

    J. Helble; Clara Smith; David Miller

    2009-08-31

    The overall goal of this project was to produce a working dynamic model to predict the transformation and partitioning of trace metals resulting from combustion of a broad range of fuels. The information provided from this model will be instrumental in efforts to identify fuels and conditions that can be varied to reduce metal emissions. Through the course of this project, it was determined that mercury (Hg) and arsenic (As) would be the focus of the experimental investigation. Experiments were therefore conducted to examine homogeneous and heterogeneous mercury oxidation pathways, and to assess potential interactions between arsenic and calcium. As described in this report, results indicated that the role of SO{sub 2} on Hg oxidation was complex and depended upon overall gas phase chemistry, that iron oxide (hematite) particles contributed directly to heterogeneous Hg oxidation, and that As-Ca interactions occurred through both gas-solid and within-char reaction pathways. Modeling based on this study indicated that, depending upon coal type and fly ash particle size, vaporization-condensation, vaporization-surface reaction, and As-CaO in-char reaction all play a role in arsenic transformations under combustion conditions.

  8. Environment-based pin-power reconstruction method for homogeneous core calculations

    SciTech Connect (OSTI)

    Leroyer, H.; Brosselard, C.; Girardi, E.

    2012-07-01

    Core calculation schemes are usually based on a classical two-step approach associated with assembly and core calculations. During the first step, infinite lattice assemblies calculations relying on a fundamental mode approach are used to generate cross-sections libraries for PWRs core calculations. This fundamental mode hypothesis may be questioned when dealing with loading patterns involving several types of assemblies (UOX, MOX), burnable poisons, control rods and burn-up gradients. This paper proposes a calculation method able to take into account the heterogeneous environment of the assemblies when using homogeneous core calculations and an appropriate pin-power reconstruction. This methodology is applied to MOX assemblies, computed within an environment of UOX assemblies. The new environment-based pin-power reconstruction is then used on various clusters of 3x3 assemblies showing burn-up gradients and UOX/MOX interfaces, and compared to reference calculations performed with APOLLO-2. The results show that UOX/MOX interfaces are much better calculated with the environment-based calculation scheme when compared to the usual pin-power reconstruction method. The power peak is always better located and calculated with the environment-based pin-power reconstruction method on every cluster configuration studied. This study shows that taking into account the environment in transport calculations can significantly improve the pin-power reconstruction so far as it is consistent with the core loading pattern. (authors)

  9. Localizing multiple X chromosome-linked retinitis pigmentosa loci using multilocus homogeneity tests

    SciTech Connect (OSTI)

    Ott, J.; Terwilliger, J.D. ); Bhattacharya, S. ); Chen, J.D.; Denton, J.; Donald, J. ); Dubay, C.; Litt, M.; Weleber, R.G. ); Farrar, G.J.; Humphries, P. ); Fishman, G.A.; Wong, F. ); Frey, D.; Maechler, M. )

    1990-01-01

    Multilocus linkage analysis of 62 family pedigrees with X chromosome-linked retinitis pigmentosa (XLRP) was undertaken to determine the presence of possible multiple disease loci and to reliability estimate their map location. Multilocus homogeneity tests furnish convincing evidence for the presence of two XLRP loci, the likelihood ratio being 6.4 {times} 10{sup 9}:1 in a favor of two versus a single XLRP locus and gave accurate estimates for their map location. In 60-75% of the families, location of an XLRP gene was estimated at 1 centimorgan distal to OTC, and in 25-40% of the families, an XLRP locus was located halfway between DXS14 (p58-1) and DXZ1 (Xcen), with an estimated recombination fraction of 25% between the two XLRP loci. There is also good evidence for third XLRP locus, midway between DXS28 (C7) and DXS164 (pERT87), supported by a likelihood ratio of 293:1 for three versus two XLRP loci.

  10. High Compositional Homogeneity of CdTexSe1-x Crystals Grown by the Bridgman Method

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

    Roy, U. N.; Bolotnikov, A. E.; Camarda, G. S.; Cui, Y.; Hossain, A.; Lee, K.; Lee, W.; Tappero, R.; Yang, G.; Gul, R.; et al

    2015-02-03

    We obtained high-quality CdTexSe1-x (CdTeSe) crystals from ingots grown by the vertical Bridgman technique. The compositional uniformity of the ingots was evaluated by X-ray fluorescence at BNL’s National Synchrotron Light Source X27A beam line. The resulting compositional homogeneity was highly uniform throughout the ingot, and the effective segregation coefficient of Se was ~1.0. This uniformity offers potential opportunity to enhance the yield of the materials for both infrared substrate and radiation-detector applications, so greatly lowering the cost of production and also offering us the prospect to grow large-diameter ingots for use as large-area substrates and for producing higher efficiency gamma-raymore » detectors. The concentration of secondary phases was found to be much lower, by eight- to ten fold compared to that of conventional CdxZn1-xTe (CdZnTe or CZT).« less

  11. Adapting SAFT-? perturbation theory to site-based molecular dynamics simulation. I. Homogeneous fluids

    SciTech Connect (OSTI)

    Ghobadi, Ahmadreza F.; Elliott, J. Richard

    2013-12-21

    In this work, we aim to develop a version of the Statistical Associating Fluid Theory (SAFT)-? equation of state (EOS) that is compatible with united-atom force fields, rather than experimental data. We rely on the accuracy of the force fields to provide the relation to experimental data. Although, our objective is a transferable theory of interfacial properties for soft and fused heteronuclear chains, we first clarify the details of the SAFT-? approach in terms of site-based simulations for homogeneous fluids. We show that a direct comparison of Helmholtz free energy to molecular simulation, in the framework of a third order Weeks-Chandler-Andersen perturbation theory, leads to an EOS that takes force field parameters as input and reproduces simulation results for Vapor-Liquid Equilibria (VLE) calculations. For example, saturated liquid density and vapor pressure of n-alkanes ranging from methane to dodecane deviate from those of the Transferable Potential for Phase Equilibria (TraPPE) force field by about 0.8% and 4%, respectively. Similar agreement between simulation and theory is obtained for critical properties and second virial coefficient. The EOS also reproduces simulation data of mixtures with about 5% deviation in bubble point pressure. Extension to inhomogeneous systems and united-atom site types beyond those used in description of n-alkanes will be addressed in succeeding papers.

  12. Analysis of Homogeneous Charge Compression Ignition (HCCI) Engines for Cogeneration Applications

    SciTech Connect (OSTI)

    Aceves, S; Martinez-Frias, J; Reistad, G

    2004-04-30

    This paper presents an evaluation of the applicability of Homogeneous Charge Compression Ignition Engines (HCCI) for small-scale cogeneration (less than 1 MWe) in comparison to five previously analyzed prime movers. The five comparator prime movers include stoichiometric spark-ignited (SI) engines, lean burn SI engines, diesel engines, microturbines and fuel cells. The investigated option, HCCI engines, is a relatively new type of engine that has some fundamental differences with respect to other prime movers. Here, the prime movers are compared by calculating electric and heating efficiency, fuel consumption, nitrogen oxide (NOx) emissions and capital and fuel cost. Two cases are analyzed. In Case 1, the cogeneration facility requires combined power and heating. In Case 2, the requirement is for power and chilling. The results show that the HCCI engines closely approach the very high fuel utilization efficiency of diesel engines without the high emissions of NOx and the expensive diesel fuel. HCCI engines offer a new alternative for cogeneration that provides a unique combination of low cost, high efficiency, low emissions and flexibility in operating temperatures that can be optimally tuned for cogeneration systems. HCCI engines are the most efficient technology that meets the oncoming 2007 CARB NOx standards for cogeneration engines. The HCCI engine appears to be a good option for cogeneration systems and merits more detailed analysis and experimental demonstration.

  13. SBIR/STTR Release 2 Topics Announced—Includes Hydrogen and Fuel Cells

    Broader source: Energy.gov [DOE]

    The 2015 Small Business Innovation Research and Small Business Technology Transfer (SBIR/STTR) Phase I Release 2 topics include fuel cell-battery electric hybrid trucks and in-line quality control devices for polymer electrolyte membrane (PEM) fuel cells.

  14. Energy Department Announces New Grant Topics to Help Small Businesses Develop Clean Energy Technologies

    Broader source: Energy.gov [DOE]

    The Energy Department's Office of Energy Efficiency and Renewable Energy (EERE) today announced nine topics and 26 new subtopics under its Small Business Innovation Research (SBIR) and Technology Transfer (STTR) programs that will help small businesses develop and deliver market-driven clean energy technologies.

  15. Characterization of leaded fuel needs and use Task 2 topical report

    SciTech Connect (OSTI)

    Not Available

    1985-02-01

    This topical report is structured around the Statement-of-Work for the DOE/EPA IAG. This includes a discussion of the users of leaded fuel, valve recession and octane, alternatives to leaded fuel and geographical distribution of leaded fuel sales.

  16. A comparison of unburned fuel and aldehyde emissions from a methanol-fueled stratified charge and homogeneous charge engine

    SciTech Connect (OSTI)

    Foster, D.E.; Kim, C.; Scull, N.

    1987-03-01

    This paper presents the results of an experimental program in which a Texaco L-163S engine was fueled with methanol and operated in its traditional stratified charge mode and then modified to run as a homogeneous charge spark ignited engine. The primary data taken were the aldehyde and unburned fuel emissions (UBF). Those data were taken using a continuous time-averaging sampling probe at the exhaust tank and at the exhaust port and with a rotary time-resolving sampling valve located at the exhaust port. The data are for two loads, 138.1 kPa (20 psi) and 207.1 kPa (30 psi) BMEP and three speeds, 1000, 1400 and 1800 rpm. The data indicate that both the stratified charge and the homogeneous charge modes of operation formaldehyde was the only aldehyde detected in the exhaust and it primarily originated in the exhaust and it primarily originated in the cylinder. Over the load and speed ranges tested, the unburned fuel emission were higher and the formaldehyde emission lower when comparing the stratified charge to the homogeneous charge operation. Time resolved data at the exhaust port for the two modes of operation are compared. The homogeneous charge operation had a uniform concentration of both unburned fuel and formaldehyde over the exhaust stroke. The stratified charge data shows large changes in the unburned fuel and moderate changes in the aldehyde concentrations during the exhaust stroke.

  17. Technology development for iron Fischer-Tropsch catalysis. Quarterly technical progress report No. 5, October 1, 1995--December 31, 1995

    SciTech Connect (OSTI)

    Davis, B.H.

    1996-01-19

    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 ``standard-catalyst`` developed by German workers for slurry phase synthesis. The proposed work will optimize the catalyst composition and pretreatment operation for this low-alpha catalyst. 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. The research is divided into four major topical areas: (a) catalyst preparation and characterization, (b) product characterization, (c) reactor operations, and (d) data assessment. Accomplishments to date are described.

  18. Technology development for iron Fischer-Tropsch catalysis. Quarterly technical progress report No. 6, January 1, 1996--March 31, 1996

    SciTech Connect (OSTI)

    Davis, B.H.

    1996-05-01

    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 ``standard-catalyst`` developed by German workers for slurry phase synthesis. The proposed work will optimize the catalyst composition and pretreatment operation for this low-alpha catalyst. In parallel, work will be conducted to design a high-alpha iron catalyst that 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. The research is divided into four major topical areas: (a) catalyst preparation and characterization, (b) product characterization, (c) reactor operations, and (d) data assessment. Accomplishments for this period are discussed.

  19. Cavitation in a metallic liquid: Homogeneous nucleation and growth of nanovoids

    SciTech Connect (OSTI)

    Cai, Y.; Wu, H. A.; Luo, S. N.

    2014-06-07

    Large-scale molecular dynamics (MD) simulations are performed to investigate homogeneous nucleation and growth of nanovoids during cavitation in liquid Cu. We characterize in detail the atomistic cavitation processes by following the temporal evolution of cavities or voids, analyze the nucleation behavior with the mean first-passage time (MFPT) and survival probability (SP) methods, and discuss the results against classical nucleation theory (CNT), the Tolman equation for surface energy, independent calculation of surface tension via integrating the stress profiles, the Johnson-Mehl-Avrami (JMA) growth law, and the power law for nucleus size distributions. Cavitation in this representative metallic liquid is a high energy barrier Poisson processes, and the steady-state nucleation rates obtained from statistical runs with the MFPT and SP methods are in agreement. The MFPT method also yields the critical nucleus size and the Zeldovich factor. Fitting with the Tolman's equation to the MD simulations yields the surface energy of a planar interface (∼0.9 J m{sup −2}) and the Tolman length (0.4–0.5 Å), and those values are in accord with those from integrating the stress profiles of a planar interface. Independent CNT predictions of the nucleation rate (10{sup 33−34} s{sup −1} m{sup −3}) and critical size (3–4 Å in radius) are in agreement with the MFPT and SP results. The JMA law can reasonably describe the nucleation and growth process. The size distribution of subcritical nuclei appears to follow a power law with an exponent decreasing with increasing tension owing to coupled nucleation and growth, and that of the supercritical nuclei becomes flattened during further stress relaxation due to void coalescence.

  20. Lattice Boltzmann simulation of immiscible fluid displacement in porous media: Homogeneous versus heterogeneous pore network

    SciTech Connect (OSTI)

    Liu, Haihu; Zhang, Yonghao; Valocchi, Albert J.

    2015-05-15

    Injection of anthropogenic carbon dioxide (CO{sub 2}) into geological formations is a promising approach to reduce greenhouse gas emissions into the atmosphere. Predicting the amount of CO{sub 2} that can be captured and its long-term storage stability in subsurface requires a fundamental understanding of multiphase displacement phenomena at the pore scale. In this paper, the lattice Boltzmann method is employed to simulate the immiscible displacement of a wetting fluid by a non-wetting one in two microfluidic flow cells, one with a homogeneous pore network and the other with a randomly heterogeneous pore network. We have identified three different displacement patterns, namely, stable displacement, capillary fingering, and viscous fingering, all of which are strongly dependent upon the capillary number (Ca), viscosity ratio (M), and the media heterogeneity. The non-wetting fluid saturation (S{sub nw}) is found to increase nearly linearly with logCa for each constant M. Increasing M (viscosity ratio of non-wetting fluid to wetting fluid) or decreasing the media heterogeneity can enhance the stability of the displacement process, resulting in an increase in S{sub nw}. In either pore networks, the specific interfacial length is linearly proportional to S{sub nw} during drainage with equal proportionality constant for all cases excluding those revealing considerable viscous fingering. Our numerical results confirm the previous experimental finding that the steady state specific interfacial length exhibits a linear dependence on S{sub nw} for either favorable (M ? 1) or unfavorable (M < 1) displacement, and the slope is slightly higher for the unfavorable displacement.

  1. Tidal dissipation in a homogeneous spherical body. II. Three examples: Mercury, Io, and Kepler-10 b

    SciTech Connect (OSTI)

    Makarov, Valeri V.; Efroimsky, Michael E-mail: michael.efroimsky@usno.navy.mil

    2014-11-01

    In Efroimsky and Makarov (Paper I), we derived from the first principles a formula for the tidal heating rate in a homogeneous sphere, compared it with the previously used formulae, and noted the differences. Now we present case studies: Mercury, Kepler-10 b, and a triaxial Io. A sharp frequency dependence of k {sub 2}/Q near spin-orbit resonances yields a sharp dependence of k {sub 2}/Q (and, therefore, of tidal heating) upon the spin rate. Thereby physical libration plays a major role in tidal heating of synchronously rotating planets. The magnitude of libration in the spin rate being defined by the planet's triaxiality, the latter becomes a factor determining the dissipation rate. Other parameters equal, a strongly triaxial synchronized body generates more heat than a similar body of a more symmetrical shape. After an initially triaxial object melts and loses its triaxiality, dissipation becomes less intensive; the body can solidify, with the tidal bulge becoming a new figure with triaxiality lower than the original. We derive approximate expressions for the dissipation rate in a Maxwell planet with the Maxwell time longer than the inverse tidal frequency. The expressions derived pertain to the 1:1 and 3:2 resonances and a nonresonant case; so they are applicable to most close-in super-Earths detected. In these planets, the heating outside synchronism is weakly dependent on the eccentricity and obliquity, provided both these parameters's values are moderate. According to our calculation, Kepler-10 b could hardly survive the intensive tidal heating without being synchronized, circularized, and reshaped through a complete or partial melt-down.

  2. Topics in nuclear and radiochemistry for college curricula and high school science programs

    SciTech Connect (OSTI)

    Not Available

    1990-01-01

    The concern with the current status and trends of nuclear chemistry and radiochemistry education in academic institutions was addressed in a recent workshop. The 1988 workshop considered the important contributions that scientist with nuclear and radiochemistry backgrounds have made and are continuing to make to other sciences and to various applied fields. Among the areas discussed were environmental studies, life sciences, materials science, separation technology, hot atom chemistry, cosmochemistry, and the rapidly growing field of nuclear medicine. It is intent of the organizer and participants of this symposium entitled Topics in Nuclear and Radiochemistry for College Curricula and High School Science Program'' to provide lecture material on topics related to nuclear and radiochemistry to educators. It is our hope that teachers, who may or may not be familiar with the field, will find this collections of articles useful and incorporate some of them into their lectures.

  3. Microsoft PowerPoint - Chairs Round Robin Presentation- Topics and Achievements for Meeting Binders 041615.pptx

    Energy Savers [EERE]

    April 22, 2015 www.energy.gov/EM 2 Savannah River Citizens' Advisory Board Topic: * Liquid Waste Program: The Liquid Waste Program at Savannah River Site (SRS) is the single greatest environmental risk in South Carolina and Georgia and must be funded to be in compliance with all state and federal agreements by 2028. Achievement: * Savannah River Site Citizens' Advisory Board (CAB) Online Training Proposal * In January 2015, the SRS CAB submitted a proposal to SRS to develop a comprehensive

  4. Microsoft Word - JAS-CABRE-III Year-6 Topical-Mar12.docx

    Office of Scientific and Technical Information (OSTI)

    COAL ASH BEHAVIOR IN REDUCING ENVIRONMENTS (CABRE) III Year 6 - Activity 1.10 - Development of a National Center for Hydrogen Technology Topical Report Prepared for: AAD Document Control National Energy Technology Laboratory U.S. Department of Energy 626 Cochrans Mill Road PO Box 10940, MS 921-107 Pittsburgh, PA 15236-0940 Cooperative Agreement No. DE-FE0003466 Performance Monitor: Meghan Napoli Prepared by: Joshua J. Stanislowski Alexander Azenkeng Donald P. McCollor Kevin C. Galbreath Robert

  5. Proceedings of a Topical Meeting On Small Scale Geothermal Power Plants and Geothermal Power Plant Projects

    SciTech Connect (OSTI)

    1986-02-12

    These proceedings describe the workshop of the Topical Meeting on Small Scale Geothermal Power Plants and Geothermal Power Plant Projects. The projects covered include binary power plants, rotary separator, screw expander power plants, modular wellhead power plants, inflow turbines, and the EPRI hybrid power system. Active projects versus geothermal power projects were described. In addition, a simple approach to estimating effects of fluid deliverability on geothermal power cost is described starting on page 119. (DJE-2005)

  6. Homesteading on the Pajarito Plateau topic of inaugural lecture at Los

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

    Alamos National Laboratory Homesteading On The Pajarito Plateau Homesteading on the Pajarito Plateau topic of inaugural lecture at Los Alamos National Laboratory The lecture is based on a book by local writers Dorothy Hoard, Judy Machen and Ellen McGehee about the area's settlement between 1887 and 1942. January 4, 2013 Los Alamos National Laboratory sits on top of a once-remote mesa in northern New Mexico with the Jemez mountains as a backdrop to research and innovation covering

  7. Matter, antimatter and surviving the big bang is topic of Lab's next

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

    Frontiers in Science lecture Frontiers in Science lectures Matter, antimatter and surviving the big bang is topic of Lab's next Frontiers in Science lecture LANL scientist Vincenzo Cirigliano asks the question, How did we survive the big bang? in a series of Frontiers in Science lectures. October 31, 2013 Frontiers in Science lecture series is intended to increase local public awareness of the diversity of science and engineering research at the Laboratory. Frontiers in Science lecture

  8. HEC-DPSSL 2012 Workshop, Topics: National Ignition Facility & Photon

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

    Science > Abstract Submission TEXT SIZE Workshops About Organizing Committee Agenda Deadlines Abstract Submission Venue NIF Tour Directions Lake Tahoe Workshop Sign-up Abstract Submission Please submit an abstract including title, authors, and a short description (no more than ½ page) in Microsoft Word format, which will be used to establish session topics and oral vs. poster mode of presentation. Please email your abstracts to . The Deadline for abstracts is July 30, 2012. Note: Areas

  9. Hanford Advisory Board Draft Letter Topic: Environmental Restoration and Disposal Facility

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

    Topic: Environmental Restoration and Disposal Facility Authors: Mattson, Leckband, Suyama Originating Committee: River & Plateau Version #1 packet 1 Dear Ms. Charboneau and Mr. Faulk, The Tri-Party Agreement (TPA) agencies announced that they were proceeding with a vertical expansion approach for the Environmental Restoration and Disposal Facility (ERDF) during the Feb. 2016 full Hanford Advisory Board (Board) meeting, and again at the Feb. 2016 River and Plateau (RAP) committee meeting.

  10. Microsoft Word - Summary of Rail Comparison for Topic Group 7-1-02.doc

    Office of Environmental Management (EM)

    7/1/2002 1 Summary of the TEC Working Group Rail Topic Group report entitled "Transportation Safety WIPP-PIG Rail Comparison" In 1999, the Transportation External Coordination (TEC) Working Group developed a report entitled the "TEC/WG Transportation Safety Rail Comparison" to provide summary information to TEC participants concerning operational approaches, for rail transport in addressing a variety of transportation issues, objectives, approaches and procedures arising from

  11. Microsoft Word - Tribal Topic Group call 5-23-07.doc

    Office of Environmental Management (EM)

    14, 2007 1 TEC Tribal Topic Group Conference Call May 23, 2007 Group Chair: Jay Jones (DOE/OCRWM) Other Participants: Nithin Akuthota (NCSL), Marlene Analla (Laguna Pueblo), Vicki Best (BSC), Kevin Blackwell (DOT/FRA), Mike Coplin (Chickasaw Nation), Kristen Ellis (DOE/CI), Greg Fasano (BSC), Bob Fry (NCSL), Josh Garcia (Ysleta del Sur Pueblo), Steve Grey (DOE/LLNL), Elizabeth Helvey (BSC), Paloma Hill (DOE/OCRWM Intern), Judith Holm (DOE/OCRWM), Vernon Jensen (Winnebago Tribe of NE), Brice

  12. HeteroFoaM | U.S. DOE Office of Science (SC)

    Office of Science (SC) Website

    as fuel cells, batteries, supercapacitors, electrolyzers, and solid membranes. Research Topics: catalysis (heterogeneous), energy storage (including batteries and capacitors), ...

  13. Fluid Interface Reactions, Structures and Transport Center (FIRST...

    Office of Science (SC) Website

    Research Topics catalysis (heterogeneous), energy storage (including batteries and capacitors), charge transport, mesostructured materials, materials and chemistry by design, ...

  14. Comparison of unburned fuel and aldehyde emissions from a methanol-fueled stratified charge and homogeneous charge engine

    SciTech Connect (OSTI)

    Scull, N.; Kim, C.; Foster, D.E.

    1986-01-01

    This paper presents the results of an experimental program in which a Texaco L-163S engine was fueled with methanol and operated in its traditional stratified charge mode and then modified to run as a homogenous charge spark ignited engine. The primary data taken were the aldehyde and unburned fuel emissions (UBF). These data were taken using a continuous time-averaging sampling probe at the exhaust tank and at the exhaust port and with a rotary time-resolving sampling valve located at the exhaust port. The data indicate that for both the stratified charge and the homogeneous charge modes of operation formaldehyde was the only aldehyde detected in the exhaust and it primarily originated in the cylinder.

  15. Comparison of Homogeneous and Heterogeneous CFD Fuel Models for Phase I of the IAEA CRP on HTR Uncertainties Benchmark

    SciTech Connect (OSTI)

    Gerhard Strydom; Su-Jong Yoon

    2014-04-01

    Computational Fluid Dynamics (CFD) evaluation of homogeneous and heterogeneous fuel models was performed as part of the Phase I calculations of the International Atomic Energy Agency (IAEA) Coordinate Research Program (CRP) on High Temperature Reactor (HTR) Uncertainties in Modeling (UAM). This study was focused on the nominal localized stand-alone fuel thermal response, as defined in Ex. I-3 and I-4 of the HTR UAM. The aim of the stand-alone thermal unit-cell simulation is to isolate the effect of material and boundary input uncertainties on a very simplified problem, before propagation of these uncertainties are performed in subsequent coupled neutronics/thermal fluids phases on the benchmark. In many of the previous studies for high temperature gas cooled reactors, the volume-averaged homogeneous mixture model of a single fuel compact has been applied. In the homogeneous model, the Tristructural Isotropic (TRISO) fuel particles in the fuel compact were not modeled directly and an effective thermal conductivity was employed for the thermo-physical properties of the fuel compact. On the contrary, in the heterogeneous model, the uranium carbide (UCO), inner and outer pyrolytic carbon (IPyC/OPyC) and silicon carbide (SiC) layers of the TRISO fuel particles are explicitly modeled. The fuel compact is modeled as a heterogeneous mixture of TRISO fuel kernels embedded in H-451 matrix graphite. In this study, a steady-state and transient CFD simulations were performed with both homogeneous and heterogeneous models to compare the thermal characteristics. The nominal values of the input parameters are used for this CFD analysis. In a future study, the effects of input uncertainties in the material properties and boundary parameters will be investigated and reported.

  16. Effective properties of a fly ash geopolymer: Synergistic application of X-ray synchrotron tomography, nanoindentation, and homogenization models

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

    Das, Sumanta; Yang, Pu; Singh, Sudhanshu S.; Mertens, James C. E.; Xiao, Xianghui; Chawla, Nikhilesh; Neithalath, Narayanan

    2015-09-02

    Microstructural and micromechanical investigation of a fly ash-based geopolymer using: (i) synchrotron x-ray tomography (XRT) to determine the volume fraction and tortuosity of pores that are influential in fluid transport, (ii) mercury intrusion porosimetry (MIP) to capture the volume fraction of smaller pores, (iii) scanning electron microscopy (SEM) combined with multi-label thresholding to identify and characterize the solid phases in the microstructure, and (iv) nanoindentation to determine the component phase elastic properties using statistical deconvolution, is reported in this paper. The phase volume fractions and elastic properties are used in multi-step mean field homogenization (Mori- Tanaka and double inclusion) modelsmore » to determine the homogenized macroscale elastic modulus of the composite. The homogenized elastic moduli are in good agreement with the flexural elastic modulus determined on macroscale paste beams. As a result, the combined use of microstructural and micromechanical characterization tools at multiple scales provides valuable information towards the material design of fly ash geopolymers.« less

  17. New Homogeneous Standards by Atomic Layer Deposition for Synchrotron X-ray Fluorescence and Absorption Spectroscopies.

    SciTech Connect (OSTI)

    Butterworth, A.L.; Becker, N.; Gainsforth, Z.; Lanzirotti, A.; Newville, M.; Proslier, T.; Stodolna, J.; Sutton, S.; Tyliszczak, T.; Westphal, A.J.; Zasadzinski, J. (UCB)

    2012-03-13

    Quantification of synchrotron XRF analyses is typically done through comparisons with measurements on the NIST SRM 1832/1833 thin film standards. Unfortunately, these standards are inhomogeneous on small scales at the tens of percent level. We are synthesizing new homogeneous multilayer standards using the Atomic Layer Deposition technique and characterizing them using multiple analytical methods, including ellipsometry, Rutherford Back Scattering at Evans Analytical, Synchrotron X-ray Fluorescence (SXRF) at Advanced Photon Source (APS) Beamline 13-ID, Synchrotron X-ray Absorption Spectroscopy (XAS) at Advanced Light Source (ALS) Beamlines 11.0.2 and 5.3.2.1 and by electron microscopy techniques. Our motivation for developing much-needed cross-calibration of synchrotron techniques is borne from coordinated analyses of particles captured in the aerogel of the NASA Stardust Interstellar Dust Collector (SIDC). The Stardust Interstellar Dust Preliminary Examination (ISPE) team have characterized three sub-nanogram, {approx}1{micro}m-sized fragments considered as candidates to be the first contemporary interstellar dust ever collected, based on their chemistries and trajectories. The candidates were analyzed in small wedges of aerogel in which they were extracted from the larger collector, using high sensitivity, high spatial resolution >3 keV synchrotron x-ray fluorescence spectroscopy (SXRF) and <2 keV synchrotron x-ray transmission microscopy (STXM) during Stardust ISPE. The ISPE synchrotron techniques have complementary capabilities. Hard X-ray SXRF is sensitive to sub-fg mass of elements Z {ge} 20 (calcium) and has a spatial resolution as low as 90nm. X-ray Diffraction data were collected simultaneously with SXRF data. Soft X-ray STXM at ALS beamline 11.0.2 can detect fg-mass of most elements, including cosmochemically important oxygen, magnesium, aluminum and silicon, which are invisible to SXRF in this application. ALS beamline 11.0.2 has spatial resolution better than 25 nm. Limiting factors for Stardust STXM analyses were self-imposed limits of photon dose due to radiation damage concerns, and significant attenuation of <1500 eV X-rays by {approx}80{micro}m thick, {approx}25 mg/cm{sup 3} density silica aerogel capture medium. In practice, the ISPE team characterized the major, light elements using STXM (O, Mg, Al, Si) and the heavier minor and trace elements using SXRF. The two data sets overlapped only with minor Fe and Ni ({approx}1% mass abundance), providing few quantitative cross-checks. New improved standards for cross calibration are essential for consortium-based analyses of Stardust interstellar and cometary particles, IDPs. Indeed, they have far reaching application across the whole synchrotron-based analytical community. We have synthesized three ALD multilayers simultaneously on silicon nitride membranes and silicon and characterized them using RBS (on Si), XRF (on Si{sub 3}N{sub 4}) and STXM/XAS (holey Si{sub 3}N{sub 4}). The systems we have started to work with are Al-Zn-Fe and Y-Mg-Er. We have found these ALD multi-layers to be uniform at {micro}m- to nm scales, and have found excellent consistency between four analytical techniques so far. The ALD films can also be used as a standard for e-beam instruments, eg., TEM EELS or EDX. After some early issues with the consistency of coatings to the back-side of the membrane windows, we are confident to be able to show multi-analytical agreement to within 10%. As the precision improves, we can use the new standards to verify or improve the tabulated cross-sections.

  18. Topical Non-Invasive Gene Delivery using Gemini Nanoparticles in Interferon-gamma-deficient Mice

    SciTech Connect (OSTI)

    Badea,I.; Wettig, S.; Verrall, R.; Foldvari, M.

    2007-01-01

    Cutaneous gene therapy, although a promising approach for many dermatologic diseases, has not progressed to the stage of clinical trials, mainly due to the lack of an effective gene delivery system. The main objective of this study was to construct and evaluate gemini nanoparticles as a topical formulation for the interferon gamma (IFN-{gamma}) gene in an IFN-{gamma}-deficient mouse model. Nanoparticles based on the gemini surfactant 16-3-16 (NP16-DNA) and another cationic lipid cholesteryl 3{beta}-(-N-[dimethylamino-ethyl] carbamate) [Dc-chol] (NPDc-DNA) were prepared and characterized. Zetasizer measurement indicated a bimodal distribution of 146 and 468 nm average particle sizes for the NP16-DNA ({zeta}-potential +51 mV) nanoparticles and monomodal distribution of 625 nm ({zeta}-potential +44 mV) for the NPDc-DNA. Circular dichroism studies showed that the gemini surfactant compacted the plasmid more efficiently compared to the Dc-chol. Small-angle X-ray scattering measurements revealed structural polymorphism in the NP16-DNA nanoparticles, with lamellar and Fd3m cubic phases present, while for the NPDc-DNA two lamellar phases could be distinguished. In vivo, both topically applied nanoparticles induced higher gene expression compared to untreated control and naked DNA (means of 0.480 and 0.398 ng/cm{sup 2} vs 0.067 and 0.167 ng/cm{sup 2}). However, treatment with NPDc-DNA caused skin irritation, and skin damage, whereas NP16-DNA showed no skin toxicity. In this study, we demonstrated that topical cutaneous gene delivery using gemini surfactant-based nanoparticles in IFN-{gamma}-deficient mice was safe and may provide increased gene expression in the skin due to structural complexity of NP16 nanoparticles (lamellar-cubic phases).

  19. Combining X-ray Absorption and X-ray Diffraction Techniques for in Situ Studies of Chemical Transformations in Heterogeneous Catalysis: Advantages and Limitations

    SciTech Connect (OSTI)

    Frenkel, A.I.; Hanson, J.; Wang, Q.; Marinkovic, N.; Chen, J.G.; Barrio, L.; Si, R.; Lopez Camara, A.; Estrella, A.M.; Rodriguez, J.A.

    2011-08-05

    Recent advances in catalysis instrumentations include synchrotron-based facilities where time-resolved X-ray scattering and absorption techniques are combined in the same in situ or operando experiment to study catalysts at work. To evaluate the advances and limitations of this method, we performed a series of experiments at the new XAFS/XRD instrument in the National Synchrotron Light Source. Nearly simultaneous X-ray diffraction (XRD) and X-ray absorption fine-structure (XAFS) measurements of structure and kinetics of several catalysts under reducing or oxidizing conditions have been performed and carefully analyzed. For CuFe{sub 2}O{sub 4} under reducing conditions, the combined use of the two techniques allowed us to obtain accurate data on kinetics of nucleation and growth of metallic Cu. For the inverse catalyst CuO/CeO{sub 2} that underwent isothermal reduction (with CO) and oxidation (with O{sub 2}), the XAFS data measured in the same experiment with XRD revealed strongly disordered Cu species that went undetected by diffraction. These and other examples emphasize the unique sensitivity of these two complementary methods to follow catalytic processes in the broad ranges of length and time scales.

  20. Combining X-ray Absorption and X-ray Diffraction Techniques for in Situ Studies of Chemical Transformations in Heterogeneous Catalysis:Advantages and Limitations

    SciTech Connect (OSTI)

    A Frenkel; Q Wang; N Marinkovic; J Chen; L Barrio; R Si; A Lopez Camara; A Estella; J Rodriquez; J Hanson

    2011-12-31

    Recent advances in catalysis instrumentations include synchrotron-based facilities where time-resolved X-ray scattering and absorption techniques are combined in the same in situ or operando experiment to study catalysts at work. To evaluate the advances and limitations of this method, we performed a series of experiments at the new XAFS/XRD instrument in the National Synchrotron Light Source. Nearly simultaneous X-ray diffraction (XRD) and X-ray absorption fine-structure (XAFS) measurements of structure and kinetics of several catalysts under reducing or oxidizing conditions have been performed and carefully analyzed. For CuFe{sub 2}O{sub 4} under reducing conditions, the combined use of the two techniques allowed us to obtain accurate data on kinetics of nucleation and growth of metallic Cu. For the inverse catalyst CuO/CeO{sub 2} that underwent isothermal reduction (with CO) and oxidation (with O{sub 2}), the XAFS data measured in the same experiment with XRD revealed strongly disordered Cu species that went undetected by diffraction. These and other examples emphasize the unique sensitivity of these two complementary methods to follow catalytic processes in the broad ranges of length and time scales.

  1. Atom probe field ion microscopy and related topics: A bibliography 1990

    SciTech Connect (OSTI)

    Russell, K.F.; Miller, M.K.

    1991-12-01

    This bibliography includes references related to the following topics: atom probe field ion microscopy (APFIM), field ion microscopy (FIM), field emission (FE), ion sources, and field desorption mass microscopy (FDMM). Technique-orientated studies and applications are included. The bibliography covers the period 1990. The references contained in this document were compiled from a variety of sources including computer searches and personal lists of publications. To reduce the length of this document, the references have been reduced to the minimum necessary to locate the articles. The references, listed alphabetically by authors, are subdivided into the categories listed in paragraph one above. An Addendum of references missed in previous bibliographies is included.

  2. GEOTHERMAL A N D HEAVY-OIL RESOURCES I N TEXAS TOPICAL REPORT

    Office of Scientific and Technical Information (OSTI)

    dV DOE/m/10412 - 6 GEOTHERMAL A N D HEAVY-OIL RESOURCES I N TEXAS TOPICAL REPORT B y Steven J. Sen1 and Timothy 6. Walter . January 1994 DISCLAIMER T h i s report was prepared as an account of work sponsored by an agency of the United States Government. Neither the United States Government nor any agency thereof, nor any of their employees, makes any warranty, express or implied, or assumes any legal liability or responsi- bility for the accuracy, completeness, or usefulness of any information,

  3. Topic A and B Awardee: Electric Reliability Council of Texas | Department

    Energy Savers [EERE]

    of Energy and B Awardee: Electric Reliability Council of Texas Topic A and B Awardee: Electric Reliability Council of Texas The Electric Reliability Council of Texas (ERCOT) manages the flow of electric power to 22 million Texas customers - representing 85 percent of the state's electric load and 75 percent of the Texas land area. As the independent system operator for the region, ERCOT schedules power on an electric grid that connects 40,000 miles of transmission lines and more than 550

  4. Topics in radiation at accelerators: Radiation physics for personnel and environmental protection

    SciTech Connect (OSTI)

    Cossairt, J.D.

    1996-10-01

    In the first chapter, terminology, physical and radiological quantities, and units of measurement used to describe the properties of accelerator radiation fields are reviewed. The general considerations of primary radiation fields pertinent to accelerators are discussed. The primary radiation fields produced by electron beams are described qualitatively and quantitatively. In the same manner the primary radiation fields produced by proton and ion beams are described. Subsequent chapters describe: shielding of electrons and photons at accelerators; shielding of proton and ion accelerators; low energy prompt radiation phenomena; induced radioactivity at accelerators; topics in radiation protection instrumentation at accelerators; and accelerator radiation protection program elements.

  5. Design, Synthesis, and Mechanistic Evaluation of Iron-Based Catalysis for Synthesis Gas Conversion to Fuels and Chemicals

    SciTech Connect (OSTI)

    Enrique Iglesia; Akio Ishikawa; Manual Ojeda; Nan Yao

    2007-09-30

    A detailed study of the catalyst composition, preparation and activation protocol of Fe-based catalysts for the Fischer-Tropsch Synthesis (FTS) have been carried out in this project. We have studied the effects of different promoters on the catalytic performance of Fe-based catalysts. Specifically, we have focused on how their sequence of addition dramatically influences the performance of these materials in the Fischer-Tropsch synthesis. The resulting procedures have been optimized to improve further upon the already unprecedented rates and C{sub 5+} selectivities of the Fe-based catalysts that we have developed as part of this project. Selectivity to C{sub 5+} hydrocarbon was close to 90 % (CO{sub 2}-free basis) and CO conversion rate was about 6.7 mol h{sup -1} g-at Fe{sup -1} at 2.14 MPa, 508 K and with substoichiometric synthesis gas; these rates were larger than any reported previously for Fe-based FTS catalysts at these conditions. We also tested the stability of Fe-based catalysts during FTS reaction (10 days); as a result, the high hydrocarbon formation rates were maintained during 10 days, though the gradual deactivation was observed. Our investigation has also focused on the evaluation of Fe-based catalysts with hydrogen-poor synthesis gas streams (H{sub 2}/CO=1). We have observed that the Fe-based catalysts prepared in this project display also a high hydrocarbon synthesis rate with substoichiometric synthesis gas (H{sub 2}/CO=1) stream, which is a less desirable reactant mixture than stoichiometric synthesis gas (H{sub 2}/CO=2). We have improved the catalyst preparation protocols and achieved the highest FTS reaction rates and selectivities so far reported at the low temperatures required for selectivity and stability. Also, we have characterized the catalyst structural change and active phases formed, and their catalytic behavior during the activation process to evaluate their influences on FTS reaction. The efforts of this project led to (i) structural evolution of Fe-Zn oxide promoted with K and Cu, and (ii) evaluation of hydrocarbon and CH{sub 4} formation rates during activation procedures at various temperature and H{sub 2}/CO ratios. On the basis of the obtained results, we suggest that lower reactor temperature can be sufficient to activate catalysts and lead to the high FTS performance. In this project, we have also carried out a detailed kinetic and mechanistic study of the Fischer-Tropsch Synthesis with Fe-based catalysts. We have proposed a reaction mechanism with two CO activation pathways: unassisted and H-assisted. Both routes lead to the formation of the same surface monomers (CH{sub 2}). However, the oxygen removal mechanism is different. In the H-assisted route, oxygen is removed exclusively as water, while oxygen is rejected as carbon dioxide in the unassisted CO dissociation. The validity of the mechanism here proposed has been found to be in agreement with the experimental observation and with theoretical calculations over a Fe(110) surface. Also, we have studied the validity of the mechanism that we propose by analyzing the H{sub 2}/D{sub 2} kinetic isotope effect (r{sub H}/r{sub D}) over a conventional iron-based Fischer-Tropsch catalyst Fe-Zn-K-Cu. We have observed experimentally that the use of D{sub 2} instead of H{sub 2} leads to higher hydrocarbons formation rates (inverse kinetic isotopic effect). On the contrary, primary carbon dioxide formation is not influenced. These experimental observations can be explained by two CO activation pathways. We have also explored the catalytic performance of Co-based catalysts prepared by using inverse micelles techniques. We have studied several methods in order to terminate the silanol groups on SiO{sub 2} support including impregnation, urea homogeneous deposition-precipitation, or zirconium (IV) ethoxide titration. Although hydroxyl groups on the SiO{sub 2} surface are difficult to be stoichiometrically titrated by ZrO{sub 2}, a requirement to prevent the formation of strongly-interacting Co oxide species on SiO{sub 2}, modification of ZrO{sub 2} on SiO{sub 2} surface can improve the Co clusters dispersion leading to a marked increase in the number of accessible Co sites. Inverse micelle method allowed the synthesis of small Co clusters on SiO{sub 2}, but the required surfactant removal steps led to the re-oxidation of Co metal clusters and to the formation of difficult to reduce CoO{sub x} species.

  6. SBIR/STTR FY16 Phase I Release 2 Topics Announced—Includes Hydrogen Delivery and Two Technology Transfer Opportunities

    Broader source: Energy.gov [DOE]

    The U.S. Department of Energy has announced the 2016 Small Business Innovation Research and Small Business Technology Transfer (SBIR/STTR) Phase I Release 2 Topics, including magnetocaloric materials development for hydrogen delivery and two technology transfer opportunities.

  7. SBIR/STTR FY16 Phase 1 Release 2 Topics AnnouncedIncludes Hydrogen Delivery and Two Technology Transfer Opportunities

    Broader source: Energy.gov [DOE]

    The U.S. Department of Energy has announced the 2016 Small Business Innovation Research and Small Business Technology Transfer (SBIR/STTR) Phase I Release 2 Topics, including magnetocaloric materials development for hydrogen delivery and two technology transfer opportunities.

  8. Significant enhancement of compositional and superconducting homogeneity in Ti rather than Ta-doped Nb3Sn

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

    Tarantini, C.; Sung, Z. -H.; Lee, P. J.; Ghosh, A. K.; Larbalestier, D. C.

    2016-01-25

    Nb3Sn wires are now very close to their final optimization but despite its classical nature, detailed understanding of the role of Ta and Ti doping in the A15 is not fully understood. Long thought to be essentially equivalent in their influence on Hc2, they were interchangeably applied. Here we show that Ti produces significantly more homogeneous chemical and superconducting properties. Despite Ta-doped samples having a slightly higher Tc onset in zero-field, they always have a wider Tc-distribution. In particular, whereas the Ta-doped A15 has a Tc-distribution extending from 18 down to 5-6 K (the lowest expected Tc for the binarymore » A15 phase), the Ti-doped samples have no A15 phase with Tc below ~12 K. The much narrower Tc distribution in the Ti-doped samples has a positive effect on their in-field Tc-distribution too, leading to an extrapolated μ0Hc2(0) 2 Tesla larger than the Ta-doped one. Ti-doping also appears to be very homogeneous even when the Sn content is reduced in order to inhibit breakdown of the diffusion barriers in very high Jc conductors. As a result, the enhanced homogeneity of the Ti-doped samples appears to result from its assistance of rapid diffusion of Sn into the filaments and by its incorporation into the A15 phase interchangeably with Sn on the Sn sites of the A15 phase.« less

  9. Exotic Effects at the Charm Threshold and Other Novel Physics Topics at JLab-12 GeV

    SciTech Connect (OSTI)

    Brodsky, Stanley J.; /SLAC

    2012-05-03

    I briefly survey a number of novel hadron physics topics which can be investigated with the 12 GeV upgrade at J-Lab. The topics include new the formation of exotic heavy quark resonances accessible above the charm threshold, intrinsic charm and strangeness phenomena, the exclusive Sivers effect, hidden-color Fock states of nuclei, local two-photon interactions in deeply virtual Compton scattering, and non-universal antishadowing.

  10. Visible-Light Photoredox Catalysis: Selective Reduction of Carbon Dioxide to Carbon Monoxide by a Nickel N-Heterocyclic Carbene-Isoquinoline Complex

    SciTech Connect (OSTI)

    Thoi, VanSara; Kornienko, Nick; Margarit, C; Yang, Peidong; Chang, Christopher

    2013-06-07

    The solar-driven reduction of carbon dioxide to value-added chemical fuels is a longstanding challenge in the fields of catalysis, energy science, and green chemistry. In order to develop effective CO2 fixation, several key considerations must be balanced, including (1) catalyst selectivity for promoting CO2 reduction over competing hydrogen generation from proton reduction, (2) visible-light harvesting that matches the solar spectrum, and (3) the use of cheap and earth-abundant catalytic components. In this report, we present the synthesis and characterization of a new family of earth-abundant nickel complexes supported by N-heterocyclic carbene amine ligands that exhibit high selectivity and activity for the electrocatalytic and photocatalytic conversion of CO2 to CO. Systematic changes in the carbene and amine donors of the ligand have been surveyed, and [Ni(Prbimiq1)]2+ (1c, where Prbimiq1 = bis(3-(imidazolyl)isoquinolinyl)propane) emerges as a catalyst for electrochemical reduction of CO2 with the lowest cathodic onset potential (Ecat = 1.2 V vs SCE). Using this earth-abundant catalyst with Ir(ppy)3 (where ppy = 2-phenylpyridine) and an electron donor, we have developed a visible-light photoredox system for the catalytic conversion of CO2 to CO that proceeds with high selectivity and activity and achieves turnover numbers and turnover frequencies reaching 98,000 and 3.9 s1, respectively. Further studies reveal that the overall efficiency of this solar-to-fuel cycle may be limited by the formation of the active Ni catalyst and/or the chemical reduction of CO2 to CO at the reduced nickel center and provide a starting point for improved photoredox systems for sustainable carbon-neutral energy conversion.

  11. Licensing topical report: application of probabilistic risk assessment in the selection of design basis accidents. [HTGR

    SciTech Connect (OSTI)

    Houghton, W.J.

    1980-06-01

    A probabilistic risk assessment (PRA) approach is proposed to be used to scrutinize selection of accident sequences. A technique is described in this Licensing Topical Report to identify candidates for Design Basis Accidents (DBAs) utilizing the risk assessment results. As a part of this technique, it is proposed that events with frequencies below a specified limit would not be candidates. The use of the methodology described is supplementary to the traditional, deterministic approach and may result, in some cases, in the selection of multiple failure sequences as DBAs; it may also provide a basis for not considering some traditionally postulated events as being DBAs. A process is then described for selecting a list of DBAs based on the candidates from PRA as supplementary to knowledge and judgments from past licensing practice. These DBAs would be the events considered in Chapter 15 of Safety Analysis Reports of high-temperature gas-cooled reactors (HTGRs).

  12. Selected topics in particle accelerators: Proceedings of the CAP meetings. Volume 4

    SciTech Connect (OSTI)

    Parsa, Z.

    1995-10-01

    This Report includes copies of transparencies and notes from the presentations made at the Center for Accelerator Physics at Brookhaven National Laboratory. Editing and changes to the authors` contributions in this Report were made only to fulfill the publication requirements. This volume includes notes and transparencies on eight presentations: ``Application of Accelerator-Driven Spallation Targets - Including Tritium Production and Nuclear Waste Transmutation``, ``BNL 5 MW Pulsed Spallation Neutron Source Study``, ``Designing and Understanding of Magnets with the Help of Conformal Mapping``, ``Laser - Electron Beam Scattering Coherent Compton X-Ray Sources``, ``The LHC Project``, ``Optimization of the Photocathode-Linac Separation for the ATF [Accelerator Test Facility] Injection System``, ``On CEBAF Commissioning: First Results``, and ``The Proposed Booster Application Facility at BNL``. An Appendix lists dates, topics, and speakers from October 1989 to December 1994.

  13. Nuclear magnetic resonance apparatus having semitoroidal rf coil for use in topical NMR and NMR imaging

    DOE Patents [OSTI]

    Fukushima, Eiichi; Roeder, Stephen B. W.; Assink, Roger A.; Gibson, Atholl A. V.

    1986-01-01

    An improved nuclear magnetic resonance (NMR) apparatus for use in topical magnetic resonance (TMR) spectroscopy and other remote sensing NMR applications includes a semitoroidal radio-frequency (rf) coil. The semitoroidal rf coil produces an effective alternating magnetic field at a distance from the poles of the coil, so as to enable NMR measurements to be taken from selected regions inside an object, particularly including human and other living subjects. The semitoroidal rf coil is relatively insensitive to magnetic interference from metallic objects located behind the coil, thereby rendering the coil particularly suited for use in both conventional and superconducting NMR magnets. The semitoroidal NMR coil can be constructed so that it emits little or no excess rf electric field associated with the rf magnetic field, thus avoiding adverse effects due to dielectric heating of the sample or to any other interaction of the electric field with the sample.

  14. Displacement Fields and Self-Energies of Circular and Polygonal Dislocation Loops in Homogeneous and Layered Anisotropic Solids

    SciTech Connect (OSTI)

    Gao, Yanfei; Larson, Ben C.

    2015-06-19

    There are large classes of materials problems that involve the solutions of stress, displacement, and strain energy of dislocation loops in elastically anisotropic solids, including increasingly detailed investigations of the generation and evolution of irradiation induced defect clusters ranging in sizes from the micro- to meso-scopic length scales. Based on a two-dimensional Fourier transform and Stroh formalism that are ideal for homogeneous and layered anisotropic solids, we have developed robust and computationally efficient methods to calculate the displacement fields for circular and polygonal dislocation loops. Using the homogeneous nature of the Green tensor of order -1, we have shown that the displacement and stress fields of dislocation loops can be obtained by numerical quadrature of a line integral. In addition, it is shown that the sextuple integrals associated with the strain energy of loops can be represented by the product of a pre-factor containing elastic anisotropy effects and a universal term that is singular and equal to that for elastic isotropic case. Furthermore, we have found that the self-energy pre-factor of prismatic loops is identical to the effective modulus of normal contact, and the pre-factor of shear loops differs from the effective indentation modulus in shear by only a few percent. These results provide a convenient method for examining dislocation reaction energetic and efficient procedures for numerical computation of local displacements and stresses of dislocation loops, both of which play integral roles in quantitative defect analyses within combined experimental–theoretical investigations.

  15. THREE DISCRETE GROUPS WITH HOMOGENEOUS CHEMISTRY ALONG THE RED GIANT BRANCH IN THE GLOBULAR CLUSTER NGC2808

    SciTech Connect (OSTI)

    Carretta, E.

    2014-11-10

    We present the homogeneous reanalysis of Mg and Al abundances from high resolution UVES/FLAMES spectra for 31 red giants in the globular cluster NGC2808. We found a well defined Mg-Al anticorrelation reaching a regime of subsolar Mg abundance ratios, with a spread of about 1.4dex in [Al/Fe]. The main result from the improved statistics of our sample is that the distribution of stars is not continuous along the anticorrelation because they are neatly clustered into three distinct clumps, each with different chemical compositions. One group (P) shows a primordial composition of field stars of similar metallicity, and the other two (I and E) have increasing abundances of Al and decreasing abundances of Mg. The fraction of stars we found in the three components (P: 68%, I: 19%, E: 13%) is in excellent agreement with the ratios computed for the three distinct main sequences in NGC2808: for the first time there is a clear correspondence between discrete photometric sequences of dwarfs and distinct groups of giants with homogeneous chemistry. The composition of the I group cannot be reproduced by mixing of matter with extreme processing in hot H-burning and gas with pristine, unprocessed composition, as also found in the recent analysis of three discrete groups in NGC6752. This finding suggests that different classes of polluters were probably at work in NGC2808 as well.

  16. Thermomechanical process optimization of U-10wt% Mo Part 2: The effect of homogenization on the mechanical properties and microstructure

    SciTech Connect (OSTI)

    Joshi, Vineet V.; Nyberg, Eric A.; Lavender, Curt A.; Paxton, Dean M.; Burkes, Douglas E.

    2015-07-09

    Low-enriched uranium alloyed with 10 wt% molybdenum (U-10Mo) is currently being investigated as an alternative fuel for the highly enriched uranium used in several of the United States high performance research reactors. Development of the methods to fabricate the U-10Mo fuel plates is currently underway and requires fundamental understanding of the mechanical properties at the expected processing temperatures. In the first part of this series, it was determined that the as-cast U-10Mo had a dendritic microstructure with chemical inhomogeneity and underwent eutectoid transformation during hot compression testing. In the present (second) part of the work, the as-cast samples were heat treated at several temperatures and times to homogenize the Mo content. Like the previous as-cast material, the homogenized materials were then tested under compression between 500 and 800C. The as-cast samples and those treated at 800C for 24 hours had grain sizes of 25-30 ?m, whereas those treated at 1000C for 16 hours had grain sizes around 250 ?m before testing. Upon compression testing, it was determined that the heat treatment had effects on the mechanical properties and the precipitation of the lamellar phase at sub-eutectoid temperatures.

  17. Displacement Fields and Self-Energies of Circular and Polygonal Dislocation Loops in Homogeneous and Layered Anisotropic Solids

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

    Gao, Yanfei; Larson, Ben C.

    2015-06-19

    There are large classes of materials problems that involve the solutions of stress, displacement, and strain energy of dislocation loops in elastically anisotropic solids, including increasingly detailed investigations of the generation and evolution of irradiation induced defect clusters ranging in sizes from the micro- to meso-scopic length scales. Based on a two-dimensional Fourier transform and Stroh formalism that are ideal for homogeneous and layered anisotropic solids, we have developed robust and computationally efficient methods to calculate the displacement fields for circular and polygonal dislocation loops. Using the homogeneous nature of the Green tensor of order -1, we have shown thatmore » the displacement and stress fields of dislocation loops can be obtained by numerical quadrature of a line integral. In addition, it is shown that the sextuple integrals associated with the strain energy of loops can be represented by the product of a pre-factor containing elastic anisotropy effects and a universal term that is singular and equal to that for elastic isotropic case. Furthermore, we have found that the self-energy pre-factor of prismatic loops is identical to the effective modulus of normal contact, and the pre-factor of shear loops differs from the effective indentation modulus in shear by only a few percent. These results provide a convenient method for examining dislocation reaction energetic and efficient procedures for numerical computation of local displacements and stresses of dislocation loops, both of which play integral roles in quantitative defect analyses within combined experimental–theoretical investigations.« less

  18. Experimental and numerical analysis of parallel reactant flow and transverse mixing with mineral precipitation in homogeneous and heterogeneous porous media

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

    Fox, Don T.; Guo, Luanjing; Fujita, Yoshiko; Huang, Hai; Redden, George

    2015-12-17

    Formation of mineral precipitates in the mixing interface between two reactant solutions flowing in parallel in porous media is governed by reactant mixing by diffusion and dispersion and is coupled to changes in porosity/permeability due to precipitation. The spatial and temporal distribution of mixing-dependent precipitation of barium sulfate in porous media was investigated with side-by-side injection of barium chloride and sodium sulfate solutions in thin rectangular flow cells packed with quartz sand. The results for homogeneous sand beds were compared to beds with higher or lower permeability inclusions positioned in the path of the mixing zone. In the homogeneous andmore » high permeability inclusion experiments, BaSO4 precipitate (barite) formed in a narrow deposit along the length and in the center of the solution–solution mixing zone even though dispersion was enhanced within, and downstream of, the high permeability inclusion. In the low permeability inclusion experiment, the deflected BaSO4 precipitation zone broadened around one side and downstream of the inclusion and was observed to migrate laterally toward the sulfate solution. A continuum-scale fully coupled reactive transport model that simultaneously solves the nonlinear governing equations for fluid flow, transport of reactants and geochemical reactions was used to simulate the experiments and provide insight into mechanisms underlying the experimental observations. Lastly, migration of the precipitation zone in the low permeability inclusion experiment could be explained by the coupling effects among fluid flow, reactant transport and localized mineral precipitation reaction.« less

  19. Predicting the influence of long-range molecular interactions on macroscopic-scale diffusion by homogenization of the Smoluchowski equation

    SciTech Connect (OSTI)

    Kekenes-Huskey, P. M.; Gillette, A. K.; McCammon, J. A.; Department of Chemistry, Howard Hughes Medical Institute, University of California San Diego, La Jolla, California 92093-0636

    2014-05-07

    The macroscopic diffusion constant for a charged diffuser is in part dependent on (1) the volume excluded by solute obstacles and (2) long-range interactions between those obstacles and the diffuser. Increasing excluded volume reduces transport of the diffuser, while long-range interactions can either increase or decrease diffusivity, depending on the nature of the potential. We previously demonstrated [P. M. Kekenes-Huskey et al., Biophys. J. 105, 2130 (2013)] using homogenization theory that the configuration of molecular-scale obstacles can both hinder diffusion and induce diffusional anisotropy for small ions. As the density of molecular obstacles increases, van der Waals (vdW) and electrostatic interactions between obstacle and a diffuser become significant and can strongly influence the latter's diffusivity, which was neglected in our original model. Here, we extend this methodology to include a fixed (time-independent) potential of mean force, through homogenization of the Smoluchowski equation. We consider the diffusion of ions in crowded, hydrophilic environments at physiological ionic strengths and find that electrostatic and vdW interactions can enhance or depress effective diffusion rates for attractive or repulsive forces, respectively. Additionally, we show that the observed diffusion rate may be reduced independent of non-specific electrostatic and vdW interactions by treating obstacles that exhibit specific binding interactions as buffers that absorb free diffusers. Finally, we demonstrate that effective diffusion rates are sensitive to distribution of surface charge on a globular protein, Troponin C, suggesting that the use of molecular structures with atomistic-scale resolution can account for electrostatic influences on substrate transport. This approach offers new insight into the influence of molecular-scale, long-range interactions on transport of charged species, particularly for diffusion-influenced signaling events occurring in crowded cellular environments.

  20. Topical efficacy of dimercapto-chelating agents against lewisite-induced skin lesions in SKH-1 hairless mice

    SciTech Connect (OSTI)

    Mouret, Stéphane; Wartelle, Julien; Emorine, Sandy; Bertoni, Marine; Nguon, Nina; Cléry-Barraud, Cécile; Dorandeu, Frédéric; Boudry, Isabelle

    2013-10-15

    Lewisite is a potent chemical warfare arsenical vesicant that can cause severe skin lesions. Today, lewisite exposure remains possible during demilitarization of old ammunitions and as a result of deliberate use. Although its cutaneous toxicity is not fully elucidated, a specific antidote exists, the British anti-lewisite (BAL, dimercaprol) but it is not without untoward effects. Analogs of BAL, less toxic, have been developed such as meso-2,3-dimercaptosuccinic acid (DMSA) and have been employed for the treatment of heavy metal poisoning. However, efficacy of DMSA against lewisite-induced skin lesions remains to be determined in comparison with BAL. We have thus evaluated in this study the therapeutic efficacy of BAL and DMSA in two administration modes against skin lesions induced by lewisite vapor on SKH-1 hairless mice. Our data demonstrate a strong protective efficacy of topical application of dimercapto-chelating agents in contrast to a subcutaneous administration 1 h after lewisite exposure, with attenuation of wound size, necrosis and impairment of skin barrier function. The histological evaluation also confirms the efficacy of topical application by showing that treatments were effective in reversing lewisite-induced neutrophil infiltration. This protective effect was associated with an epidermal hyperplasia. However, for all the parameters studied, BAL was more effective than DMSA in reducing lewisite-induced skin injury. Together, these findings support the use of a topical form of dimercaprol-chelating agent against lewisite-induced skin lesion within the first hour after exposure to increase the therapeutic management and that BAL, despite its side-effects, should not be abandoned. - Highlights: • Topically applied dimercapto-chelating agents reduce lewisite-induced skin damage. • One topical application of BAL or DMSA is sufficient to reverse lewisite effects. • Topical BAL is more effective than DMSA to counteract lewisite-induced skin damage.

  1. Low-rank coal research, Task 5.1. Topical report, April 1986--December 1992

    SciTech Connect (OSTI)

    Not Available

    1993-02-01

    This document is a topical progress report for Low-Rank Coal Research performed April 1986 - December 1992. Control Technology and Coal Preparation Research is described for Flue Gas Cleanup, Waste Management, Regional Energy Policy Program for the Northern Great Plains, and Hot-Gas Cleanup. Advanced Research and Technology Development was conducted on Turbine Combustion Phenomena, Combustion Inorganic Transformation (two sections), Liquefaction Reactivity of Low-Rank Coals, Gasification Ash and Slag Characterization, and Coal Science. Combustion Research is described for Atmospheric Fluidized-Bed Combustion, Beneficiation of Low-Rank Coals, Combustion Characterization of Low-Rank Fuels (completed 10/31/90), Diesel Utilization of Low-Rank Coals (completed 12/31/90), Produce and Characterize HWD (hot-water drying) Fuels for Heat Engine Applications (completed 10/31/90), Nitrous Oxide Emission, and Pressurized Fluidized-Bed Combustion. Liquefaction Research in Low-Rank Coal Direct Liquefaction is discussed. Gasification Research was conducted in Production of Hydrogen and By-Products from Coals and in Sulfur Forms in Coal.

  2. Catalytic conversion of light alkanes, Phase 3. Topical report, January 1990--December 1992

    SciTech Connect (OSTI)

    1992-12-31

    The mission of this work is to devise a new catalyst which can be used in the first simple, economic process to convert the light alkanes in natural gas to an alcohol-rich oxygenated product which can either be used as an environmentally friendly, high-performance liquid fuel, or a precursor to a liquid hydrocarbon transportation fuel. The authors have entered the proof-of-concept stage for converting isobutane to tert butyl alcohol in a practical process and are preparing to enter proof-of-concept of a propane to isopropyl alcohol process in the near future. Methane and ethane are more refractory and thus more difficult to oxidize than the C{sub 3} and C{sub 4} hydrocarbons. Nonetheless, advances made in this area indicate that further research progress could achieve the goal of their direct conversion to alcohols. Progress in Phase 3 catalytic vapor phase methane and ethane oxidation over metals in regular oxidic lattices are the subject of this topical report.

  3. Catalytic conversion of light alkanes-proof-of-concept stage - Phase IV. Topical report, February 1, 1994--January 31, 1995

    SciTech Connect (OSTI)

    1998-12-31

    This report details the research performed on Phase IV of the extended Cooperative Agreement. This Phase, entitled C{sub 1}-C{sub 4} Research, provides the research support which accompanies the C{sub 4} Proof-of-Concept Phase (Phase V) as the two major activities of the Cooperative Agreement during calendar 1993. It is the objective of this phase to understand the nature of the catalysts and catalytic activity of perhaloporphyrin complexes uncovered during Phases I-III in order that superior catalytic materials can be made and tested which meet commercial criteria for the oxidation of the C{sub 1}-C{sub 4} light alkane gases found in natural gas and other available hydrocarbon streams. During Phase IV, we have examined the physical and electronic structures of the very active perhaloporphyrin catalysts which we have developed, and have gained an understanding of the properties which make them active. This has led us to design and synthesize materials which are cheaper, more active, more robust and, in general superior for carrying out practical catalysis. Our early generation perhaloporphyrin catalysts, while exhibiting unprecedented catalytic activity, were far too expensive for use in converting natural gas or its C{sub 1}-C{sub 4} components.

  4. Characterization of fundamental catalytic properties of MoS2/WS2 nanotubes and nanoclusters for desulfurization catalysis - a surface temperature study

    SciTech Connect (OSTI)

    U. Burghaus

    2012-07-05

    The prior project consisted of two main project lines. First, characterization of novel nanomaterials for hydrodesulfurization (HDS) applications. Second, studying more traditional model systems for HDS such as vapor-deposited silica-supported Mo and MoSx clusters. In the first subproject, we studied WS2 and MoS2 fullerene-like nanoparticles as well as WS2 nanotubes. Thiophene (C4H4S) was used as the probe molecule. Interestingly, metallic and sulfur-like adsorption sites could be identified on the silica-supported fullerene-particles system. Similar structures are seen for the traditional system (vapor-deposited clusters). Thus, this may be a kinetics fingerprint feature of modern HDS model systems. In addition, kinetics data allowed characterization of the different adsorption sites for thiophene on and inside WS2 nanotube bundles. The latter is a unique feature of nanotubes that has not been reported before for any inorganic nanotube system; however, examples are known for carbon nanotubes, including prior work of the PI. Although HDS has been studied for decades, utilizing nanotubes as nanosized HDS reactors has never been tried before, as far as we know. This is of interest from a fundamental perspective. Unfortunately, the HDS activity of the nanocatalysts at ultra-high vacuum (UHV) conditions was close to the detection limit of our techniques. Therefore, we propose to run experiments at ambient pressure on related nanopowder samples as part of the renewal application utilizing a now-available GC (gas chromatograph) setup. In addition, Ni and Co doped nanocatalyts are proposed for study. These dopants will boost the catalytic activity. In the second subproject of the prior grant, we studied HDS-related chemistry on more traditional supported cluster catalysts. Mo clusters supported by physical vapor deposition (PVD) on silica have been characterized. Two reaction pathways are evident when adsorbing thiophene on Mo and MoSx clusters: molecular adsorption and dissociation. PVD Mo clusters turned out to be very reactive toward thiophene bond activation. Sulfur and carbon residuals form, which poison the catalyst and sulfide the Mo clusters. Sulfided silica-supported MoSx samples are not reactive toward thiophene bond activation. In addition to S and C deposits, H2, H2S, and small organic molecules were detected in the gas phase. Catalyst reactivation procedures, including O2 and atomic hydrogen treatments, have been tested. Cluster size effects have been seen: thiophene adsorbs molecularly with larger binding energies on smaller clusters. However, larger clusters have smaller activation energy for C4H4S bond activation than smaller clusters. The latter is consistent with early catalysis studies. Kinetics and dynamics parameters have been determined quantitatively. We spent a significant amount of time on upgrades of our equipment. A 2nd-hand refurbished X-ray photoelectron spectrometer (XPS) has been integrated into the existing molecular beam scattering system and is already operational (supported by the DoE supplemental grant available in October 2009). We also added a time of flight (TOF) system to the beam scattering apparatus and improved on the accessible impact energy range (new nozzle heater and gas mixing manifold) for the beam scattering experiments. In addition, a GC-based powder atmospheric flow reactor for studies on powder samples is now operational. Furthermore, a 2nd UHV kinetics system has been upgraded as well. In summary, mostly single crystal systems have so far been considered in basic science studies about HDS. Industrial catalysts, however, can be better approximated with the supported cluster systems that we studied in this project. Furthermore, an entirely new class of HDS systems, namely fullerene-like particles and inorganic nanotubes, has been included. Studying new materials and systems has the potential to impact science and technology. The systems investigated are closely related to energy and environmental-related surface science/catalysis. This prior project, conducted at NDSU by a sma

  5. TEXAS CLEAN ENERGY PROJECT TOPICAL REPORT PHASE 1 FEBRUARY 2010-DECEMBER 2012

    SciTech Connect (OSTI)

    Mattes, Karl

    2012-11-01

    Summit Texas Clean Energy, LLC (STCE) is developing the Texas Clean Energy Project (TCEP or the project) to be located near Penwell, Texas. The TCEP will include an Integrated Gasification Combined Cycle (IGCC) plant with a nameplate capacity of 400 megawatts electric (MWe), combined with the production of urea fertilizer and the capture, utilization and storage of carbon dioxide (CO2) sold commercially for regional use in enhanced oil recovery (EOR) in the Permian Basin of west Texas. The TCEP will utilize coal gasification technology to convert Powder River Basin subbituminous coal delivered by rail from Wyoming into a synthetic gas (syngas) which will be cleaned and further treated so that at least 90 percent of the overall carbon entering the facility will be captured. The clean syngas will then be divided into two high-hydrogen (H2) concentration streams, one of which will be combusted as a fuel in a combined cycle power block for power generation and the other converted into urea fertilizer for commercial sale. The captured CO2 will be divided into two streams: one will be used in producing the urea fertilizer and the other will be compressed for transport by pipeline for offsite use in EOR and permanent underground sequestration. The TCEP was selected by the U.S. Department of Energy (DOE) Office of Fossil Energy (FE) for cost-shared co-funded financial assistance under Round 3 of its Clean Coal Power Initiative (CCPI). A portion of this financial assistance was budgeted and provided for initial development, permitting and design activities. STCE and the DOE executed a Cooperative Agreement dated January 29, 2010, which defined the objectives of the project for all phases. During Phase 1, STCE conducted and completed all objectives defined in the initial development, permitting and design portions of the Cooperative Agreement. This topical report summarizes all work associated with the project objectives, and additional work required to complete the financing of the project. In general, STCE completed project definition, a front-end, engineering and design study (FEED), applied for and received its Record of Decision (ROD) associated with the NEPA requirements summarized in a detailed Environmental Impact Statement. A topical report covering the results of the FEED is the subject of a separate report submitted to the DOE on January 26, 2012. References to the FEED report are contained herein. In December 2011, STCE executed fixed-price turnkey EPC contracts and a long-term O&M agreement with industry-leading contractors.. Other work completed during Phase 1 includes execution of all major commercial input and offtake agreements. STCE negotiated long-term agreements for power, CO2 and urea offtake. A contract for the purchase of coal feedstock from Cloud Peak Energy’s Cordero Rojo mine was executed, as well as a memorandum of understanding with the Union Pacific Railroad (UPRR) for delivery of the coal to the TCEP site. An MOU for natural gas supply was completed with ONEOK, and a long-term water supply agreement was completed with a private landowner. In addition, STCE secured options for easements and rights-of-way, completed a transmission study, executed an interconnection agreement and devoted substantial effort to debt and conventional and tax equity structuring to position the Project for project financing, currently scheduled for closing on December 31, 2012.

  6. BOA: Asbestos pipe-insulation removal robot system. Phase I. Topical report, November 1993--December 1994

    SciTech Connect (OSTI)

    Schempf, H.; Bares, J.E.

    1995-01-01

    Based on several key design criteria and site visits, we developed a Robot design and built a system which automatically strips the lagging and insulation from the pipes, and encapsulates them under complete vacuum operation. The system can operate on straight runs of piping in horizontal or vertical orientations. Currently we are limited to four-inch diameter piping without obstacles as well as a somewhat laborious emplacement and removal procedure. Experimental results indicated that the current robotic abatement process is sound yet needs to be further expanded and modified. One of the main discoveries was that a longitudinal cut to fully allow the paddles to dig in and compress the insulation off the pipe is essential. Furthermore, a different cutting method might be explored to alleviate the need for a deeper cut and to enable a combination of certain functions such as compression and cutting. Unfortunately due to a damaged mechanism caused by extensive testing, we were unable to perform vertical piping abatement experiments, but foresee no trouble in implementing them in the next proposed Phase. Other encouraging results have BOA removing asbestos at a rate of 4-5 ft./h compared to 3 ft./h for manual removal of asbestos with a 3-person crew. However, we feel confident that we can double the asbestos removal rate by improving cutting speed, and increasing the length of the BOA robot. The containment and vacuum system on BOA is able to achieve the regulatory requirement for airborne fiber emissions of 0.01 fibers/ccm/8-hr. shift. Currently, BOA weighs about 117 pounds which is more than a human is permitted to lift overhead under OSHA requirements (i.e., 25 pounds). We are considering designing the robot into two components (i.e., locomotor section and cutter/removal section) to aid human installation as well as incorporating composite materials. A more detailed list of all the technical modifications is given in this topical report.

  7. Fluidized-bed retorting of Colorado oil shale: Topical report. [None

    SciTech Connect (OSTI)

    Albulescu, P.; Mazzella, G.

    1987-06-01

    In support of the research program in converting oil shale into useful forms of energy, the US Department of Energy is developing systems models of oil shale processing plants. These models will be used to project the most attractive combination of process alternatives and identify future direction for R and D efforts. With the objective of providing technical and economic input for such systems models, Foster Wheeler was contracted to develop conceptual designs and cost estimates for commercial scale processing plants to produce syncrude from oil shales via various routes. This topical report summarizes the conceptual design of an integrated oil shale processing plant based on fluidized bed retorting of Colorado oil shale. The plant has a nominal capacity of 50,000 barrels per operating day of syncrude product, derived from oil shale feed having a Fischer Assay of 30 gallons per ton. The scope of the plant encompasses a grassroots facility which receives run of the mine oil shale, delivers product oil to storage, and disposes of the processed spent shale. In addition to oil shale feed, the battery limits input includes raw water, electric power, and natural gas to support plant operations. Design of the individual processing units was based on non-confidential information derived from published literature sources and supplemented by input from selected process licensors. The integrated plant design is described in terms of the individual process units and plant support systems. The estimated total plant investment is similarly detailed by plant section and an estimate of the annual operating requirements and costs is provided. In addition, the process design assumptions and uncertainties are documented and recommendations for process alternatives, which could improve the overall plant economics, are discussed.

  8. Catalysis Center for Energy Innovation

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

    I: Analytical Characterization Instructors: Professor Paul Dauenhauer (University of Minnesota) Jeff Everhart (University of Delaware) 322 ISE Lab 10:45-11:00 Break 11:00-12:30 ...

  9. Electrochemistry: Catalysis at the boundaries

    SciTech Connect (OSTI)

    Appel, Aaron M.

    2014-04-09

    Renewable energy provides an opportunity to power society without the potential impacts from the use of fossil fuels, but a major limitation of sources such as solar and wind is their intermittent availability. Efficient storage of energy from these renewable sources is critical in developing their widespread utilization. One approach to the storage of renewable energy is the production of fuels, such as ethanol, from water and carbon dioxide. Unlike traditional centralized fuel production, electrochemical systems can operate under mild pressures and temperatures in dispersed, small-scale reactors. Renewable sources of energy are inherently dispersed, and therefore are well matched with the production of fuels electrochemically. However, the development of efficient catalysts is essential for the intended chemical transformations.

  10. Differential homogeneous immunosensor device

    DOE Patents [OSTI]

    Malmros, M.K.; Gulbinski, J. III.

    1990-04-10

    There is provided a novel method of testing for the presence of an analyte in a fluid suspected of containing the same. In this method, in the presence of the analyte, a substance capable of modifying certain characteristics of the substrate is bound to the substrate and the change in these qualities is measured. While the method may be modified for carrying out quantitative differential analyses, it eliminates the need for washing the analyte from the substrate which is characteristic of prior art methods. 12 figs.

  11. homogeneous charge compression ignition

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

    Home Office Equipment Tables (Million U.S. Households; 12 pages, 123 kb) Contents Pages HC7-1a. Home Office Equipment by Climate Zone, Million U.S. Households, 2001 1 HC7-2a. Home Office Equipment by Year of Construction, Million U.S. Households, 2001 1 HC7-3a. Home Office Equipment by Household Income, Million U.S. Households, 2001 1 HC7-4a. Home Office Equipment by Type of Housing Unit, Million U.S. Households, 2001 1 HC7-5a. Home Office Equipment by Type of Owner-Occupied Housing Unit,

  12. Differential homogeneous immunosensor device

    DOE Patents [OSTI]

    Malmros, Mark K.; Gulbinski, III, Julian

    1990-04-10

    There is provided a novel method of testing for the presence of an analyte in a fluid suspected of containing the same. In this method, in the presence of the analyte, a substance capable of modifying certain characteristics of the substrate is bound to the substrate and the change in these qualities is measured. While the method may be modified for carrying out quantitative differential analyses, it eliminates the need for washing analyte from the substrate which is characteristic of prior art methods.

  13. Multiple current peaks in room-temperature atmospheric pressure homogenous dielectric barrier discharge plasma excited by high-voltage tunable nanosecond pulse in air

    SciTech Connect (OSTI)

    Yang, De-Zheng; Wang, Wen-Chun; Zhang, Shuai; Tang, Kai; Liu, Zhi-jie; Wang, Sen

    2013-05-13

    Room temperature homogenous dielectric barrier discharge plasma with high instantaneous energy efficiency is acquired by using nanosecond pulse voltage with 20-200 ns tunable pulse width. Increasing the voltage pulse width can lead to the generation of regular and stable multiple current peaks in each discharge sequence. When the voltage pulse width is 200 ns, more than 5 organized current peaks can be observed under 26 kV peak voltage. Investigation also shows that the organized multiple current peaks only appear in homogenous discharge mode. When the discharge is filament mode, organized multiple current peaks are replaced by chaotic filament current peaks.

  14. Role of the laser pulse-length in producing high-quality electron beams in a homogenous plasma

    SciTech Connect (OSTI)

    Upadhyay, Ajay K.; Arun Samant, Sushil; Krishnagopal, Srinivas

    2012-07-15

    In laser wakefield acceleration, the pulse-length of the laser is an important parameter that affects the laser evolution and electron beam injection and acceleration in the bubble regime. Here, we use three-dimensional simulations to find, for a given plasma density, the optimal pulse-length that gives the best quality electron beam. For three different pulse lengths, we study the evolution dynamics of the laser spot-size and quality of the injected electron beam. We find that a pulse-length that is less than the theoretical optimum, {tau}{sub L} = {lambda}{sub p}/{radical}2{pi}c, derived from linear theory, gives the best beam quality. Conversely, our simulations suggest that for a given laser system, with a fixed pulse-length, there is an optimal value of the plasma density that will give the best quality accelerated beams in experiments. For an rms pulse-length of 10 fs (around 24 fs FWHM), this corresponds to a plasma density of around 3.4 Multiplication-Sign 10{sup 18}/cm{sup 3}. For these parameters, we obtain, in a homogenous plasma and with a single laser, an electron beam with an energy of around 700 MeV, an energy-spread less than 2%, and rms normalized emittance of a few {pi} mm-mrad.

  15. In situ measurements of a homogeneous to heterogeneous transition in the plastic response of ion-irradiated Ni microspecimens

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

    Zhao, Xinyu; Strickland, Daniel J.; Derlet, Peter M.; He, Mo-rigen; Cheng, You -Jung; Pu, Jue; Stanford Univ., Stanford, CA; Hattar, Khalid; Gianola, Daniel S.

    2015-02-11

    We report on the use of quantitative in situ microcompression experiments in a scanning electron microscope to systematically investigate the effect of self-ion irradiation damage on the full plastic response of Ni. In addition to the well-known irradiationinduced increases in the yield and flow strengths with increasing dose, we measure substantial changes in plastic flow intermittency behavior, manifested as stress drops accompanying energy releases as the driven material transits critical states. At low irradiation doses, the magnitude of stress drops reduces relative to the unirradiated material and plastic slip proceeds on multiple slip systems, leading to quasi-homogeneous plastic flow.more »In contrast, highly irradiated specimens exhibit pronounced shear localization on parallel slip planes, which we ascribe to the onset of defect free channels normally seen in bulk irradiated materials. Our in situ testing system and approach allows for a quantitative study of the energy release and dynamics associated with defect free channel formation and subsequent localization. As a result, this study provides fundamental insight to the nature of interactions between mobile dislocations and irradiation-mediated and damage-dependent defect structures.« less

  16. In situ measurements of a homogeneous to heterogeneous transition in the plastic response of ion-irradiated <111> Ni microspecimens

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

    Zhao, Xinyu; Strickland, Daniel J.; Derlet, Peter M.; He, Mo-rigen; Cheng, You -Jung; Pu, Jue; Stanford Univ., Stanford, CA; Hattar, Khalid; Gianola, Daniel S.

    2015-02-11

    We report on the use of quantitative in situ microcompression experiments in a scanning electron microscope to systematically investigate the effect of self-ion irradiation damage on the full plastic response of <111> Ni. In addition to the well-known irradiationinduced increases in the yield and flow strengths with increasing dose, we measure substantial changes in plastic flow intermittency behavior, manifested as stress drops accompanying energy releases as the driven material transits critical states. At low irradiation doses, the magnitude of stress drops reduces relative to the unirradiated material and plastic slip proceeds on multiple slip systems, leading to quasi-homogeneous plastic flow.more » In contrast, highly irradiated specimens exhibit pronounced shear localization on parallel slip planes, which we ascribe to the onset of defect free channels normally seen in bulk irradiated materials. Our in situ testing system and approach allows for a quantitative study of the energy release and dynamics associated with defect free channel formation and subsequent localization. As a result, this study provides fundamental insight to the nature of interactions between mobile dislocations and irradiation-mediated and damage-dependent defect structures.« less

  17. December 4, 2008; HSS/Union Working Group Meeting on 2008 HSS/Union Topical Wrap Up - PRIORITY NEAR-TERM ACTION OVERVIEW

    Energy Savers [EERE]

    Topical Wrap-Up Meeting December 4, 2008 PRIORITY NEAR-TERM ACTION OVERVIEW Background: Union representatives who participated in the initial 2007 HSS Focus Group meetings agreed to a path forward in which various unions combined to form working groups to address union identified health and safety issues by topical area. 2008 meetings were held to specifically address the topical areas of interest and concern related to worker health and safety at DOE sites: Training, 851 Rule Implementation,

  18. Tests of a Prototype for Assessing the Field Homogeneity of the Iseult/Inumac 11.7T Whole Body MRI Magnet

    SciTech Connect (OSTI)

    Quettier, Lionel

    2010-06-01

    A neuroscience research center with very high field MRI equipments has been opened in November 2006 by the CEA life science division. One of the imaging systems will require a 11.75 T magnet with a 900 mm warm bore, the so-call Iseult/Inumac magnet. Regarding the large aperture and field strength, this magnet is a challenge as compared to the largest MRI systems ever built, and is then developed within an ambitious R&D program. With the objective of demonstrating the possibility of achieving field homogeneity better than 1 ppm using double pancake windings, a 24 double pancakes model coil, working at 1.5 T has been designed. This model magnet has been manufactured by Alstom MSA and tested at CEA. It has been measured with a very high precision, in order to fully characterize the field homogeneity, and then to investigate and discriminate the parameters that influence the field map. This magnet has reached the bare magnet field homogeneity specification expected for Iseult and thus successfully demonstrated the feasibility of building a homogenous magnet with the double pancake winding technique.

  19. A Summary of Fault Recurrence and Strain Rates in the Vicinity of the Hanford Site--Topical Report

    SciTech Connect (OSTI)

    Bjornstad, Bruce N.; Winsor, Kelsey; Unwin, Stephen D.

    2012-08-01

    This document is one in a series of topical reports compiled by the Pacific Northwest National Laboratory to summarize technical information on selected topics important to the performance of a probabilistic seismic hazard analysis of the Hanford Site. The purpose of this report is to summarize available data and analyses relevant to fault recurrence and strain rates within the Yakima Fold Belt. Strain rates have met with contention in the expert community and may have a significant potential for impact on the seismic hazard estimate at the Hanford Site. This report identifies the alternative conceptual models relevant to this technical issue and the arguments and data that support those models. It provides a brief description of the technical issue and principal uncertainties; a general overview on the nature of the technical issue, along with alternative conceptual models, supporting arguments and information, and uncertainties; and finally, suggests some prospective approaches to reducing uncertainties about earthquake recurrence rates for the Yakima Fold Belt.

  20. Covariance statistics of turbulence velocity components for wind-energy-conversion system design-homogeneous, isotropic case

    SciTech Connect (OSTI)

    Fichtl, G.H.

    1983-09-01

    When designing a wind energy converison system (WECS), it may be necessary to take into account the distribution of wind across the disc of rotation. The specific engineering applications include structural strength, fatigue, and control. This wind distribution consists of two parts, namely that associated with the mean wind profile and that associated with the turbulence velocity fluctuation field. The work reported herein is aimed at the latter, namely the distribution of turbulence velocity fluctuations across the WECS disk of rotation. A theory is developed for the two-time covariance matrix for turbulence velocity vector components for wind energy conversion system (WECS) design. The theory is developed for homogeneous and iotropic turbulance with the assumption that Taylor's hypothesis is valid. The Eulerian turbulence velocity vector field is expanded about the hub of the WECS. Formulae are developed for the turbulence velocity vector component covariance matrix following the WECS blade elements. It is shown that upon specification of the turbulence energy spectrum function and the WECS rotation rate, the two-point, two-time covariance matrix of the turbulent flow relative to the WECS bladed elements is determined. This covariance matrix is represented as the sum of nonstationary and stationary contributions. Generalized power spectral methods are used to obtain two-point, double frequency power spectral density functions for the turbulent flow following the blade elements. The Dryden turbulence model is used to demonstrate the theory. A discussion of linear system response analysis is provided to show how the double frequency turbulence spectra might be used to calculate response spectra of a WECS to turbulent flow. Finally the spectrum of the component of turbulence normal to the WECS disc of rotation, following the blade elements, is compared with experimental results.