Inspection of United States-Department of Energy (US-DOE) model 9975 nuclear materials shipping package revealed corrosion of the lead shielding that was induced by off-gas constituents from organic components in the package. Experiments were performed to determine the corrosion rate of lead when exposed to off-gas or degradation products of these organic materials. The results showed that the room temperature vulcanizing (RTV) sealant was the most corrosive organic species used in the construction of the packaging, followed by polyvinyl acetate (PVAc) glue. Fiberboard material, also used in the construction of the packaging induced corrosion to a much lesser extent than the PVAc glue and RTV sealant, and only in the presence of condensed water. The results indicated faster corrosion at temperatures higher than ambient and with condensed water. In light of these corrosion mechanisms, the lead shielding was sheathed in a stainless steel liner to mitigate against corrosion.

The dynamics of water molecules near the protein surface are different from those of bulk water and influence the structure and dynamics of the protein itself. To elucidate the temperature dependence hydration dynamics of water molecules, we present results from the molecular dynamic simulation of the water molecules surrounding two proteins (Carboxypeptidase inhibitor and Ovomucoid) at seven different temperatures (T=273 to 303 K, in increments of 5 K). Translational diffusion coefficients of the surface water and bulk water molecules were estimated from 2 ns molecular dynamics simulation trajectories. Temperature dependence of the estimated bulk water diffusion closely reflects the experimental values, while hydration water diffusion is retarded significantly due to the protein. Protein surface induced scaling of translational dynamics of the hydration waters is uniform over the temperature range studied, suggesting the importance protein-water interactions.

Amorphous metal and ceramic thermal spray coatings have been developed that can be used to enhance the corrosion resistance of containers for the transportation, aging and disposal of spent nuclear fuel and high-level radioactive wastes. Iron-based amorphous metal formulations with chromium, molybdenum and tungsten have shown the corrosion resistance believed to be necessary for such applications. Rare earth additions enable very low critical cooling rates to be achieved. The boron content of these materials, and their stability at high neutron doses, enable them to serve as high efficiency neutron absorbers for criticality control. The high boron content of Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} (SAM2X5) makes it an effective neutron absorber, and suitable for criticality control applications. Average measured values of the neutron absorption cross section in transmission ({Sigma}{sub t}) for Type 316L stainless steel, Alloy C-22, borated stainless steel, a Ni-Cr-Mo-Gd alloy, and SAM2X5 have been determined to be approximately 1.1, 1.3, 2.3, 3.8 and 7.1 cm{sup -1}, respectively.

Comets have long been proposed as a potential means for the transport of complex organic compounds to early Earth. For this to be a viable mechanism, a significant fraction of organic compounds must survive the high temperatures due to impact. We have undertaken three-dimensional numerical simulations to track the thermodynamic state of a comet during oblique impacts. The comet was modeled as a 1-km water-ice sphere impacting a basalt plane at 11.2 km/s; impact angles of 15{sup o} (from horizontal), 30{sup o}, 45{sup o}, 65{sup o}, and 90{sup o} (normal impact) were examined. The survival of organic cometary material, modeled as water ice for simplicity, was calculated using three criteria: (1) peak temperatures, (2) the thermodynamic phase of H{sub 2}O, and (3) final temperature upon isentropic unloading. For impact angles greater than or equal to 30{sup o}, no organic material is expected to survive the impact. For the 15{sup o} impact, most of the material survives the initial impact and significant fractions (55%, 25%, and 44%, respectively) satisfy each survival criterion at 1 second. Heating due to deceleration, in addition to shock heating, plays a role in the heating of the cometary material for nonnormal impacts. This effect is more …

An international experiment to demonstrate muon ionization cooling is scheduled for beam at Rutherford Appleton Laboratory (RAL) in 2007. The experiment comprises one cell of the Study II cooling channel [1], along with upstream and downstream detectors to identify individual muons and measure their initial and final 6D phase-space parameters to a precision of 0.1%. Magnetic design of the beam line and cooling channel are complete and portions are under construction. The experiment will be described, including cooling channel hardware designs, fabrication status, and running plans. Phase 1 of the experiment will prepare the beam line and provide detector systems, including time-of-flight, Cherenkov, scintillating-fiber trackers and their spectrometer solenoids, and an electromagnetic calorimeter. The Phase 2 system will add the cooling channel components, including liquid-hydrogen absorbers embedded in superconducting Focus Coil solenoids, 201-MHz normal-conducting RF cavities, and their surrounding Coupling Coil solenoids. The MICE Collaboration goal is to complete the experiment by 2010; progress toward this is discussed.

One of the goals of the Saltstone variability study is to identify the operational and compositional variables that control or influence the important processing and performance properties of Saltstone grout mixtures. One of those properties of importance is the Waste Loading (WL) of the decontaminated salt solution (DSS) in the Saltstone waste form. Waste loading is a measure of the amount of waste that can be incorporated within a waste form. The value of the Saltstone waste loading ultimately determines the number of vaults that will be required to disposition all of the DSS. In this report, the waste loading is defined as the volume in milliliters of DSS per liter of Saltstone waste form. The two most important parameters that determine waste loading for Saltstone are water to cementitious material (w/cm) ratio and the cured grout density. Data are provided that show the dependence of waste loading on the w/cm ratio for a fixed DSS composition using the current premix material (45% Blast Furnace Slag (BFS), 45% Fly Ash (FA) and 10% Ordinary Portland Cement (OPC)). The impact of cured grout density on waste loading was also demonstrated. Mixes (at 0.60 w/cm) made with a Modular Caustic side extraction …

A practical, functional group tolerant method for the Rh-catalyzed direct arylation of a variety of pharmaceutically important azoles with aryl bromides is described. Many of the successful azole and aryl bromide coupling partners are not compatible with methods for the direct arylation of heterocycles using Pd(0) or Cu(I) catalysts. The readily prepared, low molecular weight ligand, Z-1-tert-butyl-2,3,6,7-tetrahydrophosphepine, which coordinates to Rh in a bidentate P-olefin fashion to provide a highly active yet thermally stable arylation catalyst, is essential to the success of this method. By using the tetrafluoroborate salt of the corresponding phosphonium, the reactions can be assembled outside of a glove box without purification of reagents or solvent. The reactions are also conducted in THF or dioxane, which greatly simplifies product isolation relative to most other methods for direct arylation of azoles employing high-boiling amide solvents. The reactions are performed with heating in a microwave reactor to obtain excellent product yields in two hours.

We present the ongoing analysis of Lattice Quantum Chromodynamics runs on the LLNL BG/L supercomputer. This installment adds the density analysis of the p4rhmc for the first few thousand trajectories and the {psi} - bar{psi} history for hot and cold starts with two values of beta.

Linked CHEETAH is a thermo-chemical code coupled to a 2-D hydrocode. Initially, a quadratic-pressure dependent kinetic rate was used, which worked well in modeling prompt detonation of explosives of large size, but does not work on other aspects of explosive behavior. The variable-pressure Tarantula reactive flow rate model was developed with JWL++ in order to also describe failure and initiation, and we have moved this model into Linked CHEETAH. The model works by turning on only above a pressure threshold, where a slow turn-on creates initiation. At a higher pressure, the rate suddenly leaps to a large value over a small pressure range. A slowly failing cylinder will see a rapidly declining rate, which pushes it quickly into failure. At a high pressure, the detonation rate is constant. A sequential validation procedure is used, which includes metal-confined cylinders, rate-sticks, corner-turning, initiation and threshold, gap tests and air gaps. The size (diameter) effect is central to the calibration.

Amorphous metal and ceramic thermal spray coatings have been developed that can be used to enhance the corrosion resistance of containers for the transportation, aging and disposal of spent nuclear fuel and high-level radioactive wastes. Fe-based amorphous metal formulations with chromium, molybdenum and tungsten have shown the corrosion resistance believed to be necessary for such applications. Rare earth additions enable very low critical cooling rates to be achieved. The boron content of these materials, and their stability at high neutron doses, enable them to serve as high efficiency neutron absorbers for criticality control. Ceramic coatings may provide even greater corrosion resistance for container applications, though the boron-containing amorphous metals are still favored for criticality control applications. These amorphous metal and ceramic materials have been produced as gas atomized powders and applied as near full density, non-porous coatings with the high-velocity oxy-fuel process. This paper summarizes the performance of these coatings as corrosion-resistant barriers, and as neutron absorbers. Relevant corrosion models are also discussed, as well as a cost model to quantify the economic benefits possible with these new materials.

This report describes the results from RPP-PLAN-32738, 'Test Plan for the Effluent Treatment Facility to Reduce Chrome(VI) to Chrome(I1I) in the Secondary Waste Stream', using sodium metabisulfite. Appendix A presents the report as submitted by the Center for Laboratory Sciences (CLS) to CH2M HILL Hanford Group, Inc. The CLS carried out the laboratory effort under Contract Number 21065, release Number 30. This report extracts the more pertinent aspects of the laboratory effort.

More than 200 million liters (53 million gallons) of highly radioactive and hazardous waste is stored at the U.S. Department of Energy's Hanford Site in southeastern Washington State. The DOE's Hanford Site River Protection Project (RPP) mission includes tank waste retrieval, waste treatment, waste disposal, and tank farms closure activities. This mission will largely be accomplished by the construction and operation of three large treatment facilities at the Waste Treatment and Immobilization Plant (WTP): (1) a Pretreatment (PT) facility intended to separate the tank waste into High Level Waste (HLW) and Low Activity Waste (LAW); (2) a HLW vitrification facility intended to immobilize the HLW for disposal at a geologic repository in Yucca Mountain; and (3) a LAW vitrification facility intended to immobilize the LAW for shallow land burial at Hanford's Integrated Disposal Facility (IDF). The LAW facility is on target to be completed in 2014, five years prior to the completion of the rest of the WTP. In order to gain experience in the operation of the LAW vitrification facility, accelerate retrieval from single-shell tank (SST) farms, and hasten the completion of the LAW immobilization, it has been proposed to begin treatment of the low-activity waste five years before …

Our identification research for the past several years has focused on the problem of correctly discriminating small-magnitude explosions from a background of earthquakes, mining tremors, and other events. Small magnitudes lead to an emphasis on regional waveforms. The goal is to reduce the variance within the population of each type of event, while increasing the separation between the explosions and the other event types. We address this problem for both broad categories of seismic waves, body waves, and surface waves. First, we map out the effects of propagation and source size in advance so that they can be accounted for and removed from observed events. This can dramatically reduce the population variance. Second, we try to optimize the measurement process to improve the separation between population types. For body waves we focus on the identification power of the short-period regional phases Pn, Pg, Sn and Lg, and coda that can often be detected down to very small magnitudes. It is now well established that particular ratios of these phases, such as 6- to 8-Hz Pn/Lg, can effectively discriminate between closely located explosions and earthquakes. To extend this discrimination power over broad areas, we developed a revised Magnitude and Distance Amplitude …

This project has built a unique historic database of regional distance nuclear explosion, earthquake, and mine-related digital broadband seismograms for the western United States (US). The emphasis is on data from Lawrence Livermore National Laboratory (LLNL)-managed stations MNA, ELK, KNB and LAC that recorded many nuclear tests and nearby earthquakes in broadband digital form since 1980, along with a small number of earlier events that were digitized from tapes. Through the generous cooperation of Sandia National Laboratory (SNL) we have also included waveforms from their Leo Brady network (BMN, DWN, LDS, NEL,TON). In addition we include data from other open broadband stations in the western US with long operating histories and/or ties to the International Monitoring System (IMS) (e.g. PFO, YKA, CMB, NEW, DUG, ANMO, TUC). These waveforms are associated with a reconciled catalog of events and station response information to facilitate analysis. The goal is to create a high-quality database that can be used in the future to analyze fundamental regional monitoring issues such as detection, location, magnitude, and discrimination. In the first stage of the project, we collected six different regional network catalogs from the University of Nevada, Reno (UNR), to provide accurate independent location information for events …

ELECTRON DISSIPATION IN RECONNECTION Detailed comparisons are reported between laboratory observations of electron scale dissipation layers near a reconnecting X-line and direct two-dimensional full-particle simulations. Many experimental features of the electron layers, such as insensitivity to the ion mass, are reproduced by the simulations; the layer thickness, however, is about 3 - 5 times larger than the predictions. Consequently, the leading candidate 2D mechanism based on collisionless electron nongyrotropic pressure is insuffcient to explain the observed reconnection rates. These results suggest that, in addition to the residual collisions, 3D effects play an important role in electron-scale dissipation during fast reconnection.

The overall objective of this research was to determine the feasibility of recovering a very fine fraction of fly ash, that is 5 microns in diameter or less and examining the characteristics of these materials in new or at least less traditional applications. These applications included as a polymer filler or as a 'super' pozzolanic concrete additive. As part of the effort the ash from 6 power plants was investigated and characterized. This work included collection from ESP Hoppers and ponds. The ash was thoroughly characterized chemically and physically. Froth flotation was used to reduce the carbon and testing showed that flotation could effectively reduce carbon to acceptable levels (i.e. 0.5% LOI) for most of the substrates tested. in order to enable eventual use as fillers. Hydraulic classification was used in the separation of the fine ash from the coarse ash. Hydraulic classification requires the ash to be dispersed to be effective and a range of dispersants were tested for adsorption as well as sedimentation rate. A wide range of dosages were required (0.3 to 10 g/kg). In general the ponded ash required less dispersant. A model was developed for hydraulic classification. A pilot-scale hydraulic classifier was also designed and …

High-resolution array comparative genomic hybridization of 235 serous epithelial ovarian cancers demonstrated a regional increase at 3q26.2 encompassing SnoN/SkiL, a coregulator of SMAD/TGF{beta} signaling. SnoN RNA transcripts were elevated in {approx}80% of advanced stage serous epithelial ovarian cancers. In both immortalized normal (TIOSE) and ovarian carcinoma cell lines (OVCA), SnoN RNA levels were increased by TGF{beta} stimulation and altered by LY294002 and JNK II inhibitor treatment suggesting that the PI3K and JNK signaling pathways may regulate TGF{beta}-induced increases in SnoN RNA. In TIOSE, SnoN protein levels were reduced 15min post TGF{beta}-stimulation, likely by proteosome-mediated degradation. In contrast, in OVCA, SnoN levels were elevated 3h post-stimulation potentially as a result of inhibition of the proteosome. To elucidate the role of SnoN in ovarian tumorigenesis, we explored the effects of both increasing and decreasing SnoN levels. In both TIOSE and OVCA, SnoN siRNA decreased cell growth between 20 and 50% concurrent with increased p21 levels. In TIOSE, transient expression of SnoN repressed TGF{beta} induction of PAI-1 promoters with little effect on the p21 promoter or resultant cell growth. In contrast to the effects of transient expression, stable expression of SnoN in TIOSE led to growth arrest through induction of senescence. Collectively, these …

Moving beyond ITER toward a demonstration power reactor (Demo) will require the integration of stable high fusion gain in steady-state, advanced methods for dissipating very high divertor heat-fluxes, and adherence to strict limits on in-vessel tritium retention. While ITER will clearly address the issue of high fusion gain, and new and planned long-pulse experiments (EAST, JT60-SA, KSTAR, SST-1) will collectively address stable steady-state highperformance operation, none of these devices will adequately address the integrated heat-flux, tritium retention, and plasma performance requirements needed for extrapolation to Demo. Expressing power exhaust requirements in terms of Pheat/R, future ARIES reactors are projected to operate with 60-200MW/m, a Component Test Facility (CTF) or Fusion Development Facility (FDF) for nuclear component testing (NCT) with 40-50MW/m, and ITER 20-25MW/m. However, new and planned long-pulse experiments are currently projected to operate at values of Pheat/R no more than 16MW/m. Furthermore, none of the existing or planned experiments are capable of operating with very high temperature first-wall (Twall = 600-1000C) which may be critical for understanding and ultimately minimizing tritium retention with a reactor-relevant metallic first-wall. The considerable gap between present and near-term experiments and the performance needed for NCT and Demo motivates the development of the concept …

Spectroscopy of radiation emitted by impurities and hydrogen isotopes plays an important role in the study of magnetically-confined fusion plasmas, both in determining the effects of impurities on plasma behavior and in measurements of plasma parameters such as electron and ion temperatures and densities, particle transport, and particle influx rates. This paper reviews spectroscopic diagnostics of plasma radiation that are excited by collisional processes in the plasma, which are termed 'passive' spectroscopic diagnostics to distinguish them from 'active' spectroscopic diagnostics involving injected particle and laser beams. A brief overview of the ionization balance in hot plasmas and the relevant line and continuum radiation excitation mechanisms is given. Instrumentation in the soft X-ray, vacuum ultraviolet, ultraviolet, visible, and near-infrared regions of the spectrum is described and examples of measurements are given. Paths for further development of these measurements and issues for their implementation in a burning plasma environment are discussed.

This is a continuing DOE-BES funded project on transition metal and actinide containing species, aimed at the electronic structure and spectroscopy of transition metal and actinide containing species. While a long term connection of these species is to catalysis and environmental management of high-level nuclear wastes, the immediate relevance is directly to other DOE-BES funded experimental projects at DOE-National labs and universities. There are a number of ongoing gas-phase spectroscopic studies of these species at various places, and our computational work has been inspired by these experimental studies and we have also inspired other experimental and theoretical studies. Thus our studies have varied from spectroscopy of diatomic transition metal carbides to large complexes containing transition metals, and actinide complexes that are critical to the environment. In addition, we are continuing to make code enhancements and modernization of ALCHEMY II set of codes and its interface with relativistic configuration interaction (RCI). At present these codes can carry out multi-reference computations that included up to 60 million configurations and multiple states from each such CI expansion. ALCHEMY II codes have been modernized and converted to a variety of platforms such as Windows XP, and Linux. We have revamped the symbolic CI code …

Pacific Northwest National Laboratory (PNNL) was tasked with incorporating cladding mechanical property data into the Nuclear Regulatory Commission (NRC) fuel codes, FRAPCON-31 and FRAPTRAN2, by the NRC Office of Nuclear Reactor Research. The objective of that task was to create a mechanical model that can calculate true stress, true strain, and the possible failure of the fuel rod cladding based on uniaxial test data.

At the power levels required for signicant heating and current drive in magnetically-con ned toroidal plasma, modi cation of the particle distribution function from a Maxwellian shape is likely [T.H. Stix, Nucl. Fusion, 15:737 1975], with consequent changes in wave propagation and in the location and amount of absorption. In order to study these e ects computationally, the nite-Larmor-radius, full-wave, hot-plasma toroidal simulation code, TORIC [M. Brambilla. Plasma Phys. Controlled Fusion, 41:1, 1999], has been extended to allow the prescription of arbitrary velocity distributions of the form ƒ (ν||, ν⊥, Ψ, θ). For H minority heating of a D-H plasma with anisotropic Maxwellian H distributions, the fractional H absorption varies signi cantly with changes in parallel temperature but is essentially independent of perpendicular temperature.

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Atomic physics in hot dense plasmas is essential for understanding the radiative properties of plasmas either produced terrestrially such as in fusion energy research or in space such as the study of the core of the sun. Various kinds of atomic data are needed for spectrum analysis or for radiation hydrodynamics simulations. There are many atomic databases accessible publicly through the web, such as CHIANTI (an atomic database for spectroscopic diagnostics for astrophysical plasmas) from Naval Research Laboratory [1], collaborative development of TOPbase (The Opacity Project for astrophysically abundant elements) [2], NIST atomic spectra database from NIST [3], TOPS Opacities from Los Alamos National Laboratory [4], etc. Most of these databases are specific to astrophysics, which provide energy levels, oscillator strength f and photoionization cross sections for astrophysical elements ( Z=1-26). There are abundant spectrum data sources for spectral analysis of low Z elements. For opacities used for radiation transport, TOPS Opacities from LANL is the most valuable source. The database provides mixed opacities from element for H (Z=1) to Zn (Z=30) The data in TOPS Opacities is calculated by the code LEDCOP. In the Fusion Technology Institute, we also have developed several different models to calculate atomic data and …