Publications

Elliptical crystal spectrometers equipped with time-gated microchannel plate (MCP) detectors provide time-, space-, and spectrally resolved data. A common problem is that the number of time resolution elements is limited by the number of MCP frames. The number of frames that fit on a given MCP is limited by the image size and the alignment tolerance. At the Z facility these problems have been addressed with twin-elliptical-crystal spectrometers. Using two crystals and detectors doubles the number of frames available. This enables measurements with ∼350 ps time resolution while still recording data from an ∼4 ns wide time window. Alternatively, the twin crystal design allows simultaneous measurements with different crystals to investigate different spectral regimes. © 2006 American Institute of Physics.

Using the physical process of ultraintense field ionization of high charge states of inert gas ions, we have developed a method of peak intensity measurement at the focus of high energy short pulse lasers operating in single shot mode. The technique involves detecting ionization products created from a low pressure gas target at the laser focus via time of flight detector. The observation of high ion charge states collected by the detector yields peak intensity at the focus when compared with the results obtained from well established tunnel ionization models. An initial peak intensity measurement of 5× 1016 W cm-2 was obtained for a 1.053 μm center wavelength, 0.4 J pulse with 1 ps pulse duration focused with an f5.5 off-axis parabola. Experiments with multijoule level, 500 fs laser pulses are on the way. © 2006 American Institute of Physics.

In optical firing sets, laser light is used to supply power to electronics (to charge capacitors, for example), to trigger electronics (such as vacuum switches), or in some cases, initiate explosives directly. Since MEMS devices combine electronics with electro-mechanical actuators, one can integrate safe and arm logic alongside the actuators to provide all functions in a single miniature package. We propose using MEMS-activated mirrors to make or break optical paths as part of the safe and arm architecture in an optical firing set. In the safe mode, a miniature (∼1 mm diameter) mirror is oriented to prevent completion of the optical path. To arm the firing set, the MEMS mirrors are deflected into the proper orientation thereby completing the optical path required for system functionality (e.g., light from a miniature laser completes the path to an optically triggered switch). The optical properties (i.e. damage threshold, reflectivity, transmission, absorption and scatter) of the miniature mirrors are critical to this application. Since Si is a strong absorber at the wavelengths under consideration (800 to 1064 nm), high-reflectivity, high-damage-threshold, dielectric coatings must be applied to the MEMS devices. In this paper we present conceptual MEMS-activated mirror architectures for performing arming and safing functions in an optical firing set and report test data which shows that dielectric coatings applied to MEMS-mirrors can withstand the prerequisite laser pulse irradiance. The measured optical damage threshold of polysilicon membranes with high-reflectivity multilayer dielectric coatings is ∼ 4 GW/cm 2, clearly demonstrating the feasibility of using coated MEMS mirrors in firing sets.

The LIGA microfabrication technique offers a unique method for fabricating 3-dimensional photonic lattices based on the Iowa State "logpile" structure. These structures represent the [111] orientation of the [100] logpile structures previously demonstrated by Sandia National Laboratories, The novelty to this approach is the single step process that does not require any alignment. The mask and substrate are fixed to one another and exposed twice from different angles using a synchrotron light source. The first exposure patterns the resist at an angle of 45 degrees normal to the substrate with a rotation of 8 degrees. The second exposure requires a 180 degree rotation about the normal of the mask and substrate. The resulting pattern is a vertically oriented logpile pattern that is rotated slightly off axis. The exposed PMMA is developed in a single step to produce an inverse lattice structure. This mold is filled with electroplated gold and stripped away to create a usable gold photonic crystal. Tilted logpiles demonstrate band characteristics very similar to those observed from [100] logpiles. Reflectivity tests show a band edge around 5 μm and compare well with numerical simulations.

The optical transfer of power is becoming important for military and industrial applications. The powering of electrical circuitry, sensors and actuators over optical fiber offers immunity from RF, EMI, voltage breakdown, lightning and high voltage hazards. Optical power transfer is being employed in industries such as electric power, communications, remote sensing, and aerospace. In this paper we address issues associated with the illumination of Series Connected Photovoltaic Arrays (SCPA). SCPAs are extremely sensitive to the uniformity of illumination. The performance of a photovoltaic array is dominated by the least illuminated cell. We introduce an analytical model that predicts the performance of a photovoltaic array for an arbitrary illumination. Experimental data on array performance is presented, and general issues associated with the problem of producing uniform illumination are discussed.

The use of photosensitive materials for the development of integrated, refractive-index structures supporting telecom, remote sensing, and varied optical beam manipulation applications is well established. Our investigations of photosensitive phenomena in polysilanes, however, have been motivated by the desire to configure, or program, the photonic device function immediately prior to use. Such an operational mode imposes requirements on wavelength sensitivity, incident fluence and environmental conditions that are not typical of more conventional applications of photosensitive material. The present paper focuses on our efforts to understand and manipulate photosensitivity in polysilane thin films under different excitation wavelengths, local atmospheric compositions and thermal history in this context. We find that the photoresponse can be influenced through the control of such optical exposure conditions, thereby influencing the magnitude of the photoinduced refractive-index change attained.

Biochemical reactions taking place in living systems that map different inputs to specific outputs are intuitively recognized as performing information processing. Conventional wisdom distinguishes such proteins, whose primary function is to transfer and process information, from proteins that perform the vast majority of the construction, maintenance, and actuation tasks of the cell (assembling and disassembling macromolecular structures, producing movement, and synthesizing and degrading molecules). In this paper, we examine the computing capabilities of biological processes in the context of the formal model of computing known as the random access machine (RAM) [Dewdney AK (1993) The New Turing Omnibus. Computer Science Press, New York], which is equivalent to a Turing machine [Minsky ML (1967) Computation: Finite and Infinite Machines. Prentice-Hall, Englewood Cliffs, NJ]. When viewed from the RAM perspective, we observe that many of these dynamic self-assembly processes - synthesis, degradation, assembly, movement - do carry out computational operations. We also show that the same computing model is applicable at other hierarchical levels of biological systems (e.g., cellular or organism networks as well as molecular networks). We present stochastic simulations of idealized protein networks designed explicitly to carry out a numeric calculation. We explore the reliability of such computations and discuss error-correction strategies (algorithms) employed by living systems. Finally, we discuss some real examples of dynamic self-assembly processes that occur in living systems, and describe the RAM computer programs they implement. Thus, by viewing the processes of living systems from the RAM perspective, a far greater fraction of these processes can be understood as computing than has been previously recognized. © Springer Science+Business Media, Inc. 2006.

Electron beam welding is a well known process used where high precision, high reliability welds are needed, often in exotic materials. Recently, it has been proposed to apply the electron beam produced in a standard scanning electron microscope (SEM), with reversible modifications to increase beam current, for microscale welding. In addition to providing the clean environment associated with the column vacuum, the SEM in imaging mode provides exceptional capabilities in visualising extremely small parts. Furthermore, the standard stage and beam motion controls offer the possibility of flexible programming of beam path with relatively minor software additions. In order to better evaluate the requirements for and effects of μE-beam welding (μEBW) on typical microtechnologically important materials, a clear understanding of the characteristics of the SEM's beam and its interaction with possible target materials is needed. The penetration ability of electrons depends strongly upon their accelerating voltage and the target they are being directed at. Hence, in some circumstances the beam may interact as a surface heat source, while in others it may act as a volume heat source, with important consequences on weld schedule development for the parts and geometry being welded. In this work, the authors explore some of the factors involved and propose simple models for the electron beam heat source which depend on the parameters being used. © 2006 Institute of Materials, Minerals and Mining.

Instrumented indentation was combined with microscopy and spectroscopy analysis to investigate the local mechanically induced ferroelectric to anti-ferroelectric phase transformation of niobium-modified lead zirconate titanate 95/5. Indentation experiments to a depth of 2 μm were performed using a Berkovich pyramidal three-sided diamond tip. Subsequent Raman spectroscopy and piezoelectric force microscopy revealed that indentation locally induced the ferroelectric to antiferroelectric phase transformation. Piezoelectric force microscopy demonstrated the ability to map the individual phases within and near indented regions on the niobium-modified lead zirconate titanate ceramics. © 2006 The American Ceramic Society.

The energy output of the high-level radioactive waste to be emplaced in the proposed geologic repository at Yucca Mountain, NV, will strongly affect the thermal-hydrological (TH) conditions in the near-drift fractured rock. Heating of rock water to above-boiling conditions will induce large water saturation changes and flux perturbations close to the waste emplacement tunnels (drifts) that will last several thousand years. Understanding these perturbations is important for the performance of the repository, because they could increase, for example, the amount of formation water seeping into the open drifts and contacting waste packages. Recent computational fluid dynamics analysis has demonstrated that the drifts will act as important conduits for gas flows driven by natural convection. As a result, vapor generated from boiling of formation water near elevated-temperature sections of the drifts may effectively be transported to cooler end sections (where no waste is emplaced), where it would condense and subsequently drain into underlying rock units. Thus, natural convection processes have great potential for reducing the near-drift moisture content in heated drift sections, which has positive ramifications for repository performance. To study these processes, we have developed a new simulation method that couples existing tools for simulating TH conditions in the fractured formation with modules that approximate natural convection and evaporation conditions in heated emplacement drifts. The new method is applied to evaluate the impact of in-drift natural convection on the future TH conditions at Yucca Mountain in a three-dimensional model domain comprising a representative emplacement drift and the surrounding fractured rock. © Soil Science Society of America.

Abstract not provided.

A decision was made early in the Tri-Lab Usage Model process, that the collection of the user requirements be separated from the document describing capabilities of the user environment. The purpose in developing the requirements as a separate document was to allow the requirements to take on a higher-level view of user requirements for ASC platforms in general. In other words, a separate ASC user requirement document could capture requirements in a way that was not focused on ''how'' the requirements would be fulfilled. The intent of doing this was to create a set of user requirements that were not linked to any particular computational platform. The idea was that user requirements would endure from one ASC platform user environment to another. The hope was that capturing the requirements in this way would assist in creating stable user environments even though the particular platforms would be evolving and changing. In order to clearly make the separation, the Tri-lab S&CS program decided to create a new title for the requirements. The user requirements became known as the ASC Computational Environment (ACE) Requirements.

Interest in the analysis of random vibrations of mechanical systems started to grow about a half century ago in response to the need for a theory that could accurately predict structural response to jet engine noise and missile launch-induced environments. However, the work that enabled development of the theory of random vibrations started about a half century earlier. This paper discusses contributions to the theory of random vibrations from the time of Einstein to the time of an MIT workshop that was organized by Crandall in 1958. © 2006 Elsevier Ltd. All rights reserved.

A very general and robust approach to solving continuous-variable optimization problems involving uncertainty in the objective function is through the use of ordinal optimization. At each step in the optimization problem, improvement is based only on a relative ranking of the uncertainty effects on local design alternatives, rather than on precise quantification of the effects. One simply asks ''Is that alternative better or worse than this one?'' -not ''HOW MUCH better or worse is that alternative to this one?'' The answer to the latter question requires precise characterization of the uncertainty--with the corresponding sampling/integration expense for precise resolution. However, in this report we demonstrate correct decision-making in a continuous-variable probabilistic optimization problem despite extreme vagueness in the statistical characterization of the design options. We present a new adaptive ordinal method for probabilistic optimization in which the trade-off between computational expense and vagueness in the uncertainty characterization can be conveniently managed in various phases of the optimization problem to make cost-effective stepping decisions in the design space. Spatial correlation of uncertainty in the continuous-variable design space is exploited to dramatically increase method efficiency. Under many circumstances the method appears to have favorable robustness and cost-scaling properties relative to other probabilistic optimization methods, and uniquely has mechanisms for quantifying and controlling error likelihood in design-space stepping decisions. The method is asymptotically convergent to the true probabilistic optimum, so could be useful as a reference standard against which the efficiency and robustness of other methods can be compared--analogous to the role that Monte Carlo simulation plays in uncertainty propagation.

Thermal properties of niobium-modified PZT95/5(1.8Nb) and PSZT ceramics used for the ferroelectric power supply have been studied from -100 C to 375 C. Within this temperature range, these materials exhibit ferroelectric-ferroelectric and ferroelectric-paraelectric phase transformations. The thermal expansion coefficient, heat capacity, and thermal diffusivity of different phases were measured. Thermal conductivity and Grueneisen constant were calculated at several selected temperatures between -60 C and 100 C. Results show that thermal properties of these two solid solutions are very similar. Phase transformations in these ceramics possess first order transformation characteristics including thermal hysteresis, transformational strain, and enthalpy change. The thermal strain in the high temperature rhombohedral phase region is extremely anisotropic. The heat capacity for both materials approaches to 3R (or 5.938 cal/(g-mole*K)) near room temperature. The thermal diffusivity and the thermal conductivity are quite low in comparison to common oxide ceramics, and are comparable to amorphous silicate glass. Furthermore, the thermal conductivity of these materials between -60 C and 100 C becomes independent of temperature and is sensitive to the structural phase transformation. These phenomena suggest that the phonon mean free path governing the thermal conductivity in this temperature range is limited by the lattice dimensions, which is in good agreement with calculated values. Effects of small compositional changes and density/porosity variations in these ceramics on their thermal properties are also discussed. The implications of these transformation characteristics and unusual thermal properties are important in guiding processing and handling procedures for these materials.

A procedure for extending the size of a Latin hypercube sample (LHS) with rank correlated variables is described and illustrated. The extension procedure starts with an LHS of size m and associated rank correlation matrix C and constructs a new LHS of size 2m that contains the elements of the original LHS and has a rank correlation matrix that is close to the original rank correlation matrix C. The procedure is intended for use in conjunction with uncertainty and sensitivity analysis of computationally demanding models in which it is important to make efficient use of a necessarily limited number of model evaluations.

Atmospheric pressure chemical vapor deposition (APCVD) of tin oxide is a very important manufacturing technique used in the production of low-emissivity glass. It is also the primary method used to provide wear-resistant coatings on glass containers. The complexity of these systems, which involve chemical reactions in both the gas phase and on the deposition surface, as well as complex fluid dynamics, makes process optimization and design of new coating reactors a very difficult task. In 2001 the U.S. Dept. of Energy Industrial Technologies Program Glass Industry of the Future Team funded a project to address the need for more accurate data concerning the tin oxide APCVD process. This report presents a case study of on-line APCVD using organometallic precursors, which are the primary reactants used in industrial coating processes. Research staff at Sandia National Laboratories in Livermore, CA, and the PPG Industries Glass Technology Center in Pittsburgh, PA collaborated to produce this work. In this report, we describe a detailed investigation of the factors controlling the growth of tin oxide films. The report begins with a discussion of the basic elements of the deposition chemistry, including gas-phase thermochemistry of tin species and mechanisms of chemical reactions involved in the decomposition of tin precursors. These results provide the basis for experimental investigations in which tin oxide growth rates were measured as a function of all major process variables. The experiments focused on growth from monobutyltintrichloride (MBTC) since this is one of the two primary precursors used industrially. There are almost no reliable growth-rate data available for this precursor. Robust models describing the growth rate as a function of these variables are derived from modeling of these data. Finally, the results are used to conduct computational fluid dynamic simulations of both pilot- and full-scale coating reactors. As a result, general conclusions are reached concerning the factors affecting the growth rate in on-line APCVD reactors. In addition, a substantial body of data was generated that can be used to model many different industrial tin oxide coating processes. These data include the most extensive compilation of thermochemistry for gas-phase tin-containing species as well as kinetic expressions describing tin oxide growth rates over a wide range of temperatures, pressures, and reactant concentrations.

Laser Engineered Net Shaping{trademark} (LENS{reg_sign}) is a unique, layer additive, metal manufacturing technique that offers the ability to create fully dense metal features and components directly from a computer solid model. LENS offers opportunities to repair and modify components by adding features to existing geometry, refilling holes, repairing weld lips, and many other potential applications. The material deposited has good mechanical properties with strengths typically slightly higher that wrought material due to grain refinement from a quickly cooling weld pool. The result is a material with properties similar to cold worked material, but without the loss in ductility traditionally seen with such treatments. Furthermore, 304L LENS material exhibits good corrosion resistance and hydrogen compatibility. This report gives a background of the LENS process including materials analysis addressing the requirements of a number of different applications. Suggestions are given to aid both the product engineer and the process engineer in the successful utilization of LENS for their applications. The results of testing on interface strength, machinability, weldability, corrosion resistance, geometric effects, heat treatment, and repair strategy testing are all included. Finally, the qualification of the LENS process is briefly discussed to give the user confidence in selecting LENS as the process of choice for high rigor applications. The testing showed LENS components to have capability in repair/modification applications requiring complex castings (W80-3 D-Bottle bracket), thin wall parts requiring metal to be rebuilt onto the part (W87 Firing Set Housing and Y-12 Test Rings), the filling of counterbores for use in reservoir reclamation welding (SRNL hydrogen compatibility study) and the repair of surface defects on pressure vessels (SRNL gas bottle repair). The material is machinable, as testing has shown that LENS deposited material machines similar to that of welded metal. Tool wear is slightly higher in LENS material than in wrought material, but not so much that one would be concerned with increased tooling cost. The LENS process achieved process qualification for the AY1E0125 D-Bottle Bracket from the W80-3 LEP program, and in the effort, also underwent testing in weapons environments. These tests included structural dynamic response testing and drop testing. The LENS deposited parts were compared in these tests with conventionally machined parts and showed equivalency to such an extent that the parts were accepted for use in parallel path subsystem-level weapon environment testing. The evaluation of LENS has shown that the process can be a viable option when either complete metal parts are needed or existing metal parts require modification or repair. The LENS Qualification Technology Investment team successfully investigated new applications for the LENS process and showed that it has great applicability across the Nuclear Weapons Complex as well as in other high rigor applications.

The LENS Qualification team had the goal of performing a process qualification for the Laser Engineered Net Shaping{trademark}(LENS{reg_sign}) process. Process Qualification requires that a part be selected for process demonstration. The AY1E0125 D-Bottle Bracket from the W80-3 was selected for this work. The repeatability of the LENS process was baselined to determine process parameters. Six D-Bottle brackets were deposited using LENS, machined to final dimensions, and tested in comparison to conventionally processed brackets. The tests, taken from ES1E0003, included a mass analysis and structural dynamic testing including free-free and assembly-level modal tests, and Haversine shock tests. The LENS brackets performed with very similar characteristics to the conventionally processed brackets. Based on the results of the testing, it was concluded that the performance of the brackets made them eligible for parallel path testing in subsystem level tests. The testing results and process rigor qualified the LENS process as detailed in EER200638525A.

The purpose of this project is to develop tools to model and simulate the processes of self-assembly and growth in biological systems from the molecular to the continuum length scales. The model biological system chosen for the study is the tendon fiber which is composed mainly of Type I collagen fibrils. The macroscopic processes of self-assembly and growth at the fiber scale arise from microscopic processes at the fibrillar and molecular length scales. At these nano-scopic length scales, we employed molecular modeling and simulation method to characterize the mechanical behavior and stability of the collagen triple helix and the collagen fibril. To obtain the physical parameters governing mass transport in the tendon fiber we performed direct numerical simulations of fluid flow and solute transport through an idealized fibrillar microstructure. At the continuum scale, we developed a mixture theory approach for modeling the coupled processes of mechanical deformation, transport, and species inter-conversion involved in growth. In the mixture theory approach, the microstructure of the tissue is represented by the species concentration and transport and material parameters, obtained from fibril and molecular scale calculations, while the mechanical deformation, transport, and growth processes are governed by balance laws and constitutive relations developed within a thermodynamically consistent framework.

Laser Engineered Net Shaping{trademark} (LENS{reg_sign}) is a layer additive manufacturing process that creates fully dense metal components using a laser, metal powder, and a computer solid model. This process has previously been utilized in research settings to create metal components and new material alloys. The ''Qualification of LENS for the Repair and Modification of Metal NWC Components'' project team has completed a Technology Investment project to investigate the use of LENS for repair of high rigor components. The team submitted components from four NWC sites for repair or modification using the LENS process. These components were then evaluated for their compatibility to high rigor weapons applications. The repairs included hole filling, replacement of weld lips, addition of step joints, and repair of surface flaws and gouges. The parts were evaluated for mechanical properties, corrosion resistance, weldability, and hydrogen compatibility. This document is a record of the LENS processing of each of these component types and includes process parameters, build strategies, and lessons learned. Through this project, the LENS process was shown to successfully repair or modify metal NWC components.

Due to increasing concerns over the buildup of long-lived transuranic isotopes in spent nuclear fuel waste, attention has been given in recent years to technologies that can burn up these species. The separation and transmutation of transuranics is part of a solution to decreasing the volume and heat load of nuclear waste significantly to increase the repository capacity. A fusion neutron source can be used for transmutation as an alternative to fast reactor systems. Sandia National Laboratories is investigating the use of a Z-Pinch fusion driver for this application. This report summarizes the initial design and engineering issues of this ''In-Zinerator'' concept. Relatively modest fusion requirements on the order of 20 MW can be used to drive a sub-critical, actinide-bearing, fluid blanket. The fluid fuel eliminates the need for expensive fuel fabrication and allows for continuous refueling and removal of fission products. This reactor has the capability of burning up 1,280 kg of actinides per year while at the same time producing 3,000 MWth. The report discusses the baseline design, engineering issues, modeling results, safety issues, and fuel cycle impact.

A major portion of the Wireless Networking Project at Sandia National Laboratories over the last few years has been to examine IEEE 802.11 wireless networking for possible use at Sandia and if practical, introduce this technology. This project team deployed 802.11a, b, and g Wireless Local Area Networking at Sandia. This report examines the basics of wireless networking and captures key results from project tests and experiments. It also records project members thoughts and designs on wireless LAN architecture and security issues. It documents some of the actions and milestones of this project, including pilot and production deployment of wireless networking equipment, and captures the team's rationale behind some of the decisions made. Finally, the report examines lessons learned, future directions, and conclusions.

Microsystems pose unparalleled opportunity in the realm of real-time sample analysis for multiple applications, including Homeland Security monitoring devices, environmental monitoring, and biomedical diagnostics. The need for a universal means of processing, separating, and delivering a sample within these devices is a critical need if these systems are to receive widespread implementation in the industry and government sectors. Efficient particle separation and enrichment techniques are critical for a range of analytical functions including pathogen detection, sample preparation, high-throughput particle sorting, and biomedical diagnostics. Previously, using insulator-based dielectrophoresis (iDEP) in microfluidic glass devices, we demonstrated simultaneous particle separation and concentration. As an alternative to glass, we evaluate the performance of similar iDEP structures produced in polymer-based microdevices and their enhancement through dynamic surface coatings. There are numerous processing and operational advantages that motivate our transition to polymers such as the availability of numerous innate chemical compositions for tailoring performance, mechanical robustness, economy of scale, and ease of thermoforming and mass manufacturing. The polymer chips we have evaluated are fabricated through an injection molding process of the commercially available cyclic olefin copolymer Zeonor{reg_sign}. We demonstrate that the polymer devices achieve the same performance metrics as glass devices. Additionally, we show that the nonionic block copolymer surfactant Pluronic F127 has a strong interaction with the cyclic olefin copolymer at very low concentrations, positively impacting performance by decreasing the magnitude of the applied electric field necessary to achieve particle trapping. The presence of these dynamic surface coatings, therefore, lowers the power required to operate such devices and minimizes Joule heating. The results of this study demonstrate that polymeric microfluidic devices with surfactant coatings for insulator-based dielectrophoresis provide an affordable engineering strategy for selective particle enrichment and sorting.

We have investigated a novel emulsion interfacial filter that is applicable for a wide range of materials, from nano-particles to cells and bacteria. This technology uses the interface between the two immiscible phases as the active surface area for adsorption of targeted materials. We showed that emulsion interfaces can effectively collect and trap materials from aqueous solution. We tested two aqueous systems, a bovine serum albumin (BSA) solution and coal bed methane produced water (CBMPW). Using a pendant drop technique to monitor the interfacial tension, we demonstrated that materials in both samples were adsorbed to the liquid-liquid interface, and did not readily desorb. A prototype system was built to test the emulsion interfacial filter concept. For the BSA system, a protein assay showed a progressive decrease in the residual BSA concentration as the sample was processed. Based on the initial prototype operation, we propose an improved system design.