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Applications of molecular modeling to the design and characterization of materials

Carlson, G.A.

A variety of new molecular modeling tools are now available for studying molecular structures and molecular interactions, for building molecular structures from simple components using analytical data, and for studying the relationship of molecular structure to the energy of bonding and non-bonding interactions. These are proving quite valuable in characterizing molecular structures and intermolecular interactions and in designing new molecules. This paper describes the application of molecular modeling techniques to a variety of materials problems, including the probable modecular structures of coals, lignins, and hybrid inorganic-organic-organic systems (silsesquioxanes), the intercalation of small gas molecules in fullerene crystals, the diffusion of gas molecules through membranes, and the design, structure and function of biomimetic and nanocluster catalysts.

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Preliminary DIAL model

Gentry, Stephen M.

A unique end-to-end LIDAR sensor model has been developed supporting the concept development stage of the CALIOPE UV DIAL and UV laser-induced-fluorescence (LIF) efforts. The model focuses on preserving the temporal and spectral nature of signals as they pass through the atmosphere, are collected by the optics, detected by the sensor, and processed by the sensor electronics and algorithms. This is done by developing accurate component sub-models with realistic inputs and outputs, as well as internal noise sources and operating parameters. These sub-models are then configured using data-flow diagrams to operate together to reflect the performance of the entire DIAL system. This modeling philosophy allows the developer to have a realistic indication of the nature of signals throughout the system and to design components and processing in a realistic environment. Current component models include atmospheric absorption and scattering losses, plume absorption and scattering losses, background, telescope and optical filter models, PMT (photomultiplier tube) with realistic noise sources, amplifier operation and noise, A/D converter operation, noise and distortion, pulse averaging, and DIAL computation. Preliminary results of the model will be presented indicating the expected model operation depicting the October field test at the NTS spill test facility. Indications will be given concerning near-term upgrades to the model.

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The Utility-Scale Joint-Venture Program

Gallup, Donald R.

The Department of Energy`s Utility-Scale Joint-Venture (USJV) Program was developed to help industry commercialize dish/engine electric systems. Sandia National Laboratories developed this program and has placed two contracts, one with Science Applications International Corporation`s Energy Projects Division and one with the Cummins Power Generation Company. In this paper we present the designs for the two dish/Stirling systems that are being developed through the USJV Program.

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MAGENCO: A map generalization controller for Arc/Info

Ganter, John H.

The Arc/Info GENERALIZE command implements the Douglas-Peucker algorithm, a well-regarded approach that preserves line ``character`` while reducing the number of points according to a tolerance parameter supplied by the user. The authors have developed an Arc Macro Language (AML) interface called MAGENCO that allows the user to browse workspaces, select a coverage, extract a sample from this coverage, then apply various tolerances to the sample. The results are shown in multiple display windows that are arranged around the original sample for quick visual comparison. The user may then return to the whole coverage and apply the chosen tolerance. They analyze the ergonomics of line simplification, explain the design (which includes an animated demonstration of the Douglas-Peucker algorithm), and discuss key points of the MAGENCO implementation.

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Comparison of the KAMELEON fire model to large-scale open pool fire data

Nicolette, Vernon F.

A comparison of the KAMELEON Fire model to large-scale open pool fire experimental data is presented. The model was used to calculate large-scale JP-4 pool fires with and without wind, and with and without large objects in the fire. The effect of wind and large objects on the fire environment is clearly seen. For the pool fire calculations without any object in the fire, excellent agreement is seen in the location of the oxygen-starved region near the pool center. Calculated flame temperatures are about 200--300 K higher than measured. This results in higher heat fluxes back to the fuel pool and higher fuel evaporation rates (by a factor of 2). Fuel concentrations at lower elevations and peak soot concentrations are in good agreement with data. For pool fire calculations with objects, similar trends in the fire environment are observed. Excellent agreement is seen in the distribution of the heat flux around a cylindrical calorimeter in a rectangular pool with wind effects. The magnitude of the calculated heat flux to the object is high by a factor of 2 relative to the test data, due to the higher temperatures calculated. For the case of a large flat plate adjacent to a circular pool, excellent qualitative agreement is seen in the predicted and measured flame shapes as a function of wind.

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Resonator response to Non-Newtonian fluids

Martin, S.J.

The thickness-shear mode (TSM) resonator typically consists of a thin disk of AT-cut quartz with circular electrodes patterned on both sides. An RF voltage applied between these electrodes excites a shear mode mechanical resonance when the excitation frequency matches the crystal resonant frequency. When the TSM resonator is operated in contact with a liquid, the shear motion of the surface generates motion in the contacting liquid. The liquid velocity field, v{sub x}(y), can be determined by solving the one-dimensional Navier-Stokes equation. Newtonian fluids cause an equal increase in resonator motional resistance and reactance, R{sub 2}{sup (N)} = X{sub 2}{sup (N)}, with the response depending only on the liquid density-viscosity product ({rho}{eta}). Non-Newtonian fluids, as illustrated by the simple example of a Maxwell fluid, can cause unequal increases in motional resistance and reactance. For the Maxwell fluid, R{sub 2}{sup (M)} > X{sub 2}{sup (M)}, with relaxation time {tau} proportional to the difference between R{sub 2}{sup (M)}and X{sub 2}{sup (M)}. Early results indicate that a TSM resonator can be used to extract properties of non-Newtonian fluids.

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Determination of the shear modulus in self-assembled monolayers using quartz resonators

Schneider, T.W.; Martin, S.J.; Frye, G.C.

This work examined self-assembled monolayers (SAMs) of n-alkane thiols using quartz resonators to determine the shear storage and loss moduli. Network analyzer measurements of electrical admittance at fundamental and corresponding harmonic values are fit to an equivalent circuit model. Shear modulus depends on frequency; the modulus values are three orders of magnitude lower than expected for a liquid or elastomeric polymer, more like those of a dense gas or supercritical fluid. A density of around 0.45 g/cm{sup 3} is calculated for a dodecane thiol SAM; this is roughly half of the bulk density. In conclusion, quartz resonators can be used to inertially deform SAMs.

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How clean is clean: Non-destructive/direct methods of flux, residue detection

Stallard, Brian R.

The feasibility of three different non-destructive and direct methods of evaluating PCB (printed circuit boards) cleanliness was demonstrated. The detection limits associated with each method were established. In addition, the pros and cons of these methods as routine quality control inspection tools were discussed. OSEE (Optically Stimulated Electron Emission) was demonstrated to be a sensitive technique for detection of low levels of flux residues on insulating substances. However, future work including development of rugged OSEE instrumentation will determine whether the PCB industry can accept this technique in a production environment. FTIR (Fourier Transform Infrared) microscopy is a well established technique with well known characteristics. The inability of FTIR to discriminate an organic contaminant from an organic substrate limits its usefulness as a PCB line inspection tool, but it will still remain a technique for the QC/QA laboratory. One advantage of FTIR over the other two techniques described here is its ability to identify the chemical nature of the residue, which is important in Failure Mode Analysis. Optical imaging using sophisticated pattern recognition algorithms was found to be limited to high concentrations of residue. Further work on improved sensor techniques is necessary.

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The effects of spatial location of defect states on the switching characteristics of amorphous and polycrystalline silicon thin film transistors: A numerical simulation using AMPS 2-D

Smith, J.; Fonash, S.; Kalkan, A.

We demonstrate a two-dimensional device simulator for MOSFET structures that incorporates models for defect distributions and show predicted effects on device switching performance for various spatial distributions of defects in amorphous and polycrystalline silicon.

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Description of a high temperature quenching furnace for the study of the directional solidification of nickel-base superalloys

Schmale, David T.

A high temperature resistance furnace has been modified for the study of directional solidification of nickel-base superalloys such as alloys 718 and 625. The furnace will be used to study segregation and solidification phenomena that occur in consumable-electrode melting processes such as vacuum arc remelting and electro-slag remelting. The system consists of a water cooled high temperature furnace (maximum temperature {approximately}2900 C), roughing vacuum,system, cooling system, cooled hearth, molten metal quenching bath, and a mechanism to lower the hearth from the furnace into the molten metal bath. The lowering mechanism is actuated by a digital stopping motor with a programmable controller. The specimen (1.9 cm dia {times} 14 cm long) is melted and contained within an alumina tube (2.54 cm dia {times} 15.24 cm long) which is seated on a copper hearth cooled with {approximately}13 C water. Directional solidification can then be accomplished by decreasing the furnace temperature while holding the specimen in position, maintaining the temperature gradient in the furnace and lowering the specimen at a controlled rate or a combination of both. At any point the specimen can be lowered rapidly into the 70 C molten metal bath to quench the specimen, preserve the solidification structure, and minimize solid state diffusion, enhancing the ability to study the localized solidification conditions.

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ATM-test: A workstation-based software suite for testing asynchronous transfer mode (ATM) networks

Tarman, Thomas D.

The design of a software package that provides a variety of Asynchronous Transfer Mode (ATM) test functions is presented here. These functions include cell capture, protocol decode for Transmission Control Protocol/Internet Protocol (TCP/IP) services, removal of cells (to support testing of an ATM system under cell loss conditions), and echo functions. This package is currently written to operate on the Sun Microsystems SPARCstation 10/SunOS 4.1.3 environment with a Fore Systems SBA-100 Sbus ATM adapter (140 Mbit/s TAXI interface), and the DEC 5000/240 running ULTRIX 4.2A with a Fore Systems TCA-100 TurboChannel adapter. Application scenarios and performance measurements of this software package on these host environments are presented here.

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Crisis Prevention Centers as confidence building measures: Suggestions for Northeast Asia

Pregenzer, Arian L.

Relationships between countries normally war and peace. Crisis prevention activities will be particularly important in this area, and should have two goals: (1) stabilizing tense situations that could push countries toward war and (2) supporting or reenforcing efforts to move countries toward a state of peace. A Crisis Prevention Center (CPC) will facilitate efforts to achieve these goals and its functions can be grouped into three broad, inter-related categories: (1) establishing and facilitating communication among participating countries, (2) supporting negotiations and consensus-building on regional security issues, and (3) supporting implementation of agreed confidence and security building measures. Appropriate activities in each of these categories will depend on the relations among participating countries. Technology will play a critical role in a establishing communication systems to ensure the timely flow of information between countries and to provide the means for organizing and analyzing this information. Technically-based cooperative monitoring can provide an objective source of information on mutually agreed issues, thereby supporting the implementation of confidence building measures and treaties. In addition, technology itself can be a neutral subject of interaction and collaboration between technical communities from different countries. Establishing a CPC in Northeast Asia does not require the existence of an Asian security regime. Indeed, activities that occur under the auspices of a CPC, even highly formalized exchanges of agreed information, can increase transparency, and thereby pave the way for future regional cooperation. Major players in Northeast Asian security are Japan, Russia, China, North and South Korea, and the United States.

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Paramagnetic point defects in amorphous thin films of SiO{sub 2} and Si{sub 3}N{sub 4}: An update

Warren, William L.

Recent research on point defects in thin films of SiO{sub 2} and Si{sub 3}SN{sub 4} on Si is presented and reviewed. In SiO{sub 2} it is now clear that no one type of E{prime} center is the sole source of radiation-induced positive charge; hydrogenous moieties or other types of E{prime} are proposed. Molecular orbital theory and easy passivation of E{prime} by H{sub 2} suggest that released H might depassivate P{sub b} sites. A charged E{prime}{sub {delta}} center has been seen in Cl-free SIMOX and thermal oxide film, and it is reassigned to an electron delocalized over four O{sub 3}{equivalent_to}Si units around a fifth Si. In Si{sub 3}N{sub 4} a new model for the amphoteric charging of Si{equivalent_to}N{sub 3} moieties is based on local shifts in defect energy with respect to the Fermi level, arising from nonuniform composition; it does not assume negative-U electron correlation. A new defect NN{sub 2}{sup 0} has been identified, with dangling orbital on a 2-coordinated N atom bonded to another N.

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Parallel performance of a preconditioned CG solver for unstructured finite element applications

Shadid, John N.

A parallel unstructured finite element (FE) implementation designed for message passing machines is described. This implementation employs automated problem partitioning algorithms for load balancing unstructured grids, a distributed sparse matrix representation of the global finite element equations and a parallel conjugate gradient (CG) solver. In this paper a number of issues related to the efficient implementation of parallel unstructured mesh applications are presented. These include the differences between structured and unstructured mesh parallel applications, major communication kernels for unstructured CG solvers, automatic mesh partitioning algorithms, and the influence of mesh. partitioning metrics on parallel performance. Initial results are presented for example finite element (FE) heat transfer analysis applications on a 1024 processor nCUBE 2 hypercube. Results indicate over 95% scaled efficiencies are obtained for some large problems despite the required unstructured data communication.

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Yield of the Non-Proliferation Experiment from the Leo Brady Seismic Net

Garbin, H.D.

The Leo Brady Seismic Net (LBSN) has been used to estimate seismic yields on US nuclear explosion tests for over 30 years. One of the concerns that Non-Proliferation Experiment (NPE) addresses is the yield equivalence between a large conventional explosion and a nuclear explosion. The LSBN consists of five stations that surround the Nevada Test Site (NTS). Because of our previous experience in measuring nuclear explosion yields, we operated this net to record NPE signals. Comparisons were made with 9 nuclear tests in the same volcanic tuff medium and within an 800 m range of the NPE source. The resulting seismic yield determined by each nuclear test ranged from 1.3 to 2.2 kT. Using the same techniques in determining nuclear explosion yields, the 1 kT NPE was measured at 1.7 kT nuclear equivalent yield with a standard deviation of 16%. The individual stations show a non-symmetric radiation pattern with more energy transmitted to the north and south. Comparisons with an nuclear event does not sow any obvious differences between the two tests.

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Smart gun technologies: One method of eliminating unauthorized firearm use

Weiss, D.R.

Law enforcement officers work each day with individuals who can become aggressive and violent. Among the worst scenarios, which occur each year and often raise national media attention, an officer has his handgun taken away and used against him. As many as 12 officers per year are killed with their own gun. This problem can be addressed through the integration of modern sensors with control electronics to provide authorized user firearms for law enforcement and even recreational uses. A considerable benefit to law enforcement agencies, as well as society as a whole, would be gained by the application of recommended Smart Gun Technologies (SGT) as a method of limiting the use of firearms to authorized individuals. Sandia National Laboratory has been actively involved in the research and design of technologically sophisticated surety devices for weapons for the DOE and DOD. This experience is now being applied to criminal justice problems by transferring these technologies to commercial industry. In the SGT project Sandia is developing the user requirements that would limit a firearms use to its owner and/or authorized users. Various technologies that are capable of meeting the requirements are being investigated, these range from biometrics identification to radio-controlled devices. Research is presently underway to investigate which technologies represent the best solutions to the problem. Proof of concept demonstration models are being built for the most promising SGT with the intent of technology transfer. Different solutions are recommended for the possible applications: law enforcement, military, and commercial (personal protection/recreational) use.

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A starting point for Risk Assessment: The Fault Mode and Effects Analysis (FMEA)

Fine, A.M.

This paper describes and discusses a basic safety analysis technique which may be useful for the beginning process of Risk Assessment and Risk Management. The technique uses judgmental factors on the part of analysts rather than dependence upon numerical techniques associated with more detailed analysis. The basic technique is presented and coupled to risk charts which may vary depending upon the intent of the analysis and the output required for the particular situation. Some variations are included to show how the technique may be used for prioritization of competing resources for necessary work.

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Free-field seismic ground motion in non-proliferation experiment

Garbin, H.D.

In addition to stress and acceleration measurements made in the inelastic regime, Sandia fielded two triaxial accelerometer packages in the seismic free-field for the NON-PROLIFERATION EXPERIMENT (NPE). The gauges were located at ranges of 190 and 200 m from the center of the ANFO-laden cavity on the opposite sides of a vertical fault. This location allowed us to assess several different seismological aspects related to non-proliferation. The radial and vertical components of the two packages show similar motion. Comparisons are made with similar data from nuclear tests to estimate yield, calculate seismic energy release and to detect spectral differences between nuclear and non-nuclear explosions. The wave forms of NPE differ significantly from nuclear explosions. The first two peak amplitudes of NPE are comparable while the nuclear explosion initial peak is much larger than the second peak. The calculated seismic energies imply that the conventional explosions couple to the medium much better at low frequencies than do nuclear explosions and that nuclear explosions contain more high frequency energy than NPE. Radial and vertical accelerations were integrated for displacement and indicate there was movement across the fault.

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A novel lead-free solder replacement

Vianco, Paul T.

Environmental and toxicity concerns related to the use of lead have initiated the search for acceptable, alternate joining materials for electronics assembly. This paper describes a novel lead-free solder designed as a ``drop in`` replacement for common tin/lead eutectic solder. The physical and mechanical properties of this solder are discussed in comparison to tin/lead eutectic solder. The performance of this solder when used for electronics assembly is discussed and compared to other common solders. Fatigue testing results are reported for thermal cycling electronics assemblies soldered with this lead-free composition. The paper concludes with a discussion on indium metal availability, supply and price.

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Systems modeling: The first step in a process for solving the health care cost problem

Gover, J.

The core problem with the US health care system is -- it already costs to much and the rate of its cost growth is cause for further alarm. To deal with these, regulators must introduce incentives for health care providers to reduce costs and introduce incentives that make consumers of health care services concerned about the costs of the services they demand. Achievement of these regulatory goals will create opportunities for the introduction of innovations, including revolutionary new technology, that can lead to major reductions in costs. Modeling of health care system inputs, outputs, transactions, and the relationships between these parameters will expedite the development of an effective regulatory process. This model must include all of those major factors that affect the demand for health care and it must facilitate benchmarking health care subsystems against the most efficient international practices.

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Microtextured resonators for measuring liquid properties

Martin, S.J.

The response of smooth- and textured-surface thickness-shear mode (TSM) quartz resonators in liquid has been examined. Smooth devices, which viscously entrain a layer of contacting liquid, exhibit a response that depends on the product of liquid density and viscosity. Textured-surface devices, with either randomly rough or regularly patterned features, also trap liquid in surface features, exhibiting an additional response that depends on liquid density alone. Combining smooth- and textured-surface resonators in a monolithic sensor enables simultaneous extraction of liquid density and viscosity.

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Quartz resonator state-of-charge monitor for lead-acid batteries

Cernosek, R.W.

We have demonstrated that a thickness shear mode quartz resonator can be used as a real-time, in situ monitor of the state-of-charge of lead-acid batteries. The resonator is sensitive to hanges in the density and viscosity of the sulfuric acid electrolyte. Both of these liquid parameters vary monotonically with the battery state-of-charge. This new monitor is more precise than sampling hydrometers, and since it is compatible with the Corrosive electrolyte environment, it can be used for in situ monitoring. A TSM resonator consists of gold electrodes deposited on opposite surfaces of a thin AT-cut quartz crystal. When an RF voltage is applied to the electrodes, a shear strain is introduced in the piezoelectric quartz and mechanical resonance occurs between the surfaces. A liquid in contact with one of the quartz surfaces is viscously entrained, which perturbs the resonant frequency and resonance magnitude. If the surface is smooth, the changes in both frequency and magnitude are proportional to ({rho}{eta}) {sup {1/2}}, where {rho} is the liquid density and {eta} is the viscosity.

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Synthetic aperture radar processing with tiered subapertures

Doerry, Armin

Synthetic Aperture Radar (SAR) is used to form images that are maps of radar reflectivity of some scene of interest, from range soundings taken over some spatial aperture. Additionally, the range soundings are typically synthesized from a sampled frequency aperture. Efficient processing of the collected data necessitates using efficient digital signal processing techniques such as vector multiplies and fast implementations of the Discrete Fourier Transform. Inherent in image formation algorithms that use these is a trade-off between the size of the scene that can be acceptably imaged, and the resolution with which the image can be made. These limits arise from migration errors and spatially variant phase errors, and different algorithms mitigate these to varying degrees. Two fairly successful algorithms for airborne SARs are Polar Format processing, and Overlapped Subaperture (OSA) processing. This report introduces and summarizes the analysis of generalized Tiered Subaperture (TSA) techniques that are a superset of both Polar Format processing and OSA processing. It is shown how tiers of subapertures in both azimuth and range can effectively mitigate both migration errors and spatially variant phase errors to allow virtually arbitrary scene sizes, even in a dynamic motion environment.

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A model for laboratory tech transfer investment

Otey, G.R.

A simple model has been developed to address a pragmatic question: What fraction of its research and development budget should a national laboratory devote to enhancing technology in the private sector? In dealing with lab-wide budgets in an aggregate sense, the model uses three parameters - fraction of lab R&D transferable to industry, transfer efficiency and payback to laboratory missions - to partition fixed R&D resources between technology transfer and core missions. It is a steady-state model in that the transfer process is assumed to work in equilibrium with technology generation. The results presented should be of use to those engaged in managing and overseeing federal laboratory technology transfer activities.

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Procedure for contact electrical resistance measurements as developed for use at Sandia National Laboratories

Finch, J.L.

Military Specifications call out general procedures and guidelines for conducting contact resistance measurements on chemical conversion coated panels. This paper deals with a test procedure developed at Sandia National Laboratories used to conduct contact electrical resistance on non-chromated conversion coated test panels. MIL-C-81706 {open_quotes}Chemical Conversion Materials For Coating Aluminum and Aluminum Alloys{close_quotes} was the reference specification used for guidance.

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Analysis of the photodiode boundary layer transition indicator. LDRD final report

Kuntz, David W.

The photodiode transition indicator is a device which has been successfully used to determine the onset of boundary layer transition on numerous hypersonic flight vehicles. The exact source of the electromagnetic radiation detected by the photodiode at transition was not understood. In some cases early saturation of the device occurred, and the device failed to detect transition. Analyses have been performed to determine the source of the radiation producing the photodiode signal. The results of these analyses indicate that the most likely source of the radiation is blackbody emission from the heatshield material bordering the quartz window of the device. Good agreement between flight data and calculations based on this radiation source has been obtained. Analyses also indicate that the most probable source of the radiation causing early saturation is blackbody radiation from carbon particles which break away from the nosetip during the ablation process.

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The response of aeroshells to lightning

Loescher, Douglas H.

Electrical discharges from a lightning simulator were directed at Mk12 aeroshells. Buckling of the aluminum substrate was observed after some 100-kA shots, and severe damage consisting of tearing of the aluminum and the production of inward flying aluminum shrapnel was observed after some 200-kA peak-current shots. Some shots resulted in severe damage to both the aluminum and the carbon-phenolic ablative material. It is reasonable to conclude from the experimental results that a lightning stroke with very high-peak current could, by itself, produce an opening in an Mk12 aeroshell. Because the aeroshell is part of the nuclear explosive safety exclusion region for the Mk12/W62 nuclear weapon, an opening would significantly reduce the assured safety of the weapon. It is unlikely that the observed interaction between lightning and the aeroshells would have been predicted by any form of computer simulation.

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Defining a controller architecture for the Long-Reach Manipulator

Ford, W.E.

To draft a procurement specification for the Long-Reach Manipulator (LRM), the benefits and limitations of the various robotic control system architectures available need to be determined. This report identifies and describes the advantages and potential disadvantages of using an open control system versus a closed (or proprietary) system, focusing on integration of interfaces for sensors, end effectors, tooling, and operator interfaces. In addition, the various controls methodologies of several recent systems are described. Finally, the reasons behind the recommendation to procure an open control system are discussed.

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Annular precision linear shaped charge flight termination system for the ODES program

Vigil, Manuel G.

The work for the development of an Annular Precision Linear Shaped Charge (APLSC) Flight Termination System (FTS) for the Operation and Deployment Experiment Simulator (ODES) program is discussed and presented in this report. The Precision Linear Shaped Charge (PLSC) concept was recently developed at Sandia. The APLSC component is designed to produce a copper jet to cut four inch diameter holes in each of two spherical tanks, one containing fuel and the other an oxidizer that are hyperbolic when mixed, to terminate the ODES vehicle flight if necessary. The FTS includes two detonators, six Mild Detonating Fuse (MDF) transfer lines, a detonator block, detonation transfer manifold, and the APLSC component. PLSCs have previously been designed in ring components where the jet penetrating axis is either directly away or toward the center of the ring assembly. Typically, these PLSC components are designed to cut metal cylinders from the outside inward or from the inside outward. The ODES program requires an annular linear shaped charge. The (Linear Shaped Charge Analysis) LESCA code was used to design this 65 grain/foot APLSC and data comparing the analytically predicted to experimental data are presented. Jet penetration data are presented to assess the maximum depth and reproducibility of the penetration. Data are presented for full scale tests, including all FTS components, and conducted with nominal 19 inch diameter, spherical tanks.

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A statistical description of the types and severities of accidents involving tractor semi-trailers

Clauss, David B.

This report provides a statistical description of the types and severities of tractor semi-trailer accidents involving at least one fatality. The data were developed for use in risk assessments of hazardous materials transportation. Several accident databases were reviewed to determine their suitability to the task. The TIFA (Trucks Involved in Fatal Accidents) database created at the University of Michigan Transportation Research Institute was extensively utilized. Supplementary data on collision and fire severity, which was not available in the TIFA database, were obtained by reviewing police reports for selected TIFA accidents. The results are described in terms of frequencies of different accident types and cumulative distribution functions for the peak contact velocity, rollover skid distance, fire temperature, fire size, fire separation, and fire duration.

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Overview of the instrument control and data reduction software in the Sandia data acquisition system at the Nevada Test Site

Boyer, W.B.

Sandia National Laboratories has developed a sophisticated custom digital data acquisition system to record data from a wide variety of experiments conducted on nuclear weapons effects tests at the Nevada Test Site (NTS). Software is a critical part of this data acquisition system. In particular software has been developed to support an instrumentation/experiment setup database, interactive and automated instrument control, remote data readout and processing, plotting, interactive data analysis, and automated calibration. Some software is also used as firmware in custom subsystems incorporating embedded microprocessors. The software operations are distributed across the nearly 40 computer nodes that comprise the NTS Wide Area Computer Network. This report is an overview of the software developed to support this data acquisition system. The report also provides a brief description of the computer network and the various recording systems used.

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Surftherm: A program to analyze thermochemical and kinetic data in gas-phase and surface chemical reaction mechanisms

Coltrin, Michael E.

This report documents the Surftherm program that analyzes transport coefficient, thermochemical- and kinetic rate information in complex gas-phase and surface chemical reaction mechanisms. The program is designed for use with the Chemkin (gas-phase chemistry) and Surface Chemkin (heterogeneous chemistry) programs. It was developed as a ``chemist`s companion`` in using the Chemkin packages with complex chemical reaction mechanisms. It presents in tabular form detailed information about the temperature and pressure dependence of chemical reaction rate constants and their reverse rate constants, reaction equilibrium constants, reaction thermochemistry, chemical species thermochemistry and transport properties. This report serves as a user`s manual for use of the program, explaining the required input and the output.

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Stability evaluation of the Markel Mine at Weeks Island, Louisiana

Hoffman, Edward L.

A three dimensional (3D) finite element analysis of the Markel Mine located on Weeks Island was performed to: (1) evaluate the stability of the mine and (2) determine the effect of mine failure on the nearby Morton Salt mine and SPR facilities. The first part of the stability evaluation investigates the effect of pillar failure on mine stability. These simulations revealed that tensile stresses and dilatant damage develop in the overlying salt as a result of pillar loss. These tensile stresses extend to the salt/overburden interface only for the case where all 45 of the pillars are assumed to fail. Tensile stresses would likely cause microfracturing of the salt, resulting in a flow path for groundwater from the overlying aquifer to enter the mine. The dilatant damage bridges between the mine and the overburden in the case where 15 or more pillars are removed from the model. Dilatant damage is attributed to microfracturing or changes in the pore structure of the salt and could also result in a flow path for groundwater to enter the mine. The second part of the Markel Mine evaluation investigates the stability of the pillars with respect to three failure mechanisms: tensile failure, compressive failure, and creep rupture. A 3D slabbing pillar model of the Markel mine was developed to investigate progressive failure of the pillars and the effect of slabbing on mine stability. Based on a strain-limiting creep rupture criterion, pillar failure is predicted to be extensive at present. The associated loss of pillar strength should be equivalent to removing all pillars from the model as was done in the first part of this stability analysis, resulting in the possibility of ground water intrusion. Since creep rupture is not a well understood phenomenon, further development and validation of this criterion is recommended.

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Evaluation of population density and distribution criteria in nuclear power plant siting

Young, Mary L.

The NRC has proposed revisions to 10 CFR 100 which include the codification of nuclear reactor site population density limits to 500 people per square mile, at the siting stage, averaged over any radial distance out to 30 miles, and 1,000 people per square mile within the 40-year lifetime of a nuclear plant. This study examined whether there are less restrictive alternative population density and/or distribution criteria which would provide equivalent or better protection to human health in the unlikely event of a nuclear accident. This study did not attempt to directly address the issue of actual population density limits because there are no US risk standards established for the evaluation of population density limits. Calculations were performed using source terms for both a current generation light water reactor (LWR) and an advanced light water reactor (ALWR) design. The results of this study suggest that measures which address the distribution of the population density, including emergency response conditions, could result in lower average individual risks to the public than the proposed guidelines that require controlling average population density. Studies also indicate that an exclusion zone size, determined by emergency response conditions and reactor design (power level and safety features), would better serve to protect public health than a rigid standard applied to all sites.

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US House of Representatives Committee on Energy and Commerce Subcommittee on Energy and Power

Narath, A.

The President of Sandia National Laboratories, Albert Narath, made this presentation to the congressional subcommittee on February 3, 1994. In it he outlines the convergence of the defense and civilian technology bases, technology leadership, the government/industry relationship in science and technology, historical laboratory effectiveness, Sandia`s evolution to a multiprogram laboratory, Sandia`s energy programs today, planning for a changing operating environment, Sandia`s strategy for enhancing industrial competitiveness, R&D partnerships, technology deployment, entrepreneurial initiatives, and current DOE planning efforts. Appendices contain information on technology transfer initiatives in the fields of high-performance computing, materials and processes for manufacturing, energy and environment, microelectronics and photonics and advanced manufacturing. Also included are customer response highlights, information on dual-use research centers and user facilities, examples of technology transfer achievements, major accomplishments of 1993, and questions and answers from the subcommittee.

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Study of the effects of humidity on the W80 MC3268/3269 trajectory-sensing signal generators during stockpile laboratory testing

Alsbrooks, T.H.

This report documents the study that was performed from October 1993 through June 1994 to determine the effects of humidity on the W80 MC3268/3269 Trajectory-Sensing Signal Generators (TSSGs) during the test bed build and laboratory test processes. Mason and Hanger, Silas Mason Co., performs the disassembly and inspections along with the test bed build processes at the Pantex Plant in Amarillo, Texas. The laboratory testing of the TSSGs is performed at Sandia`s Weapons Evaluation Test Laboratory (WETL), located at the Pantex Plant. This report summarizes the historical sequence of events, the engineering analyses and decisions, and the future plans for controlling the ingress of moisture into the TSSGS during laboratory testing.

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The application of non-destructive techniques to the testing of a wind turbine blade

Sutherland, Herbert J.

NonDestructive Testing (NDT), also called NonDestructive Evaluation (NDE), is commonly used to monitor structures before, during, and after testing. This paper reports on the use of two NDT techniques to monitor the behavior of a typical wind turbine blade during a quasi-static test-to-failure. The two NDT techniques used were acoustic emission and coherent optical. The former monitors the acoustic energy produced by the blade as it is loaded. The latter uses electron shearography to measure the differences in surface displacements between two load states. Typical results are presented to demonstrate the ability of these two techniques to locate and monitor both high damage regions and flaws in the blade structure. Furthermore, this experiment highlights the limitations in the techniques that must be addressed before one or both can be transferred, with a high probability of success, to the inspection and monitoring of turbine blades during the manufacturing process and under normal operating conditions.

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The interconnection of photovoltaic power systems with the utility grid: An overview for utility engineers

Wills, R.H.

Utility-interactive (UI) photovoltaic power systems mounted on residences and commercial buildings are likely to become a small, but important source of electric generation in the next century. This is a new concept in utility power production--a change from large-scale central generation to small-scale dispersed generation. As such, it requires a re-examination of many existing standards and practices to enable the technology to develop and emerge into the marketplace. Much work has been done over the last 20 years to identify and solve the potential problems associated with dispersed power generation systems. This report gives an overview of these issues and also provides a guide to applicable codes, standards and other related documents. The main conclusion that can be drawn from this work is that there are no major technical barriers to the implementation of dispersed PV generating systems. While more technical research is needed in some specific areas, the remaining barriers are fundamentally price and policy.

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Structural stability of the Weeks Island oil repository

Preece, Dale S.

A 3-D finite element analysis was performed to evaluate the stability of the SPR upper and lower oil storage levels at Weeks Island. The mechanical analysis predicted stresses and strains from which pillar stability was inferred using a fracture criterion developed from previous testing of Weeks Island salt. This analysis simulated the sequential mining of the two levels and subsequent oil fill of the mine. The predicted subsidence rates compare well to those measured over the past few years. Predicted failure mechanisms agree with observations made at the time the mine was being modified for oil storage. The modeling technique employed here treats an infinite array of pillars and is a reasonable representation of the behavior at the center of the mine. This analysis predicts that the lower level pillars, at the center of the mine, have fractured and their stability at this time is questionable. Localized pillar fracturing is predicted and implies that the mine is entering a phase of continual time dependent deterioration. Continued and expanded monitoring of the facility and development of methods to assess and predict its behavior are more important now than ever.

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Load limiting parachute inflation control

Proceedings of SPIE - The International Society for Optical Engineering

Redmond, James M.

Excessive deceleration forces experienced during high speed deployment of parachute systems can cause damage to the payload and the canopy fabric. Conventional reefing lines offer limited relief by temporarily restricting canopy inflation and limiting the peak deceleration load. However, the open-loop control provided by existing reefing devices restrict their use to a specific set of deployment conditions. In this paper, the sensing, processing, and actuation that are characteristic of adaptive structures form the basis of three concepts for active control of parachute inflation. These active control concepts are incorporated into a computer simulation of parachute inflation. Initial investigations indicate that these concepts promise enhanced performance as compared to conventional techniques for a nominal release. Furthermore, the ability of each controller to adapt to off-nominal release conditions is examined.

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Reconfigurable optical switches with monolithic electrical-to-optical interfaces

Proceedings of SPIE - The International Society for Optical Engineering

Zolper, I.C.

Vertical-cavity surfaeeniitting lasers (VCSELs) can be integrated with heterojunction phototransistors (HPTs)and heterojunction bipolar transistors (HBTs) on the same wafer to form high speed optical and optoelectronic switches,respectively, that can be optically or electrically addressed. This permits the direct communcication and transmission ofdata between distributed electronic processors through an optical switching network. The experimental demonstration of anintegrated optoelectronic HBT/VCSEL switch combining a GaAs/A1GaAs heterojunction bipolar transistor (HBT) with aVCSEL is described below, using the same epilayer structure upon which binary HPT/VCSEL optical switches are alsobuilt. The monolithic }IBT/VCSEL switch has high current gain, low power dissipation, and a high optical to electricalconversion efficiency. Its modulation response has been measured and modeled.

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Reactor-pumped laser experimental results

Proceedings of SPIE - The International Society for Optical Engineering

Hebner, Gregory A.

Reactor pumped lasers have the potential to be scaled to multi-megawatt power levels with long run times. In proposed designs, the laser will be capable of output powers of several megawatts of power for run times of several hours. Such a laser would have many diverse applications such as material processing, space debris removal and power beaming to geosynchronous satellites or the moon. However, before such systems can be designed, fundamental laser parameters such as small signal gain, saturation intensity and efficiency must be determined over a wide operational parameter space. We have recently measured fundamental laser parameters for a selection of nuclear pumped visible and near IR laser transitions in atomic neon, argon and xenon. An overview of the results of this investigation will be presented.

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Reactor-pumped laser facility at DOE's Nevada Test Site

Proceedings of SPIE - The International Society for Optical Engineering

Lipinski, Ronald J.

The Nevada Test Site (NTS) is one excellent possibility for a laser power beaming site. It is in the low latitudes of the U.S., is in an exceptionally cloud-free area of the southwest, is already an area of restricted access (which enhances safety considerations), and possesses a highly-skilled technical team with extensive engineering and research capabilities from underground testing of our nation's nuclear deterrence. The average availability of cloud-free clear line of site to a given point in space is about 84%. With a beaming angle of ±60° from the zenith, about 52 geostationaiy-orbit (GEO) satellites could be accessed continuously from NTS. In addition, the site would provide an average view factor of about 10% for orbital transfer from low earth orbit to GEO. One of the major candidates for a long-duration, high-power laser is a reactor-pumped laser being developed by DOE. The extensive nuclear expertise at NTS makes this site a prime candidate for utilizing the capabilities of a reactor pumped laser for power beaming. The site then could be used for many dual-use roles such as industrial material processing research, defense testing, and removing space debris.

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A massively parallel algorithm for grand canonical Monte Carlo computer simulation with the short-ranged Lennard-Jones potential

Heffelfinger, Grant S.

We present a new massively parallel decomposition for grand canonical Monte Carlo computer simulation (GCMC) suitable for short ranged fluids. Our spatial algorithm relies on the fact that for short-ranged fluids, molecules separated by a greater distance than the reach of the potential act independently, thus different processors can work concurrently in regions of the same system which are sufficiently far apart. Several parallelization issues unique to GCMC are addressed such as the handling of the three different types of Monte Carlo move used in GCMC: the displacement of a molecule, the creation of a molecule, and the destruction of a molecule. The decomposition is shown to scale with system size, making it especially useful for systems where the physical problem dictates the system size, for example, fluid behavior in mesopores.

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Single event mirroring and sense amplifier designs for enhanced SE tolerance of DRAMs

Gulati, K.; Massengill, L.W.

This paper investigates the applicability of existing SRAM SEU hardening techniques to conventional CMOS cross-coupled sense amplifiers used in DRAM structures. We propose a novel SEU mirroring concept and implementation for hardening DRAMs to bitline hits. Simulations indicate a 24-fold improvement in critical charge during the sensing state using a 10K T-Resistor scheme and a 28-fold improvement during the highly susceptible high impedance state using 2pF dynamic capacitance coupling.

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A proposed SEU tolerant DRAM cell

Agrawal, G.R.

A novel DRAM cell technology consisting of an access transistor and a bootstrapped storage capacitor with an integrated breakdown diode is proposed. This design offers considerable resistance to single event cell hits. The information change packet is shielded from an SE hit by placing the vulnerable node in a self-compensating standby state. The proposed cell is comparable in size to a conventional DRAM cell, but simulations show an improvement in critical charge of two orders of magnitude.

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Results 93951–94000 of 96,771
Results 93951–94000 of 96,771