The Chacahoula salt dome, located in southern Louisiana, approximately 66 miles southwest of New Orleans, appears to be a suitable site for a 160-million-barrel-capacity expansion facility for the U.S. Strategic Petroleum Reserve, comprising sixteen 10-million barrel underground storage caverns. The overall salt dome appears to cover an area of some 1800 acres, or approximately 2.8 square miles, at a subsea elevation of 2000 ft, which is near the top of the salt stock. The shallowest known salt is present at 1116 ft, subsea. The crest of the salt dome is relatively flatlying, outward to an elevation of -4000 ft. Below this elevation, the flanks of the dome plunge steeply in all directions. The dome appears to comprise two separate spine complexes of quasi-independently moving salt. Two mapped areas of salt overhang, located on the eastern and southeastern flanks of the salt stock, are present below -8000 ft. These regions of overhang should present no particular design issues, as the conceptual design SPR caverns are located in the western portion of the dome. The proposed cavern field may be affected by a boundary shear zone, located between the two salt spines. However, the large size of the Chacahoula salt dome suggests that there is significant design flexibility to deal with such local geologic issues.
A new multi-scale, stabilized method for Q1/P0 finite element computations of Lagrangian shock hydrodynamics is presented. Instabilities (of hourglass type) are controlled by a stabilizing operator derived using the variational multi-scale analysis paradigm. The resulting stabilizing term takes the form of a pressure correction. With respect to currently implemented hourglass control approaches, the novelty of the method resides in its residual-based character. The stabilizing residual has a definite physical meaning, since it embeds a discrete form of the Clausius-Duhem inequality. Effectively, the proposed stabilization samples and acts to counter the production of entropy due to numerical instabilities. The proposed technique is applicable to materials with no shear strength, for which there exists a caloric equation of state. The stabilization operator is incorporated into a mid-point, predictor/multi-corrector time integration algorithm, which conserves mass, momentum and total energy. Encouraging numerical results in the context of compressible gas dynamics confirm the potential of the method.
Verdict is a collection of subroutines for evaluating the geometric qualities of triangles, quadrilaterals, tetrahedra, and hexahedra using a variety of metrics. A metric is a real number assigned to one of these shapes depending on its particular vertex coordinates. These metrics are used to evaluate the input to finite element, finite volume, boundary element, and other types of solvers that approximate the solution to partial differential equations defined over regions of space. The geometric qualities of these regions is usually strongly tied to the accuracy these solvers are able to obtain in their approximations. The subroutines are written in C++ and have a simple C interface. Each metric may be evaluated individually or in combination. When multiple metrics are evaluated at once, they share common calculations to lower the cost of the evaluation.
Germanium telluride undergoes rapid transition between polycrystalline and amorphous states under either optical or electrical excitation. While the crystalline phases are predicted to be semiconductors, polycrystalline germanium telluride always exhibits p -type metallic conductivity. We present a study of the electronic structure and formation energies of the vacancy and antisite defects in both known crystalline phases. We show that these intrinsic defects determine the nature of free-carrier transport in crystalline germanium telluride. Germanium vacancies require roughly one-third the energy of the other three defects to form, making this by far the most favorable intrinsic defect. While the tellurium antisite and vacancy induce gap states, the germanium counterparts do not. A simple counting argument, reinforced by integration over the density of states, predicts that the germanium vacancy leads to empty states at the top of the valence band, thus giving a complete explanation of the observed p -type metallic conduction.
Proceedings of the ASME/Pacific Rim Technical Conference and Exhibition on Integration and Packaging of MEMS, NEMS, and Electronic Systems: Advances in Electronic Packaging 2005
Pressure stabilization methods are applied to higher-order velocity finite elements for application to viscous incompressible flows. Both a standard pressure stabilizing Petrov-Galerkin (PSPG) method and a new polynomial pressure projection stabilization (PPPS) method have been implemented and tested for various quadratic elements in two dimensions. A preconditioner based on relaxing the incompressibility constraint is also tested for the iterative solution of saddle point problems arising from mixed Galerkin finite element approximations to the Navier-Stokes equations. The preconditioner is demonstrated for BB stable elements with discontinuous pressure approximations in two and three dimensions.
This report presents a model to estimate the spallings releases for the Waste Isolation Pilot Plant Performance Assessment (WIPP PA). A spallings release in the context of WIPP PA refers to a portion of the solid waste transported from the subsurface repository to the ground surface due to inadvertent oil or gas drilling into the WIPP repository at some time after site closure. Some solid waste will be removed by the action of the drillbit and drilling fluid; this waste is referred to as cuttings and cavings. If the repository is pressurized above hydrostatic at the time of intrusion, solid waste material local to the borehole may be subject to mechanical failure and entrainment in high-velocity gases as the repository pressure is released to the borehole. Solid material that fails and is transported into the wellbore and thus to the surface comprise the spallings releases. The spallings mechanism is analogous to a well blowout in the modern oil and gas drilling industry. The current spallings conceptual model and associated computer code, DRSPALL, were developed for the 2004 recertification because the prior spallings model used in the 1996 WIPP Compliance Certification Application (CCA) was judged by an independent peer review panel as inadequate (DOE 1996, 9.3.1). The current conceptual model for spallings addresses processes that take place several minutes before and after a borehole intrusion of a WIPP waste room. The model couples a pipe-flow wellbore model with a porous flow repository model, allowing high-pressure gas to flow from the repository to the wellbore through a growing cavity region at the well bottom. An elastic stress model is applied to the porous solid domain that allows for mechanical failure of repository solids if local tensile stress exceeds the tensile strength of the waste. Tensile-failed solids may be entrained into the wellbore flow stream by a fluidized bed model, in which case they are ultimately transported to the land surface comprising a release. In July 2003, DOE/SNL presented the spallings conceptual model to a independent peer review panel in accordance with NUREG 1297 guidelines (NRC, 1988). The panel ultimately judged the model as adequate for implementation in WIPP PA (Yew et al., 2003). This report documents the spallings model history from 1997 to the implementation of DRSPALL in the 2004 Compliance Recertification Application (CRA) (DOE, 2004). The scope of this report includes descriptions of the conceptual model, numerical model, verification and validation techniques, model sensitivity studies, and WIPP PA spallings results as presented in the 2004 CRA.
The purpose of this SAND Report is to document efforts in the extraction and failure analyses of sleeve-style Lightning Arrestor Connectors (LACs). Several MC3080 and MC3079 LACs were recovered from the field and tested as part of the Enhanced Surveillance Campaign. A portion of these LACs failed retesting. Terry Ernest (01733), the LAC Component Engineer, provided eleven MC3080 LACs for evaluation where four of the LACs failed IR/DCW and one failed FRB requirements. The extraction of rutile sleeves from failed LACs was required to determine the source of failure. Rutile sleeves associated with connector function failures were examined for cracks, debris as well as any other anomalies which could have caused the LAC to not function properly. Sleeves that failed FRB or that experienced high FRB exhibited high symmetry, smooth surface, long-flow amicon, and slightly over-sized inside diameter. LACs that failed DCW or IR requirements had rutile sleeves that exhibited breakdown tracks.
This report summarizes our findings during the study of a novel homogeneous epoxidation catalyst system that uses molecular oxygen as the oxidant, a ''Holy Grail'' in catalysis. While olefins (alkenes) that do not contain allylic hydrogens can be epoxidized directly using heterogeneous catalysts, most olefins cannot, and so a general, atom-efficient route is desired. While most of the work performed on this LDRD has been on pincer complexes of late transition metals, we also scouted out metal/ligand combinations that were significantly different, and unfortunately, less successful. Most of the work reported here deals with phosphorus-ligated Pd hydrides [(PCP)Pd-H]. We have demonstrated that molecular oxygen gas can insert into the Pd-H bond, giving a structurally characterized Pd-OOH species. This species reacts with oxygen acceptors such as olefins to donate an oxygen atom, although in various levels of selectivity, and to generate a [(PCP)Pd-OH] molecule. We discovered that the active [(PCP)Pd-H] active catalyst can be regenerated by addition of either CO or hydrogen. The demonstration of each step of the catalytic cycle is quite significant. Extensions to the pincer-Pd chemistry by attaching a fluorinated tail to the pincer designed to be used in solvents with higher oxygen solubilities are also presented.
Removable encapsulants have been developed as replacement materials for electronic encapsulation. They can be removed from an electronic assembly in a fairly benign manner. Encapsulants must satisfy a limited number of criteria to be useful. These include processing ease, certain mechanical, thermal, and electrical properties, adhesion to common clean surfaces, good aging characteristics, and compatibility. This report discusses one aspect of the compatibility of removable blown epoxy foams with electronic components. Of interest is the compatibility of the blowing agent, Fluorinert{trademark} (FC-72) electronic fluid with electronic parts, components, and select materials. Excellent compatibility is found with most of the investigated materials. A few materials, such as Teflon{reg_sign} that are comprised of chemicals very similar to FC-72 show substantial absorption of FC-72. No compatibility issues have yet been identified even for the few materials that show substantial absorption.
This report summarizes an LDRD effort which looked at the feasibility of building a MEMS (Micro-Electro-Mechanical Systems) fabricated 100 GHz micro vacuum tube. PIC Simulations proved to be a very useful tool in investigating various device designs. Scaling parameters were identified. This in turn allowed predictions of oscillator growth based on beam parameters, cavity geometry, and cavity loading. The electron beam source was identified as a critical element of the design. FEA's (Field Emission Arrays) were purchased to be built into the micro device. Laboratory testing of the FEA's was also performed which pointed out care and handling issues along with maximum current capabilities. Progress was made toward MEMS fabrication of the device. Techniques were developed and successfully employed to build up several of the subassemblies of the device. However, the lower wall fabrication proved to be difficult and a successful build was not completed. Alternative approaches to building this structure have been identified. Although these alternatives look like good solutions for building the device, it was not possible to complete a redesign and build during the timeframe of this effort.
A key objective to the global deployment of nuclear technology is maintaining transparency among nation-states and international communities. By providing an environment in which to exchange scientific and technological information regarding nuclear technology, the safe and legitimate use of nuclear material and technology can be assured. Many nations are considering closed or multiple-application nuclear fuel cycles and are subsequently developing advanced reactors in an effort to obtain some degree of energy self-sufficiency. Proliferation resistance features that prevent theft or diversion of nuclear material and reduce the likelihood of diversion from the civilian nuclear power fuel cycle are critical for a global nuclear future. IAEA Safeguards have been effective in minimizing opportunities for diversion; however, recent changes in the global political climate suggest implementation of additional technology and methods to ensure the prompt detection of proliferation. For a variety of reasons, nuclear facilities are becoming increasingly automated and will require minimum manual operation. This trend provides an opportunity to utilize the abundance of process information for monitoring proliferation risk, especially in future facilities. A framework that monitors process information continuously can lead to greater transparency of nuclear fuel cycle activities and can demonstrate the ability to resist proliferation associated with these activities. Additionally, a framework designed to monitor processes will ensure the legitimate use of nuclear material. This report describes recent efforts to develop a methodology capable of assessing proliferation risk in support of overall plant transparency. The framework may be tested at the candidate site located in Japan: the Fuel Handling Training Model designed for the Monju Fast Reactor at the International Cooperation and Development Training Center of the Japan Atomic Energy Agency.
The optimized effective potential (OEP) method allows orbital-dependent functionals to be used in density functional theory (DFT), which, in particular, allows exact exchange formulations of the exchange energy to be used in DFT calculations. Because the exact exchange is inherently self-interaction correcting, the resulting OEP calculations have been found to yield superior band-gaps for condensed-phase systems. Here we apply these methods to the isolated atoms He and Be, and compare to high quality experiments and calculations to demonstrate that the orbital energies accurately reproduce the excited state spectrum for these species. These results suggest that coupling the exchange-only OEP calculations with proper (orbital-dependent or other) correlation functions might allow quantitative accuracy from DFT calculations.
The potential for implementing quantum coherence in semiconductor self-assembled quantum dots has been investigated theoretically and experimentally. Theoretical modeling suggests that coherent dynamics should be possible in self-assembled quantum dots. Our experimental efforts have optimized InGaAs and InAs self-assembled quantum dots on GaAs for demonstrating coherent phenomena. Optical investigations have indicated the appropriate geometries for observing quantum coherence and the type of experiments for observing quantum coherence have been outlined. The optical investigation targeted electromagnetically induced transparency (EIT) in order to demonstrate an all optical delay line.
Detailed statistical analysis of the experimental data from testing of alumina-loaded epoxy (ALOX) composites was conducted to better understand influences of the selected compositional properties on the compressive strength of these ALOX composites. Analysis of variance (ANOVA) for different models with different sets of parameters identified the optimal statistical model as, y{sub l} = -150.71 + 29.72T{sub l} + 204.71D{sub l} + 160.93S{sub 1l} + 90.41S{sub 2l}-20.366T{sub l}S{sub 2l}-137.85D{sub l}S{sub 1l}-90.08D{sub l}S{sub 2l} where y{sub l} is the predicted compressive strength, T{sub l} is the powder type, D{sub l} is the density as the covariate for powder volume concentration, and S{sub il}(i=1,2) is the strain rate. Based on the optimal statistical model, we conclude that the compressive strength of the ALOX composite is significantly influenced by the three main factors examined: powder type, density, and strain rate. We also found that the compressive strength of the ALOX composite is significantly influenced by interactions between the powder type and the strain rate and between the powder volume concentration and the strain rate. However, the interaction between the powder type and the powder volume concentration may not significantly influence the compressive strength of the ALOX composite.
The radiant heat test facility develops test sets providing well-characterized thermal environments, often representing fires. Many of the components and procedures have become standardized to such an extent that the development of a specialized design tool to determine optimal configurations for radiant heat experiments was appropriate. SPLASH (Single Panel Lamp and Shroud Helper) is that tool. SPLASH is implemented as a user-friendly, Windows-based program that allows a designer to describe a test setup in terms of parameters such as number of lamps, power, position, and separation distance. This document is a user manual for that software. Any incidental descriptions of theory are only for the purpose of defining the model inputs. The theory for the underlying model is described in SAND2005-2947 (Ref. [1]). SPLASH provides a graphical user interface to define lamp panel and shroud designs parametrically, solves the resulting radiation enclosure problem for up to 2500 surfaces, and provides post-processing to facilitate understanding and documentation of analyzed designs.
A series of tests involving detonation of high explosive blanketed by aqueous foam (conducted from 1982 to 1984) are described in primarily terms of recorded peak pressure, positive phase specific impulse, and time of arrival. The investigation showed that optimal blast mitigation occurs for foams with an expansion ratio of about 60:1. Simple analyses representing the foam as a shocked single phase mixture are presented and shown inadequate. The experimental data demonstrate that foam slows down and broadens the propagated pressure disturbance relative to a shock in air. Shaped charges and flyer plates were evaluated for operation in foam and appreciable degradation was observed for the flyer plates due to drag created by the foam.
As military operations in urban environments become more numerous, the ability of combat units to communicate, jam enemy communications, or employ RF weapons within this environment must be evaluated. To perform this evaluation in a mission level model requires a capability to evaluate the contributions of both terrain and man-made structures (interior and exterior) to RF propagation. The present study is an analysis of the adequacy of a mission level model (EADSIM) to perform these RF propagation calculations in an urban environment. Three basic environments must be assessed. The first environment consists entirely of terrain, with no man-made features impacting propagation values. The second environment includes terrain, but also includes the contribution of solid structures with abrupt edges, which may obstruct/influence LOS paths. The third environment includes not only terrain and structures, but also contains structures with interior features which must be evaluated to determine the propagation levels within and around these structures. EADSIM was used as the model for evaluation in view of its suite of propagation tools which can be used for analysis of RF propagation between transmitters and receivers including terrain. To assess EADSIM's capability to perform in these environments, flat terrain maps with an obstruction were created to permit comparison of EADSIM's propagation models with analytical calculations and with measurements. Calculations from the Terrain Integrated Rough Earth Model (TIREM) and the Spherical Earth Knife Edge (SEKE) propagation models included within EADSIM showed that the ability of the models to calculate knife-edge diffraction agreed favorably with analytical values. The representation of multipath effects was less encouraging. SEKE only models multipath when Fresnel clearance exists. TIREM models multipath, but the cyclical characteristics of multipath are not represented, and only subtractive path loss is considered. Multipath is only evaluated along a 2-D path in the vertical orientation. This precludes modeling propagation in the urban canyons of metropolitan areas, where horizontal paths are dominant. It also precludes modeling exterior to interior propagation. In view of the apparent inadequacy of urban propagation within mission level models, as evidenced by EADSIM, the study also attempts to address possible solutions to the problem. Correction of the sparsing techniques in both TIREM and SEKE models is recommended. Both SEKE and TIREM are optimized for DTED level 1 data, sparsed at 3 arc seconds resolution. This led to significant errors when map data was sparsed at higher or lower resolution. TIREM's errors would be significantly reduced if the 999 point array limit was eliminated. This would permit using interval sizes equal to the map resolution for larger areas. This same problem could be fixed in SEKE by changing the interval spacing from a fixed 3 arc second resolution ({approx}93 meters) to an interval which is set at the map resolution. Additionally, the cell elevation interpolation method which TIREM uses is inappropriate for the man-made structures encountered in urban environments. Turning this method of determining height off, or providing a selectable switch is desired. In the near term, it appears that further research into ray-tracing models is appropriate. Codes such as RF-ProTEC, which can be dynamically linked to mission level models such as EADSIM, can provide the higher fidelity propagation calculations required, and still permit the dynamic interactions required of the mission level model. Additional research should also be conducted on the best methods of representing man-made structures to determine whether codes other than ray-trace can be used.