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Controller's 2006 annual report : fiscal year ending September 30, 2006

Conaway, Richard A.

I am pleased to present the CFO's FY06 Financial Report for Sandia National Laboratories (SNL). As a contractor to DOE and other government agencies, the bulk of SNL's revenue is from tax dollars. SNL's FY06 total revenue, total expenditures, and total employment levels were slightly below the FY05 record high levels. Throughout FY06, SNL business staff continued to improve SNL's financial stewardship of entrusted taxpayer funds through implementation of best-in-class practices in financial business operations and internal control policies and procedures to ensure compliance with all accounting standards and provide accountability to our customers. Our FY06 efforts focused on process certification and improvement, implementing OMB Circular A-123, achieving assurance activities, implementation of a Financial Management Competency Program throughout SNL, and continuous assessment of trends and emerging issues.

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SNL/CA Environmental Planning and Ecology Program Annual Report 2007

Larsen, Barbara L.

The annual program report provides detailed information about all aspects of the Sandia National Laboratories, California (SNL/CA) Environmental Planning and Ecology Program for a given calendar year. It functions as supporting documentation to the SNL/CA Environmental Management System Program Manual. The 2006 program report describes the activities undertaken during the past year, and activities planned in future years to implement the Planning and Ecology Program, one of six programs that supports environmental management at SNL/CA.

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Scanning probe recognition microscopy investigation of tissue scaffold properties

International Journal of Nanomedicine

Fan, Yuan; Chen, Qian; Ayres, Virginia M.; Baczewski, Andrew D.; Udpa, Lalita; Kumar, Shiva

Scanning probe recognition microscopy is a new scanning probe microscopy technique which enables selective scanning along individual nanofibers within a tissue scaffold. Statistically significant data for multiple properties can be collected by repetitively fine-scanning an identical region of interest. The results of a scanning probe recognition microscopy investigation of the surface roughness and elasticity of a series of tissue scaffolds are presented. Deconvolution and statistical methods were developed and used for data accuracy along curved nanofiber surfaces. Furthermore, nanofiber features were also independently analyzed using transmission electron microscopy, with results that supported the scanning probe recognition microscopy-based analysis.

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Using Work and Energy to Characterize Mechanical Shock

Proposed Journal Article, unpublished

Edwards, Timothy S.

By far the most widely used tool in shock data analysis is the shock response spectrum (SRS). The SRS has gained popularity because of several primary considerations. It has physical significance, it is simple to understand and it is believed to indicate shock severity. Despite its popularity, the SRS has limitations. Foremost among them is the underlying assumption that shock severity is proportional to a time derivative of position, which does not agree with accepted material failure models. Also, the SRS cannot distinguish between naturally occurring, complex shocks and the chirps sometimes used to achieve a desired SRS using electrodynamic shakers with inadequate force capabilities. Thirdly, SODF models used in the computation of the SRS do not accurately predict accelerations in MDOF structures. A relatively new concept has been introduced whereby an analysis is made on the work done on structures by the excitation force. Since work is equal to the change in the energy of a system, this quantity is closely related to failure models based on strain energy such as the Von Mesis criterion. This paper is the first in a series exploring the use of energy-based description of shock motion and structural response. The input energy spectrum has attractive properties which include intuitive physical significance, insensitivity to system parameters such as viscous damping or hysteretic loss, the ability to distinguish between realistic shocks and chirps, and a close relation to accepted material failure models. Input energy spectra can be calculated using SDOF models and, in many cases, accurately predict the energy input to MDOF structures. Finally, this paper gives an introduction to these methods, derives the equations for relevant energy measures and presents relationships to several other shock analysis tools.

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Static and dynamic compaction of ceramic powders

International Journal of Solids and Structures

Vogler, Tracy J.; Lee, Moo Y.; Grady, D.E.

The static and dynamic compaction of ceramic powders was investigated experimentally using a high-pressure friction-compensated press to achieve static stresses of 1.6 GPa and with a novel gas gun setup to stresses of 5.9 GPa for a tungsten carbide powder. Experiments were performed in the partial compaction region to nearly full compaction. The effects of variables including initial density, particle size distribution, particle morphology, and loading path were investigated in the static experiments. Only particle morphology was found to significantly affect the compaction response. Post-test examination of the powder reveals fracture of the grains as well as breaking at particle edges. In dynamic experiments, steady structured compaction waves traveling at very low velocities were observed. The strain rate within the compaction waves was found to scale nearly linearly with the shock stress, in contrast with many fully dense materials where strain rate scales with stress to the fourth power. Similar scaling is found for data from the literature on TiO2 powder. The dynamic response of WC powder is found to be significantly stiffer than the static response, probably because deformation in the dynamic case is confined to the relatively narrow compaction wave front. Comparison of new static powder compaction results with shock data from the literature for SiO2 also reveals a stiffer dynamic response. © 2006 Elsevier Ltd. All rights reserved.

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Geometric correction and digital elevation extraction using multiple MTI datasets

Photogrammetric Engineering and Remote Sensing

Mercier, Jeffrey A.; Schowengerdt, Robert A.; Storey, James C.; Smith, Jody L.

Digital Elevation Models (DEMS) are traditionally acquired from a stereo pair of aerial photographs sequentially captured by an airborne metric camera. Standard DEM extraction techniques can be naturally extended to satellite imagery, but the particular characteristics of satellite imaging can cause difficulties. The spacecraft ephemeris with respect to the ground site during image collects is the most important factor in the elevation extraction process. When the angle of separation between the stereo images is small, the extraction process typically produces measurements with low accuracy, while a large angle of separation can cause an excessive number of erroneous points in the DEM from occlusion of ground areas. The use of three or more images registered to the same ground area can potentially reduce these problems and improve the accuracy of the extracted DEM. The pointing capability of some sensors, such as the Multispectral Thermal Imager (MTI), allows for multiple collects of the same area from different perspectives. This functionality of MTI makes it a good candidate for the implementation of a DEM extraction algorithm using multiple images for improved accuracy. Evaluation of this capability and development of algorithms to geometrically model the MTI sensor and extract DEMs from multi-look MTI imagery are described in this paper. An RMS elevation error of 6.3-meters is achieved using 11 ground test points, while the MTI band has a 5-meter ground sample distance. © 2007 American Society for Photogrammetry and Remote Sensing.

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Development of a removable conformal coating through the synthetic incorporation of Diels-Alder thermally reversible adducts into an epoxy resin

ACS Symposium Series

Aubert, James H.; Tallant, David R.; Sawyer, Patricia S.; Garcia, Manuel J.

An epoxy-based conformal coating with a very low modulus has been developed for the environmental protection of electronic devices and for stress relief of those devices. The coating was designed to be removable by incorporating thermally-reversible Diels-Alder (D-A) adducts into the epoxy resin utilized in the formulation. The removability of the coating allows us to recover expensive components during development, to rebuild during production, to upgrade the components during their lifetime, to perform surveillance after deployment, and it aids in dismantlement of the components after their lifetime. The removability is the unique feature of this coating and was characterized by modulus versus temperature measurements, dissolution experiments, viscosity quench experiments, and FTIR. Both the viscosity quench experiments and the FTIR measurements allowed us to estimate the equilibrium constant of the D-A adducts in a temperature range from room temperature to 90 °C. © 2007 American Chemical Society.

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Effects of aliasing on numerical integration

Mechanical Systems and Signal Processing

Edwards, Timothy S.

During the course of processing acceleration data from mechanical systems it is often desirable to integrate the data to obtain velocity or displacement waveforms. However, those who have attempted these operations may be painfully aware that the integrated records often yield unrealistic residual values. This is true whether the data has been obtained experimentally or through numerical simulation such as Runge-Kutta integration or the explicit finite element method. In the case of experimentally obtained data, the integration errors are usually blamed on accelerometer zero shift or amplifier saturation. In the case of simulation data, incorrect integrations are often incorrectly blamed on the integration algorithm itself. This work demonstrates that seemingly small aliased content can cause appreciable errors in the integrated waveforms and explores the unavoidable source of aliasing in both experiment and simulation-the sampling operation. Numerical analysts are often puzzled as to why the integrated acceleration from their simulation does not match the displacement output from the same simulation. This work shows that these strange results can be caused by aliasing induced by interpolation of the model output during sampling regularisation. © 2005 Elsevier Ltd. All rights reserved.

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Algebraic multilevel preconditioners for nonsymmetric PDEs on stretched grids

Lecture Notes in Computational Science and Engineering

Sala, Marzio; Lin, Paul T.; Shadid, John N.; Tuminaro, Raymond S.

We report on algebraic multilevel preconditioners for the parallel solution of linear systems arising from a Newton procedure applied to the finite-element (FE) discretization of the incompressible Navier-Stokes equations. We focus on the issue of how to coarsen FE operators produced from high aspect ratio elements.

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Preconditioning of Saddle Point Systems by Substructuring and a Penalty Approach

Lecture Notes in Computational Science and Engineering

Dohrmann, Clark R.

The focus of this paper is a penalty-based strategy for preconditioning elliptic saddle point systems. As the starting point, we consider the regularization approach of Axelsson in which a related linear system, differing only in the (2,2) block of the coefficient matrix, is introduced. By choosing this block to be negative definite, the dual unknowns of the related system can be eliminated resulting in a positive definite primal Schur complement. Rather than solving the Schur complement system exactly, an approximate solution is obtained using a substructuring preconditioner. The approximate primal solution together with the recovered dual solution then define the preconditioned residual for the original system.

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A statistics-based approach to binary image registration with uncertainty analysis

IEEE Transactions on Pattern Analysis and Machine Intelligence

Simonson, Katherine M.; Drescher, Steven M.; Tanner, Franklin R.

A new technique is described for the registration of edge-detected images. While an extensive literature exists on the problem of image registration, few of the current approaches include a well-defined measure of the statistical confidence associated with the solution. Such a measure is essential for many autonomous applications, where registration solutions that are dubious (involving poorly focused images or terrain that is obscured by clouds) must be distinguished from those that are reliable (based on clear images of highly structured scenes). The technique developed herein utilizes straightforward edge pixel matching to determine the "best" among a class of candidate translations. A well-established statistical procedure, the McNemar test, is then applied to identify which other candidate solutions are not significantly worse than the best solution. This allows for the construction of confidence regions in the space of the registration parameters. The approach is validated through a simulation study and examples are provided of its application in numerous challenging scenarios. While the algorithm is limited to solving for two-dimensional translations, its use in validating solutions to higher-order (rigid body, affine) transformation problems is demonstrated. © 2007 IEEE.

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Photoionization mass spectrometric studies and modeling of fuel-rich allene and propyne flames

Proceedings of the Combustion Institute

Hansen, Nils; Miller, James A.; Taatjes, Craig A.; Wang, Juan; Cool, Terrill A.; Law, Matthew E.; Westmoreland, Phillip R.

Flame-sampling photoionization mass spectrometry is used for measurements of the absolute molar composition of fuel-rich (φ = 1.8) low-pressure laminar flames of allene and propyne. The experiment combines molecular-beam mass spectrometry with photoionization by tunable vacuum-ultraviolet synchrotron radiation. This approach provides selective detection of individual isomers and unambiguous identifications of other flame species of near-equal mass by near threshold photoionization efficiency measurements. Mole fraction profiles for more than 30 flame species with ion masses ranging from 2 to 78 are presented. The isomeric composition is resolved for most intermediates, for example, mole fraction profiles are presented for both benzene and the fulvene isomer. The results are compared with predictions based on current kinetic models. The mole fractions of the major species are predicted quite accurately, however, some discrepancies are observed for minor species. © 2006 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

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The influence of ethanol addition on premixed fuel-rich propene-oxygen-argon flames

Proceedings of the Combustion Institute

Kohse-Höinghaus, Katharina; Oßwald, Patrick; Struckmeier, Ulf; Kasper, Tina; Hansen, Nils; Taatjes, Craig A.; Wang, Juan; Cool, Terrill A.; Gon, Saugata; Westmoreland, Phillip R.

The role of ethanol as a fuel additive was investigated in a fuel-rich, non-sooting (C/O = 0.77) flat premixed propene-oxygen-argon flame at 50 mbar (5 kPa). Mole fractions of stable and radical species were derived using two different in situ molecular beam mass spectrometry (MBMS) set-ups, one located in Bielefeld using electron impact ionization (EI), and the other at the Advanced Light Source (ALS) at Berkeley using vacuum UV photoionization (VUV-PI) with synchrotron radiation. A rich propene flame, previously studied in detail experimentally and with flame model calculations, was chosen as the base flame. Addition of ethanol is believed to reduce the concentrations of benzene and small aromatic compounds, while augmenting the formation of other regulated air toxics such as aldehydes. To study the chemical pathways responsible for these effects, quantitative concentrations of about 35 species were determined from both experiments. This is also the first time that a detailed comparison of quantitative species concentrations from these independent MBMS set-ups is available. Effects of ethanol addition on the species pool are discussed with special attention on benzene precursor chemistry and aldehyde formation. © 2006 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

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Effect of EGR on diesel premixed-burn equivalence ratio

Proceedings of the Combustion Institute

Idicheria, Cherian I.; Pickett, Lyle M.

The effect of exhaust-gas recirculation (EGR) on the equivalence ratio of premixed-burn mixture in diesel combustion was investigated experimentally. The ambient oxygen concentration was systematically decreased from 21% to 10% in a constant-volume combustion vessel to simulate EGR effects in engines. Pressure measurements and time-resolved imaging of high-temperature chemiluminescence were used to characterize the temporal and spatial ignition and premixed burn characteristics of n-heptane diesel jets. With increasing EGR, ignition delay increases and the location of premixed burn occurs further down-stream from the nozzle. Subsequent to first ignition, high temperature reactions stabilize at a quasi-steady lift-off length, showing that lift-off is a bounding parameter for determining premixed-burn region. The equivalence ratio of the fuel-ambient mixture in the premixed-burn region was measured using planar laser Rayleigh scattering. Fuel-oxygen mass distribution functions show that more mass is mixed into the premixed-burn region with increasing EGR, but the equivalence ratio of this mixture is the same. The study shows that an increasing ignition delay with increasing EGR does not necessarily decrease the equivalence ratio as would be desired for reducing soot formation in low-temperature combustion engines. However, measures to improve fuel-ambient mixing, such as shortened injection durations coupled to long ignition delay, could decrease equivalence ratio.

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Quantification of resolution and noise effects on thermal dissipation measurements in turbulent non-premixed jet flames

Proceedings of the Combustion Institute

Wang, G.H.; Barlow, R.S.; Clemens, N.T.

One-dimensional (1-D) line Rayleigh thermometry is used to investigate the effects of spatial resolution and noise on thermal dissipation in turbulent non-premixed CH4/H2/N2 jet flames. The high signal-tonoise ratio and spatial resolution of the measured temperature field enables determination of the cutoff wavenumber in the 1-D temperature dissipation spectrum obtained at each flame location. The local scale inferred from this cutoff is analogous to the Batchelor scale in nonreacting flows. At downstream locations in the flames studied here, it is consistent with estimates of the Batchelor scale based on the scaling laws using local Reynolds numbers. The spectral cutoff information is used to design data analysis schemes for determining mean thermal dissipation. Laminar flame measurements are used to characterize experimental noise and correct for the noise-induced apparent dissipation in the turbulent flame results. These experimentally determined resolution and noise correction techniques are combined to give measurements of the mean thermal dissipation that are essentially fully resolved and noise-free. The prospects of using spectral results from high-resolution 1-D Rayleigh imaging measurements to design filtering schemes for Raman-based measurements of mixture fraction dissipation are also discussed.

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Experimental study of scalar filtered mass density function in turbulent partially premixed flames

Proceedings of the Combustion Institute

Wang, Danhong; Tong, Chenning; Barlow, R.S.; Karpetis, A.N.

The mixture fraction filtered mass density function (FMDF) used in large eddy simulation (LES) of turbulent combustion is studied experimentally using line images obtained in turbulent partially premixed methane flames (Sandia flames D and E). Cross-stream filtering is employed to obtain the FMDF and other filtered variables. The means of the FMDF conditional on the subgrid-scale (SGS) scalar variance at a given location are found to vary from close to Gaussian to bimodal, indicating well-mixed and non-premixed SGS mixing regimes, respectively. The bimodal SGS scalar has a structure (ramp-cliff) similar to the counter-flow model for laminar flamelets. Therefore, while the burden on mixing models to predict the well-mixed SGS scalar is expected to lessen with decreasing filter scale, the burden to predict the bimodal one is not. These SGS scalar structures can result in fluctuations of the SGS flame structure between distributed reaction zones and laminar flamelets, but for reasons different from the scalar dissipation rate fluctuations associated with the turbulence cascade. Furthermore, the bimodal SGS scalar contributes a significant amount of the scalar dissipation in the reaction zones, highlighting its importance and the need for mixing models to predict the bimodal FMDFs. © 2006 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

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Structure of a spatially developing turbulent lean methane-air Bunsen flame

Proceedings of the Combustion Institute

Sankaran, Ramanan; Hawkes, Evatt R.; Chen, Jacqueline H.; Lu, Tianfeng; Law, Chung K.

Direct numerical simulation of a three-dimensional spatially developing turbulent slot-burner Bunsen flame has been performed with a new reduced methane-air mechanism. The mechanism, derived from sequential application of directed relation graph theory, sensitivity analysis and computational singular perturbation over the GRI-1.2 detailed mechanism is non-stiff and tailored to the lean conditions of the DNS. The simulation is performed for three flow through times, long enough to achieve statistical stationarity. The turbulence parameters have been chosen such that the combustion occurs in the thin reaction zones regime of premixed combustion. The data is analyzed to study possible influences of turbulence on the structure of the preheat and reaction zones. The results show that the mean thickness of the turbulent flame, based on progress variable gradient, is greater than the corresponding laminar flame. The effects of flow straining and flame front curvature on the mean flame thickness are quantified through conditional means of the thickness and by examining the balance equation for the evolution of the flame thickness. Finally, conditional mean reaction rate of key species compared to the laminar reaction rate profiles show that there is no significant perturbation of the heat release layer.

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Combinatorial scientific computing: The enabling power of discrete algorithms in computational science

Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)

Hendrickson, Bruce A.; Pothen, Alex

Combinatorial algorithms have long played a crucial, albeit under-recognized role in scientific computing. This impact ranges well beyond the familiar applications of graph algorithms in sparse matrices to include mesh generation, optimization, computational biology and chemistry, data analysis and parallelization. Trends in science and in computing suggest strongly that the importance of discrete algorithms in computational science will continue to grow. This paper reviews some of these many past successes and highlights emerging areas of promise and opportunity. © Springer-Verlag Berlin Heidelberg 2007.

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Excitation of electromagnetic flute modes in the process of interaction of plasma flow with inhomogeneous magnetic field

Astrophysics and Space Science

Sotnikov, V.I.; Presura, R.; Ivanov, V.V.; Cowan, T.E.; Leboeuf, J.N.; Oliver, Bryan V.

Laboratory experiments on the interaction of a plasma flow, produced by laser ablation of a solid target with the inhomogeneous magnetic field from the Zebra pulsed power generator demonstrated the presence of strong wave activity in the region of the flow deceleration. The deceleration of the plasma flow can be interpreted as the appearance of a gravity-like force. The drift due to this force can lead to the excitation of flute modes. In this paper a linear dispersion equation for the excitation of electromagnetic flute-type modes with plasma and magnetic field parameters, corresponding to the ongoing experiments is examined. Results indicate that the wavelength of the excited flute modes strongly depends on the strength of the external magnetic field. For magnetic field strengths ∼ 0.1 MG the excited wavelengths are larger than the width of the laser ablated plasma plume and cannot be observed during the experiment. But for magnetic field strengths ∼ 1 MG the excited wavelengths are much smaller and can then be detected. © Springer Science+Business Media B.V. 2007.

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Atomistic simulation of Si/SiO2 interfaces

Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms

Van Ginhoven, R.M.; Hjalmarson, Harold P.

Atomistic models of the Si(1 0 0)/SiO2 interface were generated using a classical reactive force field, and subsequently optimized using density functional theory. The interfaces consist of amorphous oxide bound to crystalline silicon substrate. Each system has a sub-oxide layer of partially oxidized silicon atoms at the interface, and a distribution of oxygen-deficient centers in the oxide. Both periodic and slab configurations are considered. © 2006.

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Ignition and devolatilization of pulverized bituminous coal particles during oxygen/carbon dioxide coal combustion

Proceedings of the Combustion Institute

Molina, Alejandro; Shaddix, Christopher R.

Oxygen/carbon dioxide recycle coal combustion is actively being investigated because of its potential to facilitate CO2 sequestration and to achieve emission reductions. In the work reported here, the effect of enhanced oxygen levels and CO2 bath gas is independently analyzed for their influence on single-particle pulverized coal ignition of a U.S. eastern bituminous coal. The experiments show that the presence of CO2 and a lower O2 concentration increase the ignition delay time but have no measurable effect on the time required to complete volatile combustion, once initiated. For the ignition process observed in the experiments, the CO 2 results are explained by its higher molar specific heat and the O2 results are explained by the effect of O2 concentration on the local mixture reactivity. Particle ignition and devolatilization properties in a mixture of 30% O2 in CO2 are very similar to those in air.

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Driver transition geometries and inductance considerations leading to design guidelines for a Z-IFE power plant

Fusion Science and Technology

Smith, David L.; Mazarakis, Michael G.; Olson, Craig L.

A 70-MA, 7-MV, ∼100-ns driver for a Z-pinch Inertial Fusion Energy (Z-IFE) power plant has been proposed. In this summary we address the transition region between the 70 Linear Transformer Driver (LTD) modules and the center Recyclable Transmission Line (RTL) load section, which convolves from the coaxial vacuum Magnetically Insulated Transmission Lines (MITL) to a parallel tri-plate and then a bi-plate disk feed. An inductive annular chamber terminates one side of the tri-plate in a manner that preserves vacuum and electrical circuit integrity without significant energy losses. The simplicity is offset by the disadvantage of the chamber size, which is proportional to the driver impedance and decreases with the addition of more parallel modules. Inductive isolation chamber sizes are estimated in this paper, based on an optimized LTD equivalent circuit simulation source driving a matched load using transmission line models. We consider the trade-offs between acceptable energy loss and the size of the inductive isolation chamber; accepting a 6% energy loss would only require a 60-nH chamber.

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Detailed characterization of defect production in molecular dynamics simulations of cascades in Si

Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms

Foiles, Stephen M.

Numerous molecular dynamics simulation studies of radiation cascades in Si have elucidated many of the general features of the initial defect production. However, the resulting defect structures have been analyzed with techniques that are not sensitive to changes in the local bonding topology. Here the results of analyzing the ring content in Si cascades, in addition to more traditional defect characterization such as Wigner-Seitz cell analysis, will be presented for recoil energies ranging from 25 eV up to 25 keV. The ring content of local amorphous regions in the cascades will be compared to the ring content in simulations of bulk amorphous Si. The number of atoms in the amorphous regions and the number of point defects as a function of recoil energy are determined. © 2006 Elsevier B.V. All rights reserved.

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Large eddy simulation of swirling particle-laden flow in a model axisymmetric combustor

Proceedings of the Combustion Institute

Oefelein, Joseph; Sankaran, Vaidyanathan S.; Drozda, Tomasz D.

This paper focuses on the application of the large eddy simulation (LES) technique to a swirling particle-laden flow in a model combustion chamber. A series of calculations have been performed and compared directly with detailed experimental measurements. The computational domain identically matches the laboratory configuration, which effectively isolates effects related to dilute particle dispersion and momentum coupling. Results highlight the predictive capabilities of LES when implemented with the appropriate numerics, grid resolution (as dictated by the class of models employed) and well-defined boundary conditions. The case study provides a clearer understanding of the effectiveness and feasibility of current state-of-the-art models and a quantitative understanding of relevant modeling issues by analyzing the characteristic parameters and scales of importance. The novel feature of the results presented is that they establish a baseline level of confidence in our ability to simulate complex flows at conditions representative of those typically observed in gas-turbine (and similar) combustors. © 2006 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

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Efficient MATLAB computations with sparse and factored tensors

SIAM Journal on Scientific Computing

Bader, Brett W.

In this paper, the term tensor refers simply to a multidimensional or N-way array, and we consider how specially structured tensors allow for efficient storage and computation. First, we study sparse tensors, which have the property that the vast majority of the elements are zero. We propose storing sparse tensors using coordinate format and describe the computational efficiency of this scheme for various mathematical operations, including those typical to tensor decomposition algorithms. Second, we study factored tensors, which have the property that they can be assembled from more basic components. We consider two specific types: A Tucker tensor can be expressed as the product of a core tensor (which itself may be dense, sparse, or factored) and a matrix along each mode, and a Kruskal tensor can be expressed as the sum of rank-1 tensors. We are interested in the case where the storage of the components is less than the storage of the full tensor, and we demonstrate that many elementary operations can be computed using only the components. All of the efficiencies described in this paper are implemented in the Tensor Toolbox for MATLAB. © 2007 Society for Industrial and Applied Mathematics.

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Separation of p-Xylene from Multicomponent Vapor Mixtures using Tubular MFI Zeolite Membranes

Studies in Surface Science and Catalysis

Gu, Xuehong; Dong, Junhang; Nenoff, Tina M.; Ozokwelu, Dickson E.

MFI zeolite membranes have been synthesized on tubular α-alumina substrates to investigate the separation of p-xylene (PX) from m-xylene (MX) and o-xylene (OX) in multicomponent mixtures and ranges of feed pressure and operating temperature. 1,3,5-triisopropylbenzene was added to the feed stream for online membrane modification. Separation of PX from MX and OX through the MFI membranes relies primarily on shape-selectivity when the xylene sorption level in the zeolite is sufficiently low. For an eight-component mixture containing hydrogen, hydrocarbons, PX, MX, and OX, PX/(MX+OX) selectivity of 7.71 with PX flux of 6.8×10-6mol/m2.s was obtained at 250°C and atmospheric feed pressure. © 2007 Elsevier B.V. All rights reserved.

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Generalization of von Neumann analysis for a model of two discrete half-spaces: The acoustic case

Geophysics

Haney, Matthew M.

Evaluating the performance of finite-difference algorithms typically uses a technique known as von Neumann analysis. For a given algorithm, application of the technique yields both a dispersion relation valid for the discrete time-space grid and a mathematical condition for stability. In practice, a major shortcoming of conventional von Neumann analysis is that it can be applied only to an idealized numerical model - that of an infinite, homogeneous whole space. Experience has shown that numerical instabilities often arise in finite-difference simulations of wave propagation at interfaces with strong material contrasts. These interface instabilities occur even though the conventional von Neumann stability criterion may be satisfied at each point of the numerical model. To address this issue, I generalize von Neumann analysis for a model of two half-spaces. I perform the analysis for the case of acoustic wave propagation using a standard staggered-grid finite-difference numerical scheme. By deriving expressions for the discrete reflection and transmission coefficients, I study under what conditions the discrete reflection and transmission coefficients become unbounded. I find that instabilities encountered in numerical modeling near interfaces with strong material contrasts are linked to these cases and develop a modified stability criterion that takes into account the resulting instabilities. I test and verify the stability criterion by executing a finite-difference algorithm under conditions predicted to be stable and unstable. © 2007 Society of Exploration Geophysicists.

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CARS thermometry in a 2-m-diameter methanol pool fire

Collection of Technical Papers - 45th AIAA Aerospace Sciences Meeting

Kearney, Scan P.; Grasser, Thomas

We report what is believed to be the first application of coherent anti-Stokes Raman scattering (CARS) to full-scale fire testing. A CARS instrument has been constructed at the newly commissioned FLAME (Fire Laboratory for Accreditation of Models and Experiments) facility at Sandia, where the CARS system has been used for thermometry in 2-m-diameter, turbulent methanol pool fires. Fielding of CARS in such a large-scale facility presents several challenges, including long-distance propagation of laser beams, shielding of optics from intense heat, the impact of beam steering and fiber-optic coupling of the CARS signal to remotely located detection equipment. The details of a CARS instrument that meets these challenges are presented, along with the construction of the unique new FLAME facility itself, which has been designed to accommodate optical and laser-based diagnostics to full-scale fire experimentation. The performance of the CARS instrument is investigated in a premixed methane-air flat flame to estimate the precision in single-shot CARS temperatures. Single-shot CARS spectra and best-fit temperatures from a methanol pool fire are presented, and an estimate of the pdf of the temperature fluctuations from the pool-fire environment is obtained.

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Towards a predictive MHD simulation capability for designing hypervelocity magnetically-driven flyer plates and PWclass z-pinch x-ray sources on Z and ZR

Mehlhorn, Thomas A.; Yu, Edmund; Vesey, Roger A.; Cuneo, Michael E.; Jones, Brent M.; Knudson, Marcus D.; Sinars, Daniel; Robinson, Allen C.; Trucano, Timothy G.; Brunner, Thomas A.; Desjarlais, Michael P.; Garasi, Christopher J.; Haill, Thomas A.; Hanshaw, Heath L.; Lemke, Raymond W.; Oliver, Bryan V.; Peterson, K.J.

Abstract not provided.

Inversion of Masing models via continuous Iwan systems

Proposed for publication in the Journal of Engineering Mechanics.

Starr, Michael; Segalman, Daniel J.

It is shown that for any material or structural model expressible as a Masing model, there exists a unique parallel-series (displacement-based) Iwan system that characterizes that model as a function of displacement history. This poses advantages both in terms of more convenient force evaluation in arbitrary deformation histories as well as in terms of model inversion. Characterization as an Iwan system is demonstrated through the inversion of the Ramberg-Osgood model, a force(stress)-based material model that is not explicitly invertible. An implication of the inversion process is that direct, rigorous comparisons of different Masing models, regardless of the ability to invert their constitutive relationship, can be achieved through the comparison of their associated Iwan distribution densities.

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Results 82701–82800 of 99,299
Results 82701–82800 of 99,299