The U.S. Department of Energy (DOE) is cleaning up and/or monitoring large, dilute plumes contaminated by metals, such as uranium and chromium, whose mobility and solubility change with redox status. Field-scale experiments with acetate as the electron donor have stimulated metal-reducing bacteria to effectively remove uranium [U(VI)] from groundwater at the Uranium Mill Tailings Site in Rifle, Colorado. The Pacific Northwest National Laboratory and a multidisciplinary team of national laboratory and academic collaborators has embarked on a research proposed for the Rifle site, the object of which is to gain a comprehensive and mechanistic understanding of the microbial factors and associated geochemistry controlling uranium mobility so that DOE can confidently remediate uranium plumes as well as support stewardship of uranium-contaminated sites. This Quality Assurance Project Plan provides the quality assurance requirements and processes that will be followed by the Rifle Integrated Field-Scale Subsurface Research Challenge Project.

This document describes a model for condensation of sulfuric acid aerosol given an initial concentration and/or source of gaseous sulfur trioxide (e.g. fuming from oleum). The model includes the thermochemical effects on aerosol condensation and air parcel buoyancy. Condensation is assumed to occur heterogeneously onto a preexisting background aerosol distribution. The model development is both a revisiting of research initially presented at the Fall 2001 American Geophysical Union Meeting [1] and a further extension to provide new capabilities for current atmospheric dispersion modeling efforts [2]. Sulfuric acid is one of the most widely used of all industrial chemicals. In 1992, world consumption of sulfuric acid was 145 million metric tons, with 42.4 Mt (mega-tons) consumed in the United States [10]. In 2001, of 37.5 Mt consumed in the U.S., 74% went into producing phosphate fertilizers [11]. Another significant use is in mining industries. Lawuyi and Fingas [7] estimate that, in 1996, 68% of use was for fertilizers and 5.8% was for mining. They note that H{sub 2}SO{sub 4} use has been and should continue to be very stable. In the United States, the elimination of MTBE (methyl tertiary-butyl ether) and the use of ethanol for gasoline production are further increasing …

The Physical Sciences Directorate applies frontier physics and technology to grand challenges in national security. Our highly integrated and multidisciplinary research program involves collaborations throughout Lawrence Livermore National Laboratory, the National Nuclear Security Administration, the Department of Energy, and with academic and industrial partners. The Directorate has a budget of approximately $150 million, and a staff of approximately 350 employees. Our scientists provide expertise in condensed matter and high-pressure physics, plasma physics, high-energy-density science, fusion energy science and technology, nuclear and particle physics, accelerator physics, radiation detection, optical science, biotechnology, and astrophysics. This document highlights the outstanding research and development activities in the Physical Sciences Directorate that made news in 2007. It also summarizes the awards and recognition received by members of the Directorate in 2007.

P. fluorescens PfO-1 is a soil bacterium isolated by this laboratory from sandy loam soil (4). Because of the importance of adhesion for persistence in natural environments, we utilized adherence to sand as an assay to screen a library of PfO-1 mutants for defects in adhesion. Three adhesion defective mutants, PfO-5, PfO-10, and PfO-15 were recovered. PfO-5 and PfO-10 had different insertions in the same gene, which we called adnA, and also showed motility defects (3). PfO-15 was motile, but was hyper-flagellated. The insertion was in a different gene, adnB, which shows similarity to mot genes involved in flagella functions (Strain and Levy, unpublished). These early studies demonstrated the important but separable requirements for flagella and motility in adherence. In a field study, the adnA mutant PfO-5 was less able to persist than the wildtype PfO-1 and did not spread as fast or as far from the point of inoculation as did PfO-1 (7), linking adhesion and soil fitness. DNA sequencing revealed that AdnA shares 82% identity with the flagella regulator FleQ from P. aeruginosa (3). FleQ is required for adhesion of P. aeruginosa to respiratory mucin, which is important for pathogenesis (1, 2). Using a gene fusion approach, seven …

The project was to develop cryostat designs that could be used for muon beam cooling channels where hydrogen would circulate through refrigerators and the beam-cooling channel to simultaneously refrigerate 1) high-temperature-superconductor (HTS) magnet coils, 2) cold copper RF cavities, and 3) the hydrogen that is heated by the muon beam. In an application where a large amount of hydrogen is naturally present because it is the optimum ionization cooling material, it was reasonable to explore its use with HTS magnets and cold, but not superconducting, RF cavities. In this project we developed computer programs for simulations and analysis and conducted experimental programs to examine the parameters and technological limitations of the materials and designs of Helical Cooling Channel (HCC) components (magnet conductor, RF cavities, absorber windows, heat transport, energy absorber, and refrigerant).The project showed that although a hydrogen cryostat is not the optimum solution for muon ionization cooling channels, the studies of the cooling channel components that define the cryostat requirements led to fundamental advances. In particular, two new lines of promising development were opened up, regarding very high field HTS magnets and the HS concept, that have led to new proposals and funded projects.

We applied a spectrum of uncertainty quantification (UQ) techniques to the study of a two-dimensional soil-foundation-structure-interaction (2DSFSI) system (obtained from Professor Conte at UCSD) subjected to earthquake excitation. In the process we varied 19 uncertain parameters describing material properties of the structure and the soil. We present in detail the results for the different stages of our UQ analyses.

City of Rialto, Well No.3 Demonstration System Integration Project, and Baldwin Park Operable Unit, Baldwin Park, California. The groundwater remediation contractors are AMEC Geomatrix and ARA. The sites were visited on July 22, 2008. Fluor Hanford and the U.S. Department of Energy are currently looking at a variety of alternatives to capture carbon tetrachloride, nitrates, and other COCs from 200-ZP-l groundwater. A few of the more important objectives of our visits were to: (1) Evaluate the treatment systems being used by AMEC Geomatrix to address VOCs, perchlorate, NDMA, 1,4,-Dioxane, and 1,2,3 TCP in a drinking water source; (2) Evaluate how effective these treatment methods have been; (3) Determine the types of problems they have encountered with these treatment systems and how they addressed these problems; (4) Determine the types of secondary wastes being generated by the system; (5) Determine how clean of an operation these companies run; and (6) Determine if the site is worth being visited by DOE-RL at a later date.

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Over the period of this sponsored research, UDRI performed a number of materials related tasks that helped to facilitate increased understanding of the properties and applications of a number of candidate program related materials including; effects of neutron irradiation on tantalum alloys using a 500kW reactor, thermodynamic based modeling of the chemical species in weld pools, and the application of candidate coatings for increased oxidation resistance of FWPF (Fine Weave Pierced Fabric) modules.

We have developed a highly accurate computational capability to calculate the equation of state (EOS) and defect formation energies of metallic systems. We are using a newly developed algorithm that enables the study of metallic systems with quantum Monte Carlo (QMC) methods. To date, technical limitations have restricted the application of QMC methods to semiconductors, insulators and the homogeneous electron gas. Using this new 'QMC for metals' we can determine, for the first time, the significance of correlation effects in the EOS and in the formation energies of point defects, impurities, surfaces and interfaces in metallic systems. These calculations go beyond the state-of-the-art accuracy which is currently obtained with Density Functional Theory approaches. Such benchmark calculations can provide more accurate predictions for the EOS and the formation energies of vacancies and interstitials in simple metals. These are important parameters in determining the mechanical properties as well as the micro-structural evolution of metals in irradiated materials or under extreme conditions. We describe the development of our 'QMC for metals' code, which has been adapted to run efficiently on a variety of computer architectures including BG/L. We present results of the first accurate quantum Monte Carlo calculation of an EOS of a …

In this final report in the field of theoretical nuclear physics we note important accomplishments.We were confronted with "anomoulous" magnetic moments by the experimetalists and were able to expain them. We found unexpected partial dynamical symmetries--completely unknown before, and were able to a large extent to expain them.The importance of a self consistent shell model was emphasized.

The first objective of this proposal was to develop a fundamental understanding of how short-pulse (100 ps to 1 ns) laser parameters affect conditioning and damage initiation in KDP and DKDP crystals. In this study we experimentally determine the effect of short-pulse laser parameters including pulse duration, pulse shape, and fluence on conditioning effectiveness, pinpoint damage density, pinpoint size, and pinpoint morphology in crystals. Based on the experimental results we developed empirical models, which give insight into the underlying physics of energy deposition from short-pulse lasers in KDP and DKDP crystals. The second objective of this proposal was to explore the mechanisms by which energy is deposited during damage in SiO{sub 2}. We have measured how laser parameters such as pulse duration, pulse shape, wavelength, and fluence are relevant to energy deposition, for initiation and growth on the surface of SiO{sub 2} optics.

The increased need to manage California?s electricity grid in real time is a result of the ongoing transition from a system operated by vertically-integrated utilities serving native loads to one operated by an independent system operator supporting competitive energy markets. During this transition period, the traditional approach to reliability management -- construction of new transmission lines -- has not been pursued due to unresolved issues related to the financing and recovery of transmission project costs. In the absence of investments in new transmission infrastructure, the best strategy for managing reliability is to equip system operators with better real-time information about actual operating margins so that they can better understand and manage the risk of operating closer to the edge. A companion strategy is to address known deficiencies in offline modeling tools that are needed to ground the use of improved real-time tools. This project: (1) developed and conducted first-ever demonstrations of two prototype real-time software tools for voltage security assessment and phasor monitoring; and (2) prepared a scoping study on improving load and generator response models. Additional funding through two separate subsequent work authorizations has already been provided to build upon the work initiated in this project.

The effect of Oxygen on (Nb1Zr)3Sn multifilament conductors manufactured by the Mono Element Internal Tin (MEIT) process was explored to improve the current density by refining the grain size. This followed work first done by General Electric on the Nb3Sn tape process. Techniques to fabricate the more difficult Nb1Zr composites are described and allowed fabrication of long lengths of .254 mm diameter wire from an 88.9 mm diameter billet. Oxygen was incorporated through the use of SnO2 mixed with tin powder and incorporated into the core. These were compared to samples with Ti+Sn and Cu+Sn cores. Heat treatments covered the range of 700 C to 1000 C. Current density vs. H, grain size, and reaction percentages are provided for the materials tested. The Oxygen gave superior results in the temperature range of 815-1000 C. It also stabilized the filament geometry of the array in comparison to the other additions at the higher temperatures. At 815 C a peak in layer Jc yielded values of 2537 A/mm2 at 12 T and 1353 A/mm2 at 15T, 8-22% and 30-73% greater respectively than 700 C values. Results with Oxygen at high temperature show the possibility of high speed continuous reaction of the composite …

The Petascale Simulation Initiative LDRD project began in May 2004 and ended in April 2007. The overall goal of the project was to develop a computational model that would help LLNL simulation codes use petaflop-scale computers effectively, with specific emphasis on multiscale simulation. An early deliverable of the project was a report that surveyed a range of LLNL simulation codes so that the project would better understand their structure and needs. This report was titled 'Survey of Selected LLNL Unclassified Parallel Simulation Codes', UCRL-TR-207192. Based on the findings of this report, the project proceeded along two complementary paths. One goal was to develop a technique to reduce the amount of redundant calculation in a multiscale simulation by caching certain fine-scale simulation results as they were generated and then interpolating new values, where appropriate, based on cached data. This technique, which we call 'Adaptive Sampling', was successfully applied in a materials modeling simulation, and the results are detailed in a journal paper entitled 'Embedded polycrystal plasticity and adaptive sampling', UCRL-JRNL-226715. In this paper we showed an example multiscale simulation in which we were able to achieve a 40x speedup over the standard technique for doing the same problem and with very …

The program established a collaborative process with domestic industries for the purpose of sharing Navy-developed technology. Private sector businesses were educated so as to increase their awareness of the vast amount of technologies that are available, with an initial focus on technology applications that are related to the Hydrogen, Fuel Cells and Infrastructure Technologies (Hydrogen) Program of the U.S. Department of Energy. Specifically, the project worked to increase industry awareness of the vast technology resources available to them that have been developed with taxpayer funding. NAVSEA-Carderock and the Houston Advanced Research Center teamed with Nicholls State University to catalog NAVSEA-Carderock unclassified technologies, rated the level of readiness of the technologies and established a web based catalog of the technologies. In particular, the catalog contains technology descriptions, including testing summaries and overviews of related presentations.

During 2007 and 2008, a new Multi-Probe Corrosion Monitoring System (MPCMS) was designed and fabricated for use in double-shell tank 241-AN-102. The system was successfully installed in the tank on May 1, 2008. The 241-AN-102 MPCMS consists of one 'fixed' in-tank probe containing primary and secondary reference electrodes, tank material electrodes, Electrical Resistance (ER) sensors, and stressed and unstressed corrosion coupons. In addition to the fixed probe, the 241-AN-102 MPCMS also contains four standalone coupon racks, or 'removable' probes. Each rack contains stressed and unstressed coupons made of American Society of Testing and Materials A537 CL1 steel, heat-treated to closely match the chemical and mechanical characteristics of the 241-AN-102 tank wall. These coupon racks can be removed periodically to facilitate examination of the attached coupons for corrosion damage. Along the way to successful system deployment and operation, the system design, fabrication, and testing activities presented a number of challenges. This document discusses these challenges and lessons learned, which when applied to future efforts, should improve overall project efficiency.

The Liquid Waste Organization (LWO) has requested that the Savannah River National Laboratory (SRNL) to assess the impact of a 100K gallon decant volume from Tank 40H on the existing sludge-only Sludge Batch 4 (SB4)-Frit 510 flowsheet and the coupled operations flowsheet (SB4 with the Actinide Removal Process (ARP)). Another potential SB4 flowsheet modification of interest includes the addition of 3 wt% sodium (on a calcined oxide basis) to a decanted sludge-only or coupled operations flowsheet. These potential SB4 flowsheet modifications could result in significant compositional shifts to the SB4 system. This paper study provides an assessment of the impact of these compositional changes to the projected glass operating windows and to the variability study for the Frit 510-SB4 system. The influence of the compositional changes on melt rate was not assessed in this study nor was it requested. Nominal Stage paper study assessments were completed using the projected compositions for the various flowsheet options coupled with Frit 510 (i.e., variation was not applied to the sludge and frit compositions). In order to gain insight into the impacts of sludge variation and/or frit variation (due to the procurement specifications) on the projected operating windows, three versions of the Variation Stage …

We present a framework for de Sitter model building in type IIA string theory, illustrated with specific examples. We find metastable dS minima of the potential for moduli obtained from a compactification on a product of two Nil three-manifolds (which have negative scalar curvature) combined with orientifolds, branes, fractional Chern-Simons forms, and fluxes. As a discrete quantum number is taken large, the curvature, field strengths, inverse volume, and four dimensional string coupling become parametrically small, and the de Sitter Hubble scale can be tuned parametrically smaller than the scales of the moduli, KK, and winding mode masses. A subtle point in the construction is that although the curvature remains consistently weak, the circle fibers of the nilmanifolds become very small in this limit (though this is avoided in illustrative solutions at modest values of the parameters). In the simplest version of the construction, the heaviest moduli masses are parametrically of the same order as the lightest KK and winding masses. However, we provide a method for separating these marginally overlapping scales, and more generally the underlying supersymmetry of the model protects against large corrections to the low-energy moduli potential.

This data package discusses the geochemistry of vadose zone sediments beneath the single-shell tank (SST) farms at the U.S. Department of Energy’s (DOE’s) Hanford Site. The purpose of the report is to provide a review of the most recent and relevant geochemical information available for the vadose zone beneath the SST farms and the Integrated Disposal Facility (IDF).

The Nanoscale Synthesis and Characterization Laboratory's (NSCL) primary mission is to create and advance interdisciplinary research and development opportunities in nanoscience and technology. The NSCL is delivering on its mission providing Laboratory programs with scientific solutions through the use of nanoscale synthesis and characterization. While this annual report summarizes 2007 activities, we have focused on nanoporous materials, advanced high strength, nanostructured metals, novel 3-dimensional lithography and characterization at the nanoscale for the past 3 years. In these three years we have synthesized the first monolithic nanoporous metal foams with less than 10% relative density; we have produced ultrasmooth nanocrystalline diamond inertial confinement fusion capsules; we have synthesized 3-dimensional graded density structures from full density to 5% relative density using nanolithography; and we have established ultrasmall angle x-ray scattering as a non-destructive tool to determine the structure on the sub 300nm scale. The NSCL also has a mission to recruit and to train personnel for Lab programs. The NSCL continues to attract talented scientists to the Laboratory. Andrew Detor from Massachusetts Institute of Technology, Sutapa Ghosal from the University of California, Irvine, Xiang Ying Wang from Shanghai Institute of Technology, and Arne Wittstock from University of Bremen joined the NSCL this …

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Liquid-metal-cooled fast reactors in the form of sodium-cooled fast reactors have been successfully built and tested in the U.S. and throughout the world. However, no fast reactor has operated in the U.S. for nearly fourteen years. More importantly, the U.S. has not constructed a fast reactor in nearly 30 years. In addition to reestablishing the necessary industrial infrastructure, the development, testing, and licensing of a new, advanced fast reactor concept will likely require a significant base technology program that will rely more heavily on modeling and simulation than has been done in the past. The ability to quantify uncertainty in modeling and simulations will be an important part of any experimental program and can provide added confidence that established design limits and safety margins are appropriate. In addition, there is an increasing demand from the nuclear industry for best-estimate analysis methods to provide confidence bounds along with their results. The ability to quantify uncertainty will be an important component of modeling that is used to support design, testing, and experimental programs. Three avenues of UQ investigation are proposed. Two relatively new approaches are described which can be directly coupled to simulation codes currently being developed under the Advanced Simulation and …

Carbon capture and storage (CCS) could become an instrumental part of a future carbon trading system in the US. If the US starts operating an emissions trading scheme (ETS) similar to that of the European Union's then limits on CO{sub 2} emissions will be conservative in the beginning stages. The government will most likely start by distributing most credits for free; these free credits are called allowances. The US may follow the model of the EU ETS, which during the first five-year phase distributed 95% of the credits for free, bringing that level down to 90% for the second five-year phase. As the number of free allowances declines, companies will be forced to purchase an increasing number of credits at government auction, or else obtain them from companies selling surplus credits. In addition to reducing the number of credits allocated for free, with each subsequent trading period the number of overall credits released into the market will decline in an effort to gradually reduce overall emissions. Companies may face financial difficulty as the value of credits continues to rise due to the reduction of the number of credits available in the market each trading period. Governments operating emissions trading systems …