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Finite element modeling of syntactic foam

Hobbs, Michael L.

A decomposition model has been developed to predict the response of removable syntactic foam (RSF) exposed to fire-like heat fluxes. RSF consists of glass micro-balloons (GMB) in a cured epoxy polymer matrix. A chemistry model is presented based on the chemical structure of the epoxy polymer, mass transport of polymer fragments to the bulk gas, and vapor-liquid equilibrium. Thermophysical properties were estimated from measurements. A bubble nucleation, growth, and coalescence model was used to describe changes in properties with the extent of reaction. Decomposition of a strand of syntactic foam exposed to high temperatures was simulated.

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Successful technical trading agents using genetic programming

Farnsworth, Grant V.; Kelly, John A.; Pryor, Richard J.

Genetic programming (GP) has proved to be a highly versatile and useful tool for identifying relationships in data for which a more precise theoretical construct is unavailable. In this project, we use a GP search to develop trading strategies for agent based economic models. These strategies use stock prices and technical indicators, such as the moving average convergence/divergence and various exponentially weighted moving averages, to generate buy and sell signals. We analyze the effect of complexity constraints on the strategies as well as the relative performance of various indicators. We also present innovations in the classical genetic programming algorithm that appear to improve convergence for this problem. Technical strategies developed by our GP algorithm can be used to control the behavior of agents in economic simulation packages, such as ASPEN-D, adding variety to the current market fundamentals approach. The exploitation of arbitrage opportunities by technical analysts may help increase the efficiency of the simulated stock market, as it does in the real world. By improving the behavior of simulated stock markets, we can better estimate the effects of shocks to the economy due to terrorism or natural disasters.

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High fidelity frictional models for MEMS

Reedy, Earl D.; De Boer, Maarten P.; Corwin, Alex D.; Starr, Michael; Bitsie, Fernando; Sumali, Hartono (Anton); Redmond, James M.; Jones, Reese E.; Antoun, Bonnie R.

The primary goals of the present study are to: (1) determine how and why MEMS-scale friction differs from friction on the macro-scale, and (2) to begin to develop a capability to perform finite element simulations of MEMS materials and components that accurately predicts response in the presence of adhesion and friction. Regarding the first goal, a newly developed nanotractor actuator was used to measure friction between molecular monolayer-coated, polysilicon surfaces. Amontons law does indeed apply over a wide range of forces. However, at low loads, which are of relevance to MEMS, there is an important adhesive contribution to the normal load that cannot be neglected. More importantly, we found that at short sliding distances, the concept of a coefficient of friction is not relevant; rather, one must invoke the notion of 'pre-sliding tangential deflections' (PSTD). Results of a simple 2-D model suggests that PSTD is a cascade of small-scale slips with a roughly constant number of contacts equilibrating the applied normal load. Regarding the second goal, an Adhesion Model and a Junction Model have been implemented in PRESTO, Sandia's transient dynamics, finite element code to enable asperity-level simulations. The Junction Model includes a tangential shear traction that opposes the relative tangential motion of contacting surfaces. An atomic force microscope (AFM)-based method was used to measure nano-scale, single asperity friction forces as a function of normal force. This data is used to determine Junction Model parameters. An illustrative simulation demonstrates the use of the Junction Model in conjunction with a mesh generated directly from an atomic force microscope (AFM) image to directly predict frictional response of a sliding asperity. Also with regards to the second goal, grid-level, homogenized models were studied. One would like to perform a finite element analysis of a MEMS component assuming nominally flat surfaces and to include the effect of roughness in such an analysis by using a homogenized contact and friction models. AFM measurements were made to determine statistical information on polysilicon surfaces with different roughnesses, and this data was used as input to a homogenized, multi-asperity contact model (the classical Greenwood and Williamson model). Extensions of the Greenwood and Williamson model are also discussed: one incorporates the effect of adhesion while the other modifies the theory so that it applies to the case of relatively few contacting asperities.

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A set of verification test cases for Eiger : plane wave scattering from a sphere

Jorgenson, Roy E.; Kotulski, Joseph D.

This report discusses a set of verification test cases for the frequency-domain, boundary-element, electromagnetics code Eiger based on the analytical solution of plane wave scattering from a sphere. Three cases will be considered: when the sphere is made of perfect electric conductor, when the sphere is made of lossless dielectric and when the sphere is made of lossy dielectric. We outline the procedures that must be followed in order to carefully compare the numerical solution to the analytical solution. We define an error criterion and demonstrate convergence behavior for both the analytical and numerical cases. These problems test the code's ability to calculate the surface current density and secondary quantities, such as near fields and far fields.

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Spin stabilized magnetic levitation of horizontal rotors

Romero, Louis

In this paper we present an analysis of a new configuration for achieving spin stabilized magnetic levitation. In the classical configuration, the rotor spins about a vertical axis; and the spin stabilizes the lateral instability of the top in the magnetic field. In this new configuration the rotor spins about a horizontal axis; and the spin stabilizes the axial instability of the top in the magnetic field.

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ML 3.1 smoothed aggregation user's guide

Sala, Marzio; Tuminaro, Raymond S.; Hu, Jonathan J.

ML is a multigrid preconditioning package intended to solve linear systems of equations Ax = b where A is a user supplied n x n sparse matrix, b is a user supplied vector of length n and x is a vector of length n to be computed. ML should be used on large sparse linear systems arising from partial differential equation (PDE) discretizations. While technically any linear system can be considered, ML should be used on linear systems that correspond to things that work well with multigrid methods (e.g. elliptic PDEs). ML can be used as a stand-alone package or to generate preconditioners for a traditional iterative solver package (e.g. Krylov methods). We have supplied support for working with the Aztec 2.1 and AztecOO iterative package [16]. However, other solvers can be used by supplying a few functions. This document describes one specific algebraic multigrid approach: smoothed aggregation. This approach is used within several specialized multigrid methods: one for the eddy current formulation for Maxwell's equations, and a multilevel and domain decomposition method for symmetric and nonsymmetric systems of equations (like elliptic equations, or compressible and incompressible fluid dynamics problems). Other methods exist within ML but are not described in this document. Examples are given illustrating the problem definition and exercising multigrid options.

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Damage displacement phenomena in Si junction devices : mapping and interpreting a science and technology knowledge domain

Tsao, Jeffrey Y.

As technical knowledge grows deeper, broader, and more interconnected, knowledge domains increasingly combine a number of sub-domains. More often than not, each of these sub-domains has its own community of specialists and forums for interaction. Hence, from a generalist's viewpoint, it is sometimes difficult to understand the relationships between the sub-domains within the larger domain; and, from a specialist's viewpoint, it may be difficult for those working in one sub-domain to keep abreast of knowledge gained in another sub-domain. These difficulties can be especially important in the initial stages of creating new projects aimed at adding knowledge either at the domain or sub-domain level. To circumvent these difficulties, one would ideally like to create a map of the knowledge domain--a map which would help clarify relationships between the various sub-domains, and a map which would help inform choices regarding investing in the production of knowledge either at the domain or sub-domain levels. In practice, creating such a map is non-trivial. First, relationships between knowledge subdomains are complex, and not likely to be easily simplified into a visualizable 2-or-few-dimensional map. Second, even if some of the relationships can be simplified, capturing them would require some degree of expert understanding of the knowledge domain, rendering impossible any fully automated method for creating the map. In this work, we accept these limitations, and within them, attempt to explore semi-automated methodologies for creating such a map. We chose as the knowledge domain for this case study 'displacement damage phenomena in Si junction devices'. This knowledge domain spans a particularly wide range of knowledge subdomains, and hence is a particularly challenging one.

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A capillary valve for microfluidic systems

Kanouff, Michael P.; Rush, Brian M.; Cummings, Eric B.

Microfluidic systems are becoming increasingly complicated as the number of applications grows. The use of microfluidic systems for chemical and biological agent detection, for example, requires that a given sample be subjected to many process steps, which requires microvalves to control the position and transport of the sample. Each microfluidic application has its own specific valve requirements and this has precipitated the wide variety of valve designs reported in the literature. Each of these valve designs has its strengths and weaknesses. The strength of the valve design proposed here is its simplicity, which makes it easy to fabricate, easy to actuate, and easy to integrate with a microfluidic system. It can be applied to either gas phase or liquid phase systems. This novel design uses a secondary fluid to stop the flow of the primary fluid in the system. The secondary fluid must be chosen based on the type of flow that it must stop. A dielectric fluid must be used for a liquid phase flow driven by electroosmosis, and a liquid with a large surface tension should be used to stop a gas phase flow driven by a weak pressure differential. Experiments were carried out investigating certain critical functions of the design. These experiments verified that the secondary fluid can be reversibly moved between its 'valve opened' and 'valve closed' positions, where the secondary fluid remained as one contiguous piece during this transport process. The experiments also verified that when Fluorinert is used as the secondary fluid, the valve can break an electric circuit. It was found necessary to apply a hydrophobic coating to the microchannels to stop the primary fluid, an aqueous electrolyte, from wicking past the Fluorinert and short-circuiting the valve. A simple model was used to develop valve designs that could be closed using an electrokinetic pump, and re-opened by simply turning the pump off and allowing capillary forces to push the secondary fluid back into its stowed position.

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The evaluation of several corrosion mitigation strategies for oil coolers used by the strategic petroleum reserve

Enos, David; Levin, Bruce L.; Hinkebein, Thomas E.

The goal of this study was to first establish the fitness for service of the carbon steel based oil coolers presently located at the Bryan Mound and West Hackberry sites, and second, to compare quantitatively the performance of two proposed corrosion mitigation strategies. To address these goals, a series of flow loops were constructed to simulate the conditions present within the oil coolers allowing the performance of each corrosion mitigation strategy, as well as the baseline performance of the existing systems, to be assessed. As prior experimentation had indicated that the corrosion and fouling was relatively uniform within the oil coolers, the hot and cold side of the system were simulated, representing the extremes of temperature observed within a typical oil cooler. Upon completion of the experiment, the depth of localized attack observed on carbon steel was such that perforation of the tube walls would likely result within a 180 day drawdown procedure at West Hackberry. Furthermore, considering the average rate of wall recession (from LPR measurements), combined with the extensive localized attack (pitting) which occurred in both environments, the tubing wall thickness remaining after 180 days would be less than that required to contain the operating pressures of the oil coolers for both sites. Finally, the inhibitor package, while it did reduce the measured corrosion rate in the case of the West Hackberry solutions, did not provide a sufficient reduction in the observed attack to justify its use.

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Computational social network modeling of terrorist recruitment

Wu, Benjamin C.; Ko, Teresa H.

The Seldon terrorist model represents a multi-disciplinary approach to developing organization software for the study of terrorist recruitment and group formation. The need to incorporate aspects of social science added a significant contribution to the vision of the resulting Seldon toolkit. The unique addition of and abstract agent category provided a means for capturing social concepts like cliques, mosque, etc. in a manner that represents their social conceptualization and not simply as a physical or economical institution. This paper provides an overview of the Seldon terrorist model developed to study the formation of cliques, which are used as the major recruitment entity for terrorist organizations.

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Natural gas production problems : solutions, methodologies, and modeling

Lorenz, John C.; Cooper, Scott P.; Arnold, Bill W.; Herrin, James M.; Keefe, Russell G.; Olsson, William A.; Rautman, Christopher A.

Natural gas is a clean fuel that will be the most important domestic energy resource for the first half the 21st centtuy. Ensuring a stable supply is essential for our national energy security. The research we have undertaken will maximize the extractable volume of gas while minimizing the environmental impact of surface disturbances associated with drilling and production. This report describes a methodology for comprehensive evaluation and modeling of the total gas system within a basin focusing on problematic horizontal fluid flow variability. This has been accomplished through extensive use of geophysical, core (rock sample) and outcrop data to interpret and predict directional flow and production trends. Side benefits include reduced environmental impact of drilling due to reduced number of required wells for resource extraction. These results have been accomplished through a cooperative and integrated systems approach involving industry, government, academia and a multi-organizational team within Sandia National Laboratories. Industry has provided essential in-kind support to this project in the forms of extensive core data, production data, maps, seismic data, production analyses, engineering studies, plus equipment and staff for obtaining geophysical data. This approach provides innovative ideas and technologies to bring new resources to market and to reduce the overall environmental impact of drilling. More importantly, the products of this research are not be location specific but can be extended to other areas of gas production throughout the Rocky Mountain area. Thus this project is designed to solve problems associated with natural gas production at developing sites, or at old sites under redevelopment.

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Analysis of multichannel internet communication

Nove, Charles E.; Maclin, Richard F.; Theuninck, Andrew K.; Newland, Jeremy L.; Torrey, Lisa A.; Robinson, Eric R.

A novel method employing machine-based learning to identify messages related to other messages is described and evaluated. This technique may enable an analyst to identify and correlate a small number of related messages from a large sample of individual messages. The classic machine learning techniques of decision trees and naive Bayes classification are seeded with few (or no) messages of interest and 'learn' to identify other related messages. The performance of this approach and these specific learning techniques are evaluated and generalized.

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Passive microwave tags : LDRD 52709, FY04 final report

Brocato, Robert W.

This report describes both a general methodology and specific examples of completely passive microwave tags. Surface acoustic wave (SAW) devices were used to make tags for both identification and sensing applications at different frequencies. SAW correlators were optimized for wireless identification, and SAW filters were developed to enable wireless remote sensing of physical properties. Identification tag applications and wireless remote measurement applications are discussed. Significant effort went into optimizing the SAW devices used for this work, and the lessons learned from that effort are reviewed.

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The Hydrogen Futures Simulation Model (H[2]Sim) technical description

Drennen, Thomas E.; Jones, Scott A.; Lutz, Andrew E.

Hydrogen has the potential to become an integral part of our energy transportation and heat and power sectors in the coming decades and offers a possible solution to many of the problems associated with a heavy reliance on oil and other fossil fuels. The Hydrogen Futures Simulation Model (H2Sim) was developed to provide a high level, internally consistent, strategic tool for evaluating the economic and environmental trade offs of alternative hydrogen production, storage, transport and end use options in the year 2020. Based on the model's default assumptions, estimated hydrogen production costs range from 0.68 $/kg for coal gasification to as high as 5.64 $/kg for centralized electrolysis using solar PV. Coal gasification remains the least cost option if carbon capture and sequestration costs ($0.16/kg) are added. This result is fairly robust; for example, assumed coal prices would have to more than triple or the assumed capital cost would have to increase by more than 2.5 times for natural gas reformation to become the cheaper option. Alternatively, assumed natural gas prices would have to fall below $2/MBtu to compete with coal gasification. The electrolysis results are highly sensitive to electricity costs, but electrolysis only becomes cost competitive with other options when electricity drops below 1 cent/kWhr. Delivered 2020 hydrogen costs are likely to be double the estimated production costs due to the inherent difficulties associated with storing, transporting, and dispensing hydrogen due to its low volumetric density. H2Sim estimates distribution costs ranging from 1.37 $/kg (low distance, low production) to 3.23 $/kg (long distance, high production volumes, carbon sequestration). Distributed hydrogen production options, such as on site natural gas, would avoid some of these costs. H2Sim compares the expected 2020 per mile driving costs (fuel, capital, maintenance, license, and registration) of current technology internal combustion engine (ICE) vehicles (0.55$/mile), hybrids (0.56 $/mile), and electric vehicles (0.82-0.84 $/mile) with 2020 fuel cell vehicles (FCVs) (0.64-0.66 $/mile), fuel cell vehicles with onboard gasoline reformation (FCVOB) (0.70 $/mile), and direct combustion hydrogen hybrid vehicles (H2Hybrid) (0.55-0.59 $/mile). The results suggests that while the H2Hybrid vehicle may be competitive with ICE vehicles, it will be difficult for the FCV to compete without significant increases in gasoline prices, reduced predicted vehicle costs, stringent carbon policies, or unless they can offer the consumer something existing vehicles can not, such as on demand power, lower emissions, or better performance.

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Phase transformation of poled "chem-prep" PZT 95/5-2Nb ceramic under quasi-static loading conditions

Lee, Moo Y.; Montgomery, Stephen; Hofer, John

Specimens of poled 'chem-prep' PNZT ceramic from batch HF803 were tested under hydrostatic, uniaxial, and constant stress difference loading conditions at three temperatures of -55, 25, and 75 C and pressures up to 500 MPa. The objective of this experimental study was to obtain the electro-mechanical properties of the ceramic and the criteria of FE (Ferroelectric) to AFE (Antiferroelectric) phase transformations so that grain-scale modeling efforts can develop and test models and codes using realistic parameters. The poled ceramic undergoes anisotropic deformation during the transition from a FE to an AFE structure. The lateral strain measured parallel to the poling direction was typically 35 % greater than the strain measured perpendicular to the poling direction. The rates of increase in the phase transformation pressures per temperature changes were practically identical for both unpoled and poled PNZT HF803 specimens. We observed that the retarding effect of temperature on the kinetics of phase transformation appears to be analogous to the effect of shear stress. We also observed that the FE-to-AFE phase transformation occurs in poled ceramic when the normal compressive stress, acting perpendicular to a crystallographic plane about the polar axis, equals the hydrostatic pressure at which the transformation otherwise takes place.

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Site selection and technology evaluation for pilot demonstrations in the Arsenic Water Technology Partnership program

Siegel, Malcolm; Dwyer, Brian P.; Everett, Randy; Aragon, Alicia R.

As part of the Arsenic Water Technology Partnership program, Sandia National Laboratories will carry out field demonstration testing of innovative technologies that have the potential to substantially reduce the costs associated with arsenic removal from drinking water. The scope for this work includes: (1) selection of sites for pilot demonstrations, (2) identification of candidate technologies through Vendor Forums, proof-of-principle bench-scale studies managed by the American Water Works Association Research Foundation (AwwaRF) or the WERC design contest, and (3) pilot-scale studies involving side-by-side tests of innovative technologies. The goal of site selection is identification of a suite of sites that exhibit a sufficiently wide range of groundwater chemistries to allow examination of treatment processes and systems under conditions that are relevant to different geochemical settings throughout the country. A number of candidate sites have been identified through reviews of groundwater quality databases, conference proceedings and discussions with state and local officials. These include sites in New Mexico, Arizona, Colorado, Oklahoma, Illinois, Michigan, Florida, Massachusetts and New Hampshire. In New Mexico, discussions have been held with water utility board staffs in Chama, Jemez Pueblo, Placitas, Socorro and several communities near Las Cruces to determine the suitability of those communities for pilot studies. The initial pilot studies will be carried at Socorro and Jemez Pueblo; other communities will be included as the program progresses. The proposed pilot test at a hot spring water source near Socorro will provide an opportunity to test treatment technologies at relatively high temperatures. If approved by the Tribal Government, the proposed pilot at the Jemez Pueblo would provide an opportunity to test technologies that will remove arsenic in the presence of relatively high concentrations of iron and manganese while leaving the beneficial levels of fluoride unchanged. Candidate technologies for the pilot tests are being reviewed by technical evaluation teams. The initial reviews will consider as many potential technologies and screen out unsuitable ones by considering data from past performance testing, expected costs, complexity of operation and maturity of the technology. The pilot test configurations will depend on the site-specific conditions such as access, power availability, waste disposal options and availability of permanent structures to house the test. Most of the treatment technologies that will be evaluated can be separated into two broad categories: (1) sorption processes that use fixed bed adsorbents and (2) membrane processes. The latter include processes that involve formation of a floc or precipitate that contains the arsenic in a reactor followed by separation of the solids from the water by filtration. Several innovations that could lead to lower treatment costs have been proposed for adsorptive media systems. These include: (1) higher capacity and selectivity using mixed oxides composed of iron and other transition metals, titanium and zirconium based oxides, or mixed resin-metal oxides composite media, (2) improved durability of virgin media and greater chemical stability of the spent media, and (3) use of inexpensive natural or recycled materials with a coating that has a high affinity for arsenic. Improvements to filtration-based treatment systems include: (1) enhanced coagulation with iron compounds or polyelectrolytes and (2) improved filtration with nanocomposite materials. In the pilot tests, the innovative technologies will be evaluated in terms of: (1) their ability to reduce arsenic to levels below the EPA Maximum Contaminant Level (MCL) of 10 ppb, (2) site-specific adsorptive capacity, robustness of performance with respect to likely changes in water quality parameters including pH, TDS, foulants such as Fe, Mn, silica, and organics, effect of competing ions such as other metals and radionuclides, and potentially deleterious effects on the water system such as pipe corrosion from low pH levels, fluoride removal, and generation of disinfection by-products. The new arsenic MCL will result in modification of many rural water systems that otherwise would not require treatment. Opportunities for improvement of water quality in systems that currently do not comply with other standards would be an added benefit from the new arsenic MCL that has both economic and public health value.

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Molecular dynamics of membrane proteins

Stevens, Mark J.

Understanding the dynamics of the membrane protein rhodopsin will have broad implications for other membrane proteins and cellular signaling processes. Rhodopsin (Rho) is a light activated G-protein coupled receptor (GPCR). When activated by ligands, GPCRs bind and activate G-proteins residing within the cell and begin a signaling cascade that results in the cell's response to external stimuli. More than 50% of all current drugs are targeted toward G-proteins. Rho is the prototypical member of the class A GPCR superfamily. Understanding the activation of Rho and its interaction with its Gprotein can therefore lead to a wider understanding of the mechanisms of GPCR activation and G-protein activation. Understanding the dark to light transition of Rho is fully analogous to the general ligand binding and activation problem for GPCRs. This transition is dependent on the lipid environment. The effect of lipids on membrane protein activity in general has had little attention, but evidence is beginning to show a significant role for lipids in membrane protein activity. Using the LAMMPS program and simulation methods benchmarked under the IBIG program, we perform a variety of allatom molecular dynamics simulations of membrane proteins.

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Laboratory evaluation of frozen soil target materials with a fused interface

Bronowski, David R.

To investigate the performance of artificial frozen soil materials with a fused interface, split tension (or 'Brazilian') tests and unconfined uniaxial compression tests were carried out in a low temperature environmental chamber. Intact and fused specimens were fabricated from four different soil mixtures (962: clay-rich soil with bentonite; DNA1: clay-poor soil; DNA2: clay-poor soil with vermiculite; and DNA3: clay-poor soil with perlite). Based on the 'Brazilian' test results and density measurements, the DNA3 mixture was selected to closely represent the mechanical properties of the Alaskan frozen soil. The healed-interface by the same soil layer sandwiched between two blocks of the same material yielded the highest 'Brazilian' tensile strength of the interface. Based on unconfined uniaxial compression tests, the frictional strength of the fused DNA3 specimens with the same soil appears to exceed the shear strength of the intact specimen.

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Time-resolved laser-induced incandescence measurements of particulate emissions during enrichment for diesel lean NOx trap regeneration

Laser-induced incandescence is used to measure time-resolved diesel particulate emissions for two lean NOx trap regeneration strategies that utilize intake throttling and in-cylinder fuel enrichment. The results show that when the main injection event is increased in duration and delayed 13 crank-angle degrees, particulate emissions are very high. For a repetitive pattern of 3 seconds of rich regeneration followed by 27 seconds of NOx-trap loading, we find a monotonic increase in particulate emissions during the loading intervals that approaches twice the initial baseline particulate level after 1000 seconds. In contrast, particulate emissions during the re-generation intervals are constant throughout the test sequence. For regeneration using an additional late injection event (post-injection), particulate emissions are about twice the baseline level for the first regeneration interval, but then decay with an exponential-like behavior over the repetitive test sequence, eventually reaching a level that is comparable to the baseline. In contrast, particulate emissions between regenerations decrease slowly throughout the test sequence, reaching a level 12 percent below the starting baseline value.

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Nanocrystal formation in gas-atomized amorphous Al85Ni10La5 alloy

Proposed for publication in a journal article to be determined.

Yang, Nancy

An Al{sub 85}Ni{sub 10}La{sub 5} amorphous alloy, produced via gas atomization, was selected to study the mechanisms of nanocrystallization induced by thermal exposure. High resolution transmission electron microscopy results indicated the presence of quenched-in Al nuclei in the amorphous matrix of the atomized powder. However, a eutectic-like reaction, which involved the formation of the Al, Al{sub 11}La{sub 3}, and Al{sub 3}Ni phases, was recorded in the first crystallization event (263 C) during differential scanning calorimetry continuous heating. Isothermal annealing experiments conducted below 263 C revealed that the formation of single fcc-Al phase occurred at 235 C. At higher temperatures, growth of the Al crystals occurred with formation of intermetallic phases, leading to a eutectic-like transformation behavior at 263 C. During the first crystallization stage, nanocrystals were developed in the size range of 5 - 30 nm. During the second crystallization event (283 C), a bimodal size distribution of nanocrystals was formed with the smaller size in the range of around 10 - 30 nm and the larger size around 100 nm. The influence of pre-existing quenched-in Al nuclei on the microstructural evolution in the amorphous Al{sub 85}Ni{sub 10}La{sub 5} alloy is discussed and the effect of the microstructural evolution on the hardening behavior is described in detail.

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Soot formation, transport, and radiation in unsteady diffusion flames : LDRD final report

Shaddix, Christopher R.; Williams, Timothy C.; Schefer, Robert W.; Jensen, Kirk A.; Suo-Anttila, Jill M.; Kearney, Sean P.

Fires pose the dominant risk to the safety and security of nuclear weapons, nuclear transport containers, and DOE and DoD facilities. The thermal hazard from these fires primarily results from radiant emission from high-temperature flame soot. Therefore, it is necessary to understand the local transport and chemical phenomena that determine the distributions of soot concentration, optical properties, and temperature in order to develop and validate constitutive models for large-scale, high-fidelity fire simulations. This report summarizes the findings of a Laboratory Directed Research and Development (LDRD) project devoted to obtaining the critical experimental information needed to develop such constitutive models. A combination of laser diagnostics and extractive measurement techniques have been employed in both steady and pulsed laminar diffusion flames of methane, ethylene, and JP-8 surrogate burning in air. For methane and ethylene, both slot and coannular flame geometries were investigated, as well as normal and inverse diffusion flame geometries. For the JP-8 surrogate, coannular normal diffusion flames were investigated. Soot concentrations, polycyclic aromatic hydrocarbon (PAH) laser-induced fluorescence (LIF) signals, hydroxyl radical (OH) LIF, acetylene and water vapor concentrations, soot zone temperatures, and the velocity field were all successfully measured in both steady and unsteady versions of these various flames. In addition, measurements were made of the soot microstructure, soot dimensionless extinction coefficient (&), and the local radiant heat flux. Taken together, these measurements comprise a unique, extensive database for future development and validation of models of soot formation, transport, and radiation.

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The pitting behavior of structural electrodeposits used in MEMS applications

Serna, Lysle M.

LIGA is an acronym for the German terms Lithographie, Galvanoformung, Abformung, which describe a microfabrication process for high aspect ratio, structural parts based on electrodeposition of a metal into a poly-methyl-methacrylate (PMMA) mold. LIGA produced parts have very high dimensional tolerances (on the order of a micron) and can vary in size from microns to centimeters. These properties make LIGA parts ideal for incorporation into MEMS devices or for other applications where strict tolerances must be met; however, functionality of the parts can only be maintained if they remain dimensionally stable throughout their lifetime. It follows that any form of corrosion attack (e.g., uniform dissolution, localized pitting, environmental cracking, etc.) cannot be tolerated. This presentation focuses on the pitting behavior of Ni electrodeposits, specifically addressing the influence of the following: grain structure, alloy composition, impurities, plating conditions, post plating processing (including chemical and thermal treatment), galvanic interactions and environment (aqueous vs. atmospheric). A small subset of these results is summarized. A typical LIGA part is shown in Figure 1. Due to the small size scale, electrochemical testing was performed using a capillary based test system. Although very small test areas can be probed with this system (e.g., Figure 2), typically capillaries on the order of 80 to 90 ?m's were used in the testing. All LIGA parts tested in the as-received condition had better pitting resistance than the high purity wrought Ni material used as a control. In the case of LIGA-Ni and LIGA-Ni-Mn, no detrimental effects were observed due to aging at 700C. Ni-S (approximately 500 ppm S), showed good as-received pitting behavior but decreased pitting resistance with thermal aging. Aged Ni-S showed dramatic increases in grain size (from single {micro}m's to 100's of {micro}m's), and significant segregation of S to the boundaries. The capillary test cell was used to measure pitting potentials at the boundaries and within grains (Figure 3) with the results clearly showing the lowered pit resistance being due to the S-rich boundaries. It is believed that the process used to release the LIGA parts from the Cu substrate acts as a pickling agent for the LIGA parts, resulting in removal of surface impurities and detrimental alloying additions. EIS data from freshly polished samples exposed to the release bath support this hypothesis; RP values for all LIGA materials and for wrought Ni, continuously increase during exposure. Mechanical polishing of LIGA parts prior to electrochemical testing consistently resulted in lowering the pitting potentials to a range bounded by Ni 201 and high purity Ni. The as-received vs. polished behavior also effects the galvanic interactions with noble metals. When as-produced material is coupled to Au, initially the LIGA material acts as the cathode, though eventually the behavior switches such that the LIGA becomes the anode. Overall, the LIGA produced Ni and Ni alloys examined in this work demonstrated pitting behavior similar to wrought Ni, only showing reduced resistance when specific metallurgical and environmental conditions were met.

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Shroud boundary condition characterization experiments at the Radiant Heat Facility

Nakos, James T.; Suo-Anttila, Jill M.; Gill, Walter

A series of experiments was performed to better characterize the boundary conditions from an inconel heat source ('shroud') painted with Pyromark black paint. Quantifying uncertainties in this type of experimental setup is crucial to providing information for comparisons with code predictions. The characterization of this boundary condition has applications in many scenarios related to fire simulation experiments performed at Sandia National Laboratories Radiant Heat Facility (RHF). Four phases of experiments were performed. Phase 1 results showed that a nominal 1000 C shroud temperature is repeatable to about 2 C. Repeatability of temperatures at individual points on the shroud show that temperatures do not vary more than 10 C from experiment to experiment. This variation results in a 6% difference in heat flux to a target 4 inches away. IR camera images showed the shroud was not at a uniform temperature, although the control temperature was constant to about {+-}2 C during a test. These images showed that a circular shaped, flat shroud with its edges supported by an insulated plate has a temperature distribution with higher temperatures at the edges and lower temperatures in the center. Differences between the center and edge temperatures were up to 75 C. Phase 3 results showed that thermocouple (TC) bias errors are affected by coupling with the surrounding environment. The magnitude of TC error depends on the environment facing the TC. Phase 4 results were used to estimate correction factors for specific applications (40 and 63-mil diameter, ungrounded junction, mineral insulated, metal-sheathed TCs facing a cold surface). Correction factors of about 3.0-4.5% are recommended for 40 mil diameter TCs and 5.5-7.0% for 63 mil diameter TCs. When mounted on the cold side of the shroud, TCs read lower than the 'true' shroud temperature, and the TC reads high when on the hot side. An alternate method uses the average of a cold side and hot side TC of the same size to estimate the true shroud temperature. Phase 2 results compared IR camera measurements with TC measurements and measured values of Pyromark emissivity. Agreement was within measured uncertainties of the Pyromark paint emissivity and IR camera temperatures.

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Methods for model selection in applied science and engineering

Field, Richard V.

Mathematical models are developed and used to study the properties of complex systems and/or modify these systems to satisfy some performance requirements in just about every area of applied science and engineering. A particular reason for developing a model, e.g., performance assessment or design, is referred to as the model use. Our objective is the development of a methodology for selecting a model that is sufficiently accurate for an intended use. Information on the system being modeled is, in general, incomplete, so that there may be two or more models consistent with the available information. The collection of these models is called the class of candidate models. Methods are developed for selecting the optimal member from a class of candidate models for the system. The optimal model depends on the available information, the selected class of candidate models, and the model use. Classical methods for model selection, including the method of maximum likelihood and Bayesian methods, as well as a method employing a decision-theoretic approach, are formulated to select the optimal model for numerous applications. There is no requirement that the candidate models be random. Classical methods for model selection ignore model use and require data to be available. Examples are used to show that these methods can be unreliable when data is limited. The decision-theoretic approach to model selection does not have these limitations, and model use is included through an appropriate utility function. This is especially important when modeling high risk systems, where the consequences of using an inappropriate model for the system can be disastrous. The decision-theoretic method for model selection is developed and applied for a series of complex and diverse applications. These include the selection of the: (1) optimal order of the polynomial chaos approximation for non-Gaussian random variables and stationary stochastic processes, (2) optimal pressure load model to be applied to a spacecraft during atmospheric re-entry, and (3) optimal design of a distributed sensor network for the purpose of vehicle tracking and identification.

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Direct single ion machining of nanopores

Follstaedt, David M.; Norman, Adam K.; Doyle, B.L.

The irradiation of thin insulating films by high-energy ions (374 MeV Au{sup +25} or 241 MeV I{sup +19}) was used to attempt to form nanometer-size pores through the films spontaneously. Such ions deposit a large amount of energy into the target materials ({approx}20 keV/nm), which significantly disrupts their atomic lattice and sputters material from the surfaces, and might produce nanopores for appropriate ion-material combinations. Transmission electron microscopy was used to examine the resulting ion tracks. Tracks were found in the crystalline oxides quartz, sapphire, and mica. Sapphire and mica showed ion tracks that are likely amorphous and exhibit pits 5 nm in diameter on the surface at the ion entrance and exit points. This suggests that nanopores might form in mica if the film thickness is less than {approx}10 nm. Tracks in quartz showed strain in the matrix around them. Tracks were not found in the amorphous thin films examined: 20 nm-SiN{sub x}, deposited SiOx, fused quartz (amorphous SiO{sub 2}), formvar and 3 nm-C. Other promising materials for nanopore formation were identified, including thin Au and SnO{sub 2} layers.

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Potential applications of nanostructured materials in nuclear waste management

Wang, Yifeng

This report summarizes the results obtained from a Laboratory Directed Research & Development (LDRD) project entitled 'Investigation of Potential Applications of Self-Assembled Nanostructured Materials in Nuclear Waste Management'. The objectives of this project are to (1) provide a mechanistic understanding of the control of nanometer-scale structures on the ion sorption capability of materials and (2) develop appropriate engineering approaches to improving material properties based on such an understanding.

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Safety assessment of borehole disposal of unwanted radioactive sealed sources in Egypt using Goldsim

Mattie, Patrick; Cochran, John R.

A radioactive sealed source is any radioactive material that is encased in a capsule designed to prevent leakage or escape of the radioactive material. Radioactive sealed sources are used for a wide variety of applications at hospitals, in manufacturing and research. Typical uses are in portable gauges to measure soil compaction and moisture or to determine physical properties of rocks units in boreholes (well logging). Hospitals and clinics use radioactive sealed sources for teletherapy and brachytherapy. Oil exploration and medicine are the largest users. Accidental mismanagement of radioactive sealed sources each year results in a large number of people receiving very high or even fatal does of ionizing radiation. Deliberate mismanagement is a growing international concern. Sealed sources must be managed and disposed effectively in order to protect human health and the environment. Effective national safety and management infrastructures are prerequisites for efficient and safe transportation, treatment, storage, and disposal. The Integrated Management Program for Radioactive Sealed Sources in Egypt (IMPRSS) is a cooperative development agreement between the Egyptian Atomic Energy Authority (EAEA), Egyptian Ministry of Health (MOH), Sandia National Laboratories (SNL), the University of New Mexico (UNM), and Agriculture Cooperative Development International (ACDI/VOCA). The EAEA, teaming with SNL, is conducting a Preliminary Safety Assessment (PSA) of an intermediate-depth borehole disposal in thick arid alluvium in Egypt based on experience with the U.S. Greater Confinement Disposal (GCD). Goldsim has been selected for the preliminary disposal system assessment for the Egyptian GCD Study. The results of the PSA will then be used to decide if Egypt desires to implement such a disposal system.

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A low power ultra-fast current transient measuring device

Doyle, B.L.; Foltynowicz, Robert J.; Sullivan, John P.; Armendariz, Marcelino; Zutavern, Fred J.

We have studied the feasibility of an innovative device to sample 1ns low-power single current transients with a time resolution better than 10 ps. The new concept explored here is to close photoconductive semiconductor switches (PCSS) with a Laser for a period of 10 ps. The PCSSs are in a series along a Transmission Line (TL). The transient propagates along the TL allowing one to carry out a spatially resolved sampling of charge at a fixed time instead of the usual timesampling of the current. The fabrication of such a digitizer was proven to be feasible but very difficult.

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Solution verification for explicit transient dynamics problems in the presence of hourglass and contact forces

Proposed for publication in Computer Methods in Applied Mechanics and Engineering Journal.

Stewart, James

This paper presents solution verification studies applicable to a class of problems involving wave propagation, frictional contact, geometrical complexity, and localized incompressibility. The studies are in support of a validation exercise of a phenomenological screw failure model. The numerical simulations are performed using a fully explicit transient dynamics finite element code, employing both standard four-node tetrahedral and eight-node mean quadrature hexahedral elements. It is demonstrated that verifying the accuracy of the simulation involves not only consideration of the mesh discretization error, but also the effect of the hourglass control and the contact enforcement. In particular, the proper amount of hourglass control and the behavior of the contact search and enforcement algorithms depend greatly on the mesh resolution. We carry out the solution verification exercise using mesh refinement studies and describe our systematic approach to handling the complicating issues. It is shown that hourglassing and contact must both be carefully monitored as the mesh is refined, and it is often necessary to make adjustments to the hourglass and contact user input parameters to accommodate finer meshes. We introduce in this paper the hourglass energy, which is used as an 'error indicator' for the hourglass control. If the hourglass energy does not tend to zero with mesh refinement, then an hourglass control parameter is changed and the calculation is repeated.

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Manticore and CS mode : parallelizable encryption with joint cipher-state authentication

Anderson, William E.; Beaver, Cheryl L.; Draelos, Timothy J.; Schroeppel, Richard C.; Torgerson, Mark D.; Miller, Russell D.

We describe a new mode of encryption with inexpensive authentication, which uses information from the internal state of the cipher to provide the authentication. Our algorithms have a number of benefits: (1) the encryption has properties similar to CBC mode, yet the encipherment and authentication can be parallelized and/or pipelined, (2) the authentication overhead is minimal, and (3) the authentication process remains resistant against some IV reuse. We offer a Manticore class of authenticated encryption algorithms based on cryptographic hash functions, which support variable block sizes up to twice the hash output length and variable key lengths. A proof of security is presented for the MTC4 and Pepper algorithms. We then generalize the construction to create the Cipher-State (CS) mode of encryption that uses the internal state of any round-based block cipher as an authenticator. We provide hardware and software performance estimates for all of our constructions and give a concrete example of the CS mode of encryption that uses AES as the encryption primitive and adds a small speed overhead (10-15%) compared to AES alone.

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Securing mobile code

Beaver, Cheryl L.; Neumann, William D.; Link, Hamilton E.; Schroeppel, Richard C.; Campbell, Philip L.; Pierson, Lyndon G.; Anderson, William E.

If software is designed so that the software can issue functions that will move that software from one computing platform to another, then the software is said to be 'mobile'. There are two general areas of security problems associated with mobile code. The 'secure host' problem involves protecting the host from malicious mobile code. The 'secure mobile code' problem, on the other hand, involves protecting the code from malicious hosts. This report focuses on the latter problem. We have found three distinct camps of opinions regarding how to secure mobile code. There are those who believe special distributed hardware is necessary, those who believe special distributed software is necessary, and those who believe neither is necessary. We examine all three camps, with a focus on the third. In the distributed software camp we examine some commonly proposed techniques including Java, D'Agents and Flask. For the specialized hardware camp, we propose a cryptographic technique for 'tamper-proofing' code over a large portion of the software/hardware life cycle by careful modification of current architectures. This method culminates by decrypting/authenticating each instruction within a physically protected CPU, thereby protecting against subversion by malicious code. Our main focus is on the camp that believes that neither specialized software nor hardware is necessary. We concentrate on methods of code obfuscation to render an entire program or a data segment on which a program depends incomprehensible. The hope is to prevent or at least slow down reverse engineering efforts and to prevent goal-oriented attacks on the software and execution. The field of obfuscation is still in a state of development with the central problem being the lack of a basis for evaluating the protection schemes. We give a brief introduction to some of the main ideas in the field, followed by an in depth analysis of a technique called 'white-boxing'. We put forth some new attacks and improvements on this method as well as demonstrating its implementation for various algorithms. We also examine cryptographic techniques to achieve obfuscation including encrypted functions and offer a new application to digital signature algorithms. To better understand the lack of security proofs for obfuscation techniques, we examine in detail general theoretical models of obfuscation. We explain the need for formal models in order to obtain provable security and the progress made in this direction thus far. Finally we tackle the problem of verifying remote execution. We introduce some methods of verifying remote exponentiation computations and some insight into generic computation checking.

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Radiation effects microscopy for failure analysis of microelectronic devices

Doyle, B.L.; Dodd, Paul E.; Shaneyfelt, Marty R.; Schwank, James R.

Microelectronic devices in satellites and spacecraft are exposed to high energy cosmic radiation. Furthermore, Earth-based electronics can be affected by terrestrial radiation. The radiation causes a variety of Single Event Effects (SEE) that can lead to failure of the devices. High energy heavy ion beams are being used to simulate both the cosmic and terrestrial radiation to study radiation effects and to ensure the reliability of electronic devices. Broad beam experiments can provide a measure of the radiation hardness of a device (SEE cross section) but they are unable to pinpoint the failing components in the circuit. A nuclear microbeam is an ideal tool to map SEE on a microscopic scale and find the circuit elements (transistors, capacitors, etc.) that are responsible for the failure of the device. In this paper a review of the latest radiation effects microscopy (REM) work at Sandia will be given. Different SEE mechanisms (Single Event Upset, Single Event Transient, etc.) and the methods to study them (Ion Beam Induced Charge (IBIC), Single Event Upset mapping, etc.) will be discussed. Several examples of using REM to study the basic effects of radiation in electronic devices and failure analysis of integrated circuits will be given.

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Visualization of salt-induced stress perturbations

Rogers, David; Brannon, Rebecca M.

An important challenge encountered during post-processing of finite element analyses is the visualizing of three-dimensional fields of real-valued second-order tensors. Namely, as finite element meshes become more complex and detailed, evaluation and presentation of the principal stresses becomes correspondingly problematic. In this paper, we describe techniques used to visualize simulations of perturbed in-situ stress fields associated with hypothetical salt bodies in the Gulf of Mexico. We present an adaptation of the Mohr diagram, a graphical paper and pencil method used by the material mechanics community for estimating coordinate transformations for stress tensors, as a new tensor glyph for dynamically exploring tensor variables within three-dimensional finite element models. This interactive glyph can be used as either a probe or a filter through brushing and linking.

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MATLAB tensor classes for fast algorithm prototyping

Bader, Brett W.

Tensors (also known as mutidimensional arrays or N-way arrays) are used in a variety of applications ranging from chemometrics to psychometrics. We describe four MATLAB classes for tensor manipulations that can be used for fast algorithm prototyping. The tensor class extends the functionality of MATLAB's multidimensional arrays by supporting additional operations such as tensor multiplication. The tensor as matrix class supports the 'matricization' of a tensor, i.e., the conversion of a tensor to a matrix (and vice versa), a commonly used operation in many algorithms. Two additional classes represent tensors stored in decomposed formats: cp tensor and tucker tensor. We descibe all of these classes and then demonstrate their use by showing how to implement several tensor algorithms that have appeared in the literature.

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Direct measurement and theoretical calculation of the rate coefficient for Cl + CH3 from T = 202 - 298 K

Proposed for publication in J. Phys. Chem. A.

Klippenstein, Stephen J.

The rate coefficient has been measured under pseudo-first-order conditions for the Cl + CH{sub 3} association reaction at T = 202, 250, and 298 K and P = 0.3-2.0 Torr helium using the technique of discharge-flow mass spectrometry with low-energy (12-eV) electron-impact ionization and collision-free sampling. Cl and CH{sub 3} were generated rapidly and simultaneously by reaction of F with HCl and CH{sub 4}, respectively. Fluorine atoms were produced by microwave discharge in an approximately 1% mixture of F{sub 2} in He. The decay of CH{sub 3} was monitored under pseudo-first-order conditions with the Cl-atom concentration in large excess over the CH{sub 3} concentration ([Cl]{sub 0}/[CH{sub 3}]{sub 0} = 9-67). Small corrections were made for both axial and radial diffusion and minor secondary chemistry. The rate coefficient was found to be in the falloff regime over the range of pressures studied. For example, at T = 202 K, the rate coefficient increases from 8.4 x 10{sup -12} at P = 0.30 Torr He to 1.8 x 10{sup -11} at P = 2.00 Torr He, both in units of cm{sup 3} molecule{sup -1} s{sup -1}. A combination of ab initio quantum chemistry, variational transition-state theory, and master-equation simulations was employed in developing a theoretical model for the temperature and pressure dependence of the rate coefficient. Reasonable empirical representations of energy transfer and of the effect of spin-orbit interactions yield a temperature- and pressure-dependent rate coefficient that is in excellent agreement with the present experimental results. The high-pressure limiting rate coefficient from the RRKM calculations is k{sub 2} = 6.0 x 10{sup -11} cm{sup 3} molecule{sup -1} s{sup -1}, independent of temperature in the range from 200 to 300 K.

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Geomechanics of penetration : experimental and computational approaches : final report for LDRD project 38718

Holcomb, David J.; Fossum, Arlo F.; Gettemy, Glen L.; Hardy, Robert D.; Bronowski, David R.; Rivas, Raul R.; Preece, Dale S.

The purpose of the present work is to increase our understanding of which properties of geomaterials most influence the penetration process with a goal of improving our predictive ability. Two primary approaches were followed: development of a realistic, constitutive model for geomaterials and designing an experimental approach to study penetration from the target's point of view. A realistic constitutive model, with parameters based on measurable properties, can be used for sensitivity analysis to determine the properties that are most important in influencing the penetration process. An immense literature exists that is devoted to the problem of predicting penetration into geomaterials or similar man-made materials such as concrete. Various formulations have been developed that use an analytic or more commonly, numerical, solution for the spherical or cylindrical cavity expansion as a sort of Green's function to establish the forces acting on a penetrator. This approach has had considerable success in modeling the behavior of penetrators, both as to path and depth of penetration. However the approach is not well adapted to the problem of understanding what is happening to the material being penetrated. Without a picture of the stress and strain state imposed on the highly deformed target material, it is not easy to determine what properties of the target are important in influencing the penetration process. We developed an experimental arrangement that allows greater control of the deformation than is possible in actual penetrator tests, yet approximates the deformation processes imposed by a penetrator. Using explosive line charges placed in a central borehole, we loaded cylindrical specimens in a manner equivalent to an increment of penetration, allowing the measurement of the associated strains and accelerations and the retrieval of specimens from the more-or-less intact cylinder. Results show clearly that the deformation zone is highly concentrated near the borehole, with almost no damage occurring beyond 1/2 a borehole diameter. This implies penetration is not strongly influenced by anything but the material within a diameter or so of the penetration. For penetrator tests, target size should not matter strongly once target diameters exceed some small multiple of the penetrator diameter. Penetration into jointed rock should not be much affected unless a discontinuity is within a similar range. Accelerations measured at several points along a radius from the borehole are consistent with highly-concentrated damage and energy absorption; At the borehole wall, accelerations were an order of magnitude higher than at 1/2 a diameter, but at the outer surface, 8 diameters away, accelerations were as expected for propagation through an elastic medium. Accelerations measured at the outer surface of the cylinders increased significantly with cure time for the concrete. As strength increased, less damage was observed near the explosively-driven borehole wall consistent with the lower energy absorption expected and observed for stronger concrete. As it is the energy absorbing properties of a target that ultimately stop a penetrator, we believe this may point the way to a more readily determined equivalent of the S number.

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Uncertainty and sensitivity analysis for models of complex systems

Sampling-based methods for uncertainty and sensitivity analysis are reviewed. The following topics are considered: (1) definition of probability distributions to characterize epistemic uncertainty in analysis inputs, (2) generation of samples from uncertain analysis inputs, (3) propagation of sampled inputs through an analysis, (4) presentation of uncertainty analysis results, and (5) determination of sensitivity analysis results.

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Identifying the primitive path mesh in entangled polymer liquids

Proposed for publication in J Polymer Science Part B: Polymer Physics.

Grest, Gary S.

Similar to entangled ropes, polymer chains cannot slide through each other. These topological constraints, the so-called entanglements, dominate the viscoelastic behavior of high-molecular-weight polymeric liquids. Tube models of polymer dynamics and rheology are based on the idea that entanglements confine a chain to small fluctuations around a primitive path which follows the coarse-grained chain contour. To establish the microscopic foundation for these highly successful phenomenological models, we have recently introduced a method for identifying the primitive path mesh that characterizes the microscopic topological state of computer-generated conformations of long-chain polymer melts and solutions. Here we give a more detailed account of the algorithm and discuss several key aspects of the analysis that are pertinent for its successful use in analyzing the topology of the polymer configurations. We also present a slight modification of the algorithm that preserves the previously neglected self-entanglements and allows us to distinguish between local self-knots and entanglements between distant sections of the same chain. Our results indicate that the latter make a negligible contribution to the tube and that the contour length between local self-knots, N{sub 1k} is significantly larger than the entanglement length N{sub e}.

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Data collection for cooperative water resources modeling in the Lower Rio Grande Basin, Fort Quitman to the Gulf of Mexico

Tidwell, Vincent C.; Brainard, James R.; Ennis, Martha L.

Water resource scarcity around the world is driving the need for the development of simulation models that can assist in water resources management. Transboundary water resources are receiving special attention because of the potential for conflict over scarce shared water resources. The Rio Grande/Rio Bravo along the U.S./Mexican border is an example of a scarce, transboundary water resource over which conflict has already begun. The data collection and modeling effort described in this report aims at developing methods for international collaboration, data collection, data integration and modeling for simulating geographically large and diverse international watersheds, with a special focus on the Rio Grande/Rio Bravo. This report describes the basin, and the data collected. This data collection effort was spatially aggregated across five reaches consisting of Fort Quitman to Presidio, the Rio Conchos, Presidio to Amistad Dam, Amistad Dam to Falcon Dam, and Falcon Dam to the Gulf of Mexico. This report represents a nine-month effort made in FY04, during which time the model was not completed.

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Programmable SAW development :Sandia/NASA project final report

Brocato, Robert W.

This report describes a project to develop both fixed and programmable surface acoustic wave (SAW) correlators for use in a low power space communication network. This work was funded by NASA at Sandia National Laboratories for fiscal years 2004, 2003, and the final part of 2002. The role of Sandia was to develop the SAW correlator component, although additional work pertaining to use of the component in a system and system optimization was also done at Sandia. The potential of SAW correlator-based communication systems, the design and fabrication of SAW correlators, and general system utilization of those correlators are discussed here.

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Effect of high-viscosity interphases on drainage between hydrophilic surfaces

Feibelman, Peter J.

Drainage of water from the region between an advancing probe tip and a flat sample is reconsidered under the assumption that the tip and sample surfaces are both coated by a thin water 'interphase' (of width {approx}a few nm) whose viscosity is much higher than the bulk liquid's. A formula derived by solving the Navier-Stokes equations allows one to extract an interphase viscosity of {approx}59 KPa-sec (or {approx}6.6x10{sup 7} times the viscosity of bulk water at 25C) from Interfacial Force Microscope measurements with both tip and sample functionalized hydrophilic by OH-terminated tri(ethylene glycol) undecylthiol, self-assembled monolayers.

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Secure computing using cryptographic assurance of execution correctness

Pierson, Lyndon G.

Current computing architectures are 'inherently insecure' because they are designed to execute ANY arbitrary sequence of instructions. As a result they are subject to subversion by malicious code. Our goal is to produce a cryptographic method of 'tamper-proofing' trusted code over a large portion of the software life cycle. We have developed a technique called 'faithful execution', to cryptographically protect instruction sequences from subversion. This paper presents an overview of, and the lessons learned from, our implementations of faithful execution in a Java virtual machine prototype and also in a configurable soft-core processor implemented in a field programmable gate array (FPGA).

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Photonic encryption : modeling and functional analysis of all optical logic

Tang, Jason D.; Robertson, Perry J.; Schroeppel, Richard C.

With the build-out of large transport networks utilizing optical technologies, more and more capacity is being made available. Innovations in Dense Wave Division Multiplexing (DWDM) and the elimination of optical-electrical-optical conversions have brought on advances in communication speeds as we move into 10 Gigabit Ethernet and above. Of course, there is a need to encrypt data on these optical links as the data traverses public and private network backbones. Unfortunately, as the communications infrastructure becomes increasingly optical, advances in encryption (done electronically) have failed to keep up. This project examines the use of optical logic for implementing encryption in the photonic domain to achieve the requisite encryption rates. This paper documents the innovations and advances of work first detailed in 'Photonic Encryption using All Optical Logic,' [1]. A discussion of underlying concepts can be found in SAND2003-4474. In order to realize photonic encryption designs, technology developed for electrical logic circuits must be translated to the photonic regime. This paper examines S-SEED devices and how discrete logic elements can be interconnected and cascaded to form an optical circuit. Because there is no known software that can model these devices at a circuit level, the functionality of S-SEED devices in an optical circuit was modeled in PSpice. PSpice allows modeling of the macro characteristics of the devices in context of a logic element as opposed to device level computational modeling. By representing light intensity as voltage, 'black box' models are generated that accurately represent the intensity response and logic levels in both technologies. By modeling the behavior at the systems level, one can incorporate systems design tools and a simulation environment to aid in the overall functional design. Each black box model takes certain parameters (reflectance, intensity, input response), and models the optical ripple and time delay characteristics. These 'black box' models are interconnected and cascaded in an encrypting/scrambling algorithm based on a study of candidate encryption algorithms. Demonstration circuits show how these logic elements can be used to form NAND, NOR, and XOR functions. This paper also presents functional analysis of a serial, low gate count demonstration algorithm suitable for scrambling/encryption using S-SEED devices.

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Self-assembly and dynamics of oxide nano-rods on NiAl(110)

Proposed for publication in Physical Review B.

Pierce, John P.; McCarty, Kevin F.

We observe the spontaneous formation of parallel oxide rods upon exposing a clean NiAl(110) surface to oxygen at elevated temperatures (850-1350 K). By following the self-assembly of individual nanorods in real time with low-energy electron microscopy (LEEM), we are able to investigate the processes by which the rods lengthen along their axes and thicken normal to the surface of the substrate. At a fixed temperature and O{sub 2} pressure, the rods lengthen along their axes at a constant rate. The exponential temperature dependence of this rate yields an activation energy for growth of 1.2 {+-} 0.1 eV. The rod growth rates do not change as their ends pass in close proximity (<40 nm) to each other, which suggests that they do not compete for diffusing flux in order to elongate. Both LEEM and scanning tunneling microscopy (STM) studies show that the rods can grow vertically in layer-by-layer fashion. The heights of the rods are extremely bias dependent in STM images, but occur in integer multiples of approximately 2-{angstrom}-thick oxygen-cation layers. As the rods elongate from one substrate terrace to the next, we commonly see sharp changes in their rates of elongation that result from their tendency to gain (lose) atomic layers as they descend (climb) substrate steps. Diffraction analysis and dark-field imaging with LEEM indicate that the rods are crystalline, with a lattice constant that is well matched to that of the substrate along their length. We discuss the factors that lead to the formation of these highly anisotropic structures.

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In-situ scanning probe microscopy of electrodeposited nickel

Dibble, Dean C.; Kelly, James J.

The performance characteristics and material properties such as stress, microstructure, and composition of nickel coatings and electroformed components can be controlled over a wide range by the addition of small amounts of surface-active compounds to the electroplating bath. Saccharin is one compound that is widely utilized for its ability to reduce tensile stress and refine grain size in electrodeposited nickel. While the effects of saccharin on nickel electrodeposition have been studied by many authors in the past, there is still uncertainty over saccharin's mechanisms of incorporation, stress reduction, and grain refinement. In-situ scanning probe microscopy (SPM) is a tool that can be used to directly image the nucleation and growth of thin nickel films at nanometer length scales to help elucidate saccharin's role in the development and evolution of grain structure. In this study, in-situ atomic force microscopy (AFM) and scanning tunneling microscopy (STM) techniques are used to investigate the effects of saccharin on the morphological evolution of thin nickel films. By observing mono-atomic height nickel island growth with and without saccharin present we conclude that saccharin has little effect on the nickel surface mobility during deposition at low overpotentials where the growth occurs in a layer-by-layer mode. Saccharin was imaged on Au(l11) terraces as condensed patches without resolved packing structure. AFM measurements of the roughness evolution of nickel films up to 1200 nm thick on polycrystalline gold indicate that saccharin initially increases the roughness and surface skewness of the deposit that at greater thickness becomes smoother than films deposited without saccharin. Faceting of the deposit morphology decreases as saccharin concentration increases even for the thinnest films that have 3-D growth.

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Results 87701–87800 of 99,299
Results 87701–87800 of 99,299