Typical topics for lectures and posters include: biochemical and biophysical characterization of new metal containing proteins, enzymes, nucleic acids, factors, and chelators from all forms of life; synthesis, detailed characterization, and reaction chemistry of biomimetic compounds; novel crystal and solution structures of biological molecules and synthetic metal-chelates; discussions of the roles that metals play in medicine, maintenance of the environment, and biogeochemical processes; metal homeostasis; application of theory and computations to the structure and mechanism of metal-containing biological systems; and novel applications of spectroscopy to metals in biological systems.

Beryllium is a strategic metal, indispensable for national defense programs in aerospace, telecommunications, electronics, and weaponry. Exposure to beryllium is an extensively documented occupational hazard that causes irreversible, debilitating granulomatous lung disease in as much as 3 - 5% of exposed workers. Mechanistic research on beryllium exposure-disease relationships has been severely limited by a general lack of a sufficient CBD animal model. We have now developed and tested an animal model which can be used for dissecting dose-response relationships and pathogenic mechanisms and for testing new diagnostic and treatment paradigms. We have created 3 strains of transgenic mice in which the human antigen-presenting moiety, HLA-DP, was inserted into the mouse genome. Each mouse strain contains HLA-DPB1 alleles that confer different magnitude of risk for chronic beryllium disease (CBD): HLA-DPB1*0401 (odds ratio = 0.2), HLA-DPB1*0201 (odds ratio = 15), HLA-DPB1*1701 (odds ratio = 240). Our preliminary work has demonstrated that the *1701 allele, as predicted by human studies, results in the greatest degree of sensitization in a mouse ear swelling test. We have also completed dose-response experiments examining beryllium-induced lung granulomas and identified susceptible and resistant inbred strains of mice (without the human transgenes) as well as quantitative trait loci that …

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Savannah River National Laboratory (SRNL) performed experiments on qualification material for use in the Interim Salt Disposition Program (ISDP) Batch 6 processing. This qualification material was a set of six samples from Tank 21H in October 2012. This sample was used as a real waste demonstration of the Actinide Removal Process (ARP) and the Extraction-Scrub-Strip (ESS) tests process. The Tank 21H sample was contacted with a reduced amount (0.2 g/L) of MST and characterized for strontium and actinide removal at 0 and 8 hour time intervals in this salt batch. {sup 237}Np and {sup 243}Am were both observed to be below detection limits in the source material, and so these results are not reported in this report. The plutonium and uranium samples had decontamination factor (DF) values that were on par or slightly better than we expected from Batch 5. The strontium DF values are slightly lower than expected but still in an acceptable range. The Extraction, Scrub, and Strip (ESS) testing demonstrated cesium removal, stripping and scrubbing within the acceptable range. Overall, the testing indicated that cesium removal is comparable to prior batches at MCU.

Shape analysis plays an important role in many applications. In particular, in molecular biology, analyzing molecular shapes is essential to the fundamental problem of understanding how molecules interact. This project aims at developing efficient and effective algorithms to characterize and analyze molecular structures using geometric and topological methods. Two main components of this project are (1) developing novel molecular shape descriptors; and (2) identifying and representing meaningful features based on those descriptors. The project also produces accompanying (visualization) software. Results from this project (09/2006–10/2009) include the following publications. We have also set up web-servers for the software developed in this period, so that our new methods are accessible to a broader scientific community. The web sites are given below as well. In this final technical report, we first list publications and software resulted from this project. We then briefly explain the research conducted and main accomplishments during the period of this project.

With international efforts to limit anthropogenic carbon in the atmosphere, various CO{sub 2} sequestration methods have been studied by various facilities worldwide. Basalt rock in general has been referred to as potential host material for mineral carbonation by various authors, without much regard for compositional variations due to depositional environment, subsequent metamorphism, or hydrothermal alteration. Since mineral carbonation relies on the presence of certain magnesium, calcium, or iron silicates, it is necessary to study the texture, mineralogy, petrology, and geochemistry of specific basalts before implying potential for mineral carbonation. The development of a methodology for the characterization of basalts with respect to their susceptibility for mineral carbonation is proposed to be developed as part of this research. The methodology will be developed based on whole rock data, petrography and microprobe analyses for samples from the Caledonia Mine in Michigan, which is the site for a proposed small-scale demonstration project on mineral carbonation in basalt. Samples from the Keweenaw Peninsula will be used to determine general compositional trends using whole rock data and petrography. Basalts in the Keweenaw Peninsula have been subjected to zeolite and prehnite-pumpellyite facies metamorphism with concurrent native copper deposition. Alteration was likely due to the circulation of …

Methods and algorithms are developed to enable the accurate analysis of problems that exhibit interacting physical processes with uncertainties. These uncertainties can pertain either to each of the physical processes or to the manner in which they depend on each others. These problems are cast within a polynomial chaos framework and their solution then involves either solving a large system of algebraic equations or a high dimensional numerical quadrature. In both cases, the curse of dimensionality is manifested. Procedures are developed for the efficient evaluation of the resulting linear equations that advantage of the block sparse structure of these equations, resulting in a block recursive Schur complement construction. In addition, embedded quadratures are constructed that permit the evaluation of very high-dimensional integrals using low-dimensional quadratures adapted to particular quantities of interest. The low-dimensional integration is carried out in a transformed measure space in which the quantity of interest is low-dimensional. Finally, a procedure is also developed to discover a low-dimensional manifold, embedded in the initial high-dimensional one, in which scalar quantities of interest exist. This approach permits the functional expression of the reduced space in terms of the original space, thus permitting cross-scale sensitivity analysis.

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The objectives of the confirmatory activities were to provide independent contractor field data reviews and to generate independent radiological data for use by the NRC in evaluating the adequacy and accuracy of the contractor�s procedures and FSS results. ORAU reviewed ABB CE�s decommissioning plan, final status survey plan, and the applicable soil DCGLs, which were developed based on an NRC-approved radiation dose assessment. The surveys include gamma surface scans, gamma direct measurements, and soil sampling.

Summary of research carried out under Interagency Agreement DE-AI02-07ER64355 with the USDA Forest Service at the Howland Forest AmeriFlux site in central Maine. Includes a list of publications resulting in part or whole from this support.

The purpose of the Caldwell Ranch Exploration and Confirmation Project was to drill, test, and confirm the present economic viability of the undeveloped geothermal reservoir in the 870 acre Caldwell Ranch area of the Northwest Geysers that included the CCPA No.1 steam field. All of the drilling, logging, and sampling challenges were met. � Three abandoned wells, Prati 5, Prati 14 and Prati 38 were re-opened and recompleted to nominal depths of 10,000 feet in 2010. Two of the wells required sidetracking. � The flow tests indicated Prati 5 Sidetrack 1 (P-5 St1), Prati 14 (P-14) and Prati 38 Sidetrack 2 (P-38 St2) were collectively capable of initially producing an equivalent of 12 megawatts (MWe) of steam using a conversion rate of 19,000 pounds of steam/hour

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The project investigated the development and improvement process of a R744 (CO2) commercial heat pump water heater (HPWH) package of approximately 35 kW. The improvement process covered all main components of the system. More specific the heat exchangers (Internal heat exchanger, Evaporator, Gas cooler) as well as the expansion device and the compressor were investigated. In addition, a comparison to a commercially available baseline R134a unit of the same capacity and footprint was made in order to compare performance as well as package size reduction potential.

This study examines how existing U.S. refining infrastructure matches in geography and processing capability with the needs projected from anticipated biofuels production. Key findings include:  a potential shortfall in both overall hydrotreating capacity and hydrogen production capacity in refineries to manage the conversion of certain bio-derived feedstocks having high oxygen contents;  a regional concentration of anticipated biofuel resources, placing added stress in particular refining regions (e.g. the Gulf Coast);  uncertainties surrounding the impact of bio-derived fuel intermediates on the refiner’s ability to meet product performance and product quantity demands, and the need for better and more comprehensive chemical composition information;  the need for considerably more data and experience on the behavior of projected biofuels feedstocks in refining processes (e.g. impacts on process performance and reliability);  and the need to examine the optimum capital investment locations for additional processing equipment. For example, whether it is better to further refine biofuels at the new production sites, in centralized biofuel "depots", or whether the existing refining facilities should be expanded to better handle a more 'raw' biofuel.

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A mainstay pump for tritium systems, the Normetex scroll pump, is currently unavailable because the Normetex company went out of business. This pump was an all-metal scroll pump that served tritium processing facilities very well. Current tritium system operators are evaluating replacement pumps for the Normetex pump and for general used in tritium service. An all-metal equivalent alternative to the Normetex pump has not yet been identified. 1. The ideal replacement tritium pump would be hermetically sealed and contain no polymer components or oils. Polymers and oils degrade over time when they contact ionizing radiation. 2. Halogenated polymers (containing fluorine, chlorine, or both) and oils are commonly found in pumps. These materials have many properties that surpass those of hydrocarbon-based polymers and oils, including thermal stability (higher operating temperature) and better chemical resistance. Unfortunately, they are less resistant to degradation from ionizing radiation than hydrocarbon-based materials (in general). 3. Polymers and oils can form gaseous, condensable (HF, TF), liquid, and solid species when exposed to ionizing radiation. For example, halogenated polymers form HF and HCl, which are extremely corrosive upon reaction with water. If a pump containing polymers or oils must be used in a tritium system, the system must …

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The U.S. Department of Energy (DOE) requested that Oak Ridge Associated Universities (ORAU), via the Oak Ridge Institute for Science and Education (ORISE) contract, perform independent sampling and analysis of used oils contained within eight 55 gallon drums stored at the former IMPACT Services facility, located at the East Tennessee Technology Park in Oak Ridge, Tennessee. These drums were originally delivered by LATA Sharp Remediation Services (LSRS) to IMPACT Services on January 11, 2011 as part of the Bldg. K-33 demolition project, and the drums plus contents should have been processed as non-hazardous non-radiological waste by IMPACT Services. LSRS received a certificate of destruction on August 29, 2012 (LSRS 2012a). However, IMPACT Services declared bankruptcy and abandoned the site later in 2012, and eight of the original eleven K-33 drums are currently stored at the facility. The content of these drums is the subject of this investigation. The original drum contents were sampled by LSRS in 2010 and analyzed for gross alpha, gross beta, and polychlorinated biphenyls (PCBs), using both compositing and grab sampling techniques. The objective of this 2013 sample and analysis effort was to duplicate, to the extent possible, the 2010 sampling and analysis event to support final …