This report is a collection of documents written by the group members of the Engineering Sciences Research Foundation (ESRF), Laboratory Directed Research and Development (LDRD) project titled 'A Robust, Coupled Approach to Atomistic-Continuum Simulation'. Presented in this document is the development of a formulation for performing quasistatic, coupled, atomistic-continuum simulation that includes cross terms in the equilibrium equations that arise due to kinematic coupling and corrections used for the calculation of system potential energy to account for continuum elements that overlap regions containing atomic bonds, evaluations of thermo-mechanical continuum quantities calculated within atomistic simulations including measures of stress, temperature and heat flux, calculation used to determine the appropriate spatial and time averaging necessary to enable these atomistically-defined expressions to have the same physical meaning as their continuum counterparts, and a formulation to quantify a continuum 'temperature field', the first step towards constructing a coupled atomistic-continuum approach capable of finite temperature and dynamic analyses.

Waste characterization is probably the most costly part of radioactive waste management. An important part of this characterization is the measurements of headspace gas in waste containers in order to demonstrate the compliance with Resource Conservation and Recovery Act (RCRA) or transportation requirements. The traditional chemical analysis methods, which include all steps of gas sampling, sample shipment and laboratory analysis, are expensive and time-consuming as well as increasing worker's exposure to hazardous environments. Therefore, an alternative technique that can provide quick, in-situ, and real-time detections of headspace gas compositions is highly desirable. This report summarizes the results obtained from a Laboratory Directed Research & Development (LDRD) project entitled 'Potential Application of Microsensor Technology in Radioactive Waste Management with Emphasis on Headspace Gas Detection'. The objective of this project is to bridge the technical gap between the current status of microsensor development and the intended applications of these sensors in nuclear waste management. The major results are summarized below: {sm_bullet} A literature review was conducted on the regulatory requirements for headspace gas sampling/analysis in waste characterization and monitoring. The most relevant gaseous species and the related physiochemical environments were identified. It was found that preconcentrators might be needed in order for …

As part of DARPA Information Processing Technology Office (IPTO) Software for Distributed Robotics (SDR) Program, Sandia National Laboratories has developed analysis and control software for coordinating tens to thousands of autonomous cooperative robotic agents (primarily unmanned ground vehicles) performing military operations such as reconnaissance, surveillance and target acquisition; countermine and explosive ordnance disposal; force protection and physical security; and logistics support. Due to the nature of these applications, the control techniques must be distributed, and they must not rely on high bandwidth communication between agents. At the same time, a single soldier must easily direct these large-scale systems. Finally, the control techniques must be provably convergent so as not to cause undo harm to civilians. In this project, provably convergent, moderate communication bandwidth, distributed control algorithms have been developed that can be regulated by a single soldier. We have simulated in great detail the control of low numbers of vehicles (up to 20) navigating throughout a building, and we have simulated in lesser detail the control of larger numbers of vehicles (up to 1000) trying to locate several targets in a large outdoor facility. Finally, we have experimentally validated the resulting control algorithms on smaller numbers of autonomous vehicles.

Contaminant dispersal models for use at scales ranging from meters to miles are widely used for planning sensor locations, first-responder actions for release scenarios, etc. and are constantly being improved. Applications range from urban contaminant dispersal to locating buried targets from an exhaust signature. However, these models need detailed data for model improvement and validation. A small Sandia National Laboratories Laboratory Directed Research and Development (LDRD) program was funded in FY04 to examine the feasibility and usefulness of a scale-model capability for quantitative characterization of flow and contaminant dispersal in complex environments. This report summarizes the work performed in that LDRD. The basics of atmospheric dispersion and dispersion modeling are reviewed. We examine the need for model scale data, and the capability of existing model test methods. Currently, both full-scale and model scale experiments are performed in order to collect validation data for numerical models. Full-scale experiments are expensive, are difficult to repeat, and usually produce relatively sparse data fields. Model scale tests often employ wind tunnels, and the data collected is, in many cases, derived from single point measurements. We review the scaling assumptions and methods that are used to relate model and full scale flows. In particular, we …

The Delaware Basin Drilling Surveillance Program (DBDSP) is designed to monitor drilling activities in the vicinity of the Waste Isolation Pilot Plant (WIPP). This program is based on Environmental Protection Agency (EPA) requirements. The EPA environmental standards for the management and disposal of transuranic (TRU) radioactive waste are codified in 40 CFR Part 191 (EPA 1993). Subparts B and C of the standard address the disposal of radioactive waste. The standard requires the Department of Energy (DOE) to demonstrate the expected performance of the disposal system using a probabilistic risk assessment or performance assessment (PA). This PA must show that the expected repository performance will not release radioactive material above limits set by the EPA's standard. This assessment must include the consideration of inadvertent drilling into the repository at some future time.

An efficient inversion algorithm has been developed forthree-dimensional (3D) interpretations for single-hole electromagnetic(EM) logging data based on a modified extended Born approximation (MEBA)scheme. The single-hole data was collected at an oil field undergoing CO2injection in southern California using a tool, Geo-BILT, developed byElectromagnetic Instruments, Inc (EMI). The tool is equipped with amulti-component source, and an array of multi-component receivers atdifferent separations. The inversion result provides a reasonableelectrical conductivity image to a distance of 10 m from the well, andillustrates several zones with lateral conductivity variations that couldnot be resolved with traditional induction logging tools. The computercost of the inversion processes can be further reduced using a trivialmulti-grid methodology.

When residual range migration due to either real or apparent motion errors exceeds the range resolution, conventional autofocus algorithms fail. A new migration-correction autofocus algorithm has been developed that estimates the migration and applies phase and frequency corrections to properly focus the image.

With increased terrorist threats in the past few years, it is no longer feasible to feel confident that a facility is well protected with a static security system. Potential adversaries often research their targets, examining procedural and system changes, in order to attack at a vulnerable time. Such system changes may include scheduled sensor maintenance, scheduled or unscheduled changes in the guard force, facility alert level changes, sensor failures or degradation, etc. All of these changes impact the system effectiveness and can make a facility more vulnerable. Currently, a standard analysis of system effectiveness is performed approximately every six months using a vulnerability assessment tool called ASSESS (Analytical Systems and Software for Evaluating Safeguards and Systems). New standards for determining a facility's system effectiveness will be defined by tools that are currently under development, such as ATLAS (Adversary Time-line Analysis System) and NextGen (Next Generation Security Simulation). Although these tools are useful to model analyses at different spatial resolutions and can support some sensor dynamics using statistical models, they are limited in that they require a static system state as input. They cannot account for the dynamics of the system through day-to-day operations. The emphasis of this project was to …

Located in the northern Willamette River basin, Tualatin River National Wildlife Refuge (Refuge) was established in 1992 with an approved acquisition boundary to accommodate willing sellers with potentially restorable holdings within the Tualatin River floodplain. The Refuge's floodplain of seasonal and emergent wetlands, Oregon ash riparian hardwood, riparian shrub, coniferous forest, and Garry oak communities are representative of remnant plant communities historically common in the Willamette River valley and offer an opportunity to compensate for wildlife habitat losses associated with the Willamette River basin federal hydroelectric projects. The purchase of the Oleson Units as additions to the Refuge using Bonneville Power Administration (BPA) funds will partially mitigate for wildlife habitat and target species losses incurred as a result of construction and inundation activities at Dexter and Detroit Dams. Lands acquired for mitigation of Federal Columbia River Power System (FCRPS) impacts to wildlife are evaluated using the Habitat Evaluation Procedures (HEP) methodology, which quantifies how many Habitat Units (HUs) are to be credited to BPA. HUs or credits gained lessen BPA's debt, which was formally tabulated in the FCRPS Loss Assessments and adopted as part of the Northwest Power and Conservation Council's Fish and Wildlife Program as a BPA obligation (NWPCC, …

Description. Individual raw data streams from instrumentation at the Atmospheric Radiation Measurement (ARM) Program Climate Research Facility (ACRF) fixed and mobile sites are collected and sent to the Data Management Facility (DMF) at Pacific Northwest National Laboratory for processing in near real time. Raw and processed data are then sent daily to the ACRF Archive, where they are made available to users. For each instrument, we calculate the ratio of the actual number of data records received daily at the Archive to the expected number of data records. The results are tabulated by (1) individual data stream, site, and month for the current year and (2) site and fiscal year (FY) dating back to 1998. The United States Department of Energy requires national user facilities to report time-based operating data. The requirements concern the actual hours of operation (ACTUAL); the estimated maximum operation or uptime goal (OPSMAX), which accounts for planned downtime; and the VARIANCE [1 – (ACTUAL/OPSMAX)], which accounts for unplanned downtime. The annual OPSMAX time for the Southern Great Plains (SGP) site is 8,322 hours per year (0.95 × 8,760, the number hours in a year, not including leap year). The annual OPSMAX for the North Slope Alaska …

This study investigates the factors that lead countries into conflict. Specifically, political, social and economic factors may offer insight as to how prone a country (or set of countries) may be for inter-country or intra-country conflict. Largely methodological in scope, this study examines the literature for quantitative models that address or attempt to model conflict both in the past, and for future insight. The analysis concentrates specifically on the system dynamics paradigm, not the political science mainstream approaches of econometrics and game theory. The application of this paradigm builds upon the most sophisticated attempt at modeling conflict as a result of system level interactions. This study presents the modeling efforts built on limited data and working literature paradigms, and recommendations for future attempts at modeling conflict.

This report describes the selection of water compositions for the total system performance assessment (TSPA) model of results from the thermal-hydrological-chemical (THC) seepage model documented in ''Drift-Scale THC Seepage Model'' (BSC 2004 [DIRS 169856]). The selection has been conducted in accordance with ''Technical Work Plan for: Near-Field Environment and Transport: Coupled Processes (Mountain-Scale TH/THC/THM, Drift-Scale THC Seepage, and Post-Processing Analysis for THC Seepage) Report Integration'' (BSC 2004 [DIRS 171334]). This technical work plan (TWP) was prepared in accordance with AP-2.27Q, ''Planning for Science Activities''. Section 1.2.3 of the TWP describes planning information pertaining to the technical scope, content, and management of this report. The post-processing analysis for THC seepage (THC-PPA) documented in this report provides a methodology for evaluating the near-field compositions of water and gas around a typical waste emplacement drift as these relate to the chemistry of seepage, if any, into the drift. The THC-PPA inherits the conceptual basis of the THC seepage model, but is an independently developed process. The relationship between the post-processing analysis and other closely related models, together with their main functions in providing seepage chemistry information for the Total System Performance Assessment for the License Application (TSPA-LA), are illustrated in Figure 1-1. The …

The conventional vibrating machines used in processing plants have had undesirable high noise and vibration levels. They also have had unsatisfactorily low screening efficiency, high energy consumption, high maintenance cost, low productivity, and poor worker safety. These conventional vibrating machines have been used in most every processing plant. Most of the current material separation technology uses heavy and inefficient electric motors with an unbalance rotating mass to generate the shaking. In addition to being excessively noisy, inefficient, and high-maintenance, these vibrating machines are often the bottleneck in the entire process. Furthermore, these motors, along with the vibrating machines and supporting structure, shake other machines and structures in the vicinity. The latter increases maintenance costs while reducing worker health and safety. The conventional vibrating fine screens at taconite processing plants have had the same problems as those listed above. This has resulted in lower screening efficiency, higher energy and maintenance cost, and lower productivity and workers safety concerns. The focus of this work is on the design of a high performance screening machine suitable for taconite processing plants. SmartScreens{trademark} technology uses miniaturized motors, based on smart materials, to generate the shaking. The underlying technologies are Energy Flow Control{trademark} and Vibration Control …

The effects of ionizing and neutron radiation on the characteristics and performance of laser diodes are reviewed, and the formation mechanisms for nonradiative recombination centers, the primary type of radiation damage in laser diodes, are discussed. Additional topics include the detrimental effects of aluminum in the active (lasing) volume, the transient effects of high-dose-rate pulses of ionizing radiation, and a summary of ways to improve the radiation hardness of laser diodes. Radiation effects on laser diodes emitting in the wavelength region around 808 nm are emphasized.

Wheat straw (Triticum aestivum L.) is an abundant source of plant fiber. It is regenerated, in large quantities, every year. At present, this potentially valuable resource is greatly under-exploited. Most of the excess straw biomass (i.e., tonnage above that required for agronomic cropping system sustainability) is managed through expensive chopping/tillage operations and/or burnt in the field following harvest, resulting in air pollution and associated health problems. Potential applications for wheat straw investigated within this project include energy and composites manufacture. Other methods of straw utilization that will potentially benefit from the findings of this research project include housing and building, pulp and paper, thermal insulation, fuels, and chemicals. This project focused on components of the feedstock assembly system for supplying a higher value small grains straw residue for (1) gasification/combustion and (2) straw-thermoplastic composites. This project was an integrated effort to solve the technological, infrastructural, and economic challenges associated with using straw residue for these bioenergy and bioproducts applications. The objective of the research is to contribute to the development of a low-capital distributed harvesting and engineered storage system for upgrading wheat straw to more desirable feedstocks for combustion and for straw-plastic composites. They investigated two processes for upgrading wheat …

Laboratory studies were conducted to investigate dry, regenerable, alkali carbonate-based sorbents for the capture of CO{sub 2} from power plant flue gas. Electrobalance, fixed-bed and fluid-bed reactors were used to examine both the CO{sub 2} capture and sorbent regeneration phases of the process. Sodium carbonate-based sorbents (calcined sodium bicarbonate and calcined trona) were the primary focus of the testing. Supported sodium carbonate and potassium carbonate sorbents were also tested. Sodium carbonate reacts with CO{sub 2} and water vapor contained in flue gas at temperatures between 60 and 80 C to form sodium bicarbonate, or an intermediate salt (Wegscheider's salt). Thermal regeneration of this sorbent produces an off-gas containing equal molar quantities of CO{sub 2} and H{sub 2}O. The low temperature range in which the carbonation reaction takes place is suited to treatment of coal-derived flue gases following wet flue gas desulfurization processes, but limits the concentration of water vapor which is an essential reactant in the carbonation reaction. Sorbent regeneration in an atmosphere of CO{sub 2} and water vapor can be carried out at a temperature of 160 C or higher. Pure CO{sub 2} suitable for use or sequestration is available after condensation of the H{sub 2}O. Flue gas contaminants …

This report describes both a general methodology and some specific examples of passive radio receivers. A passive radio receiver uses no direct electrical power but makes sole use of the power available in the radio spectrum. These radio receivers are suitable as low data-rate receivers or passive alerting devices for standard, high power radio receivers. Some zero-power radio architectures exhibit significant improvements in range with the addition of very low power amplifiers or signal processing electronics. These ultra-low power radios are also discussed and compared to the purely zero-power approaches.

Heavy ground vehicles, especially those involved in long-haul freight transportation, consume a significant part of our nation's energy supply. it is therefore of utmost importance to improve their efficiency, both to reduce emissions and to decrease reliance on imported oil. At highway speeds, more than half of the power consumed by a typical semi truck goes into overcoming aerodynamic drag, a fraction which increases with speed and crosswind. Thanks to better tools and increased awareness, recent years have seen substantial aerodynamic improvements by the truck industry, such as tractor/trailer height matching, radiator area reduction, and swept fairings. However, there remains substantial room for improvement as understanding of turbulent fluid dynamics grows. The group's research effort focused on vortex particle methods, a novel approach for computational fluid dynamics (CFD). Where common CFD methods solve or model the Navier-Stokes equations on a grid which stretches from the truck surface outward, vortex particle methods solve the vorticity equation on a Lagrangian basis of smooth particles and do not require a grid. They worked to advance the state of the art in vortex particle methods, improving their ability to handle the complicated, high Reynolds number flow around heavy vehicles. Specific challenges that they have …

Decommissioning of the Haddam Neck Nuclear Power Plant operated by Connecticut Yankee is in progress. Figure 1 shows a schematic of the Containment Building and Spent Fuel Pool (SFP) Building. Consideration is being given to leaving some subsurface concrete from the Containment, Spent Fuel and certain other buildings in place following NRC license termination. Characterization data of most of these structures show small amounts of residual contamination. The In-Core Sump area of the Containment Building has shown elevated levels of tritium, Co-60, Fe-55, and Eu-152 and lesser quantities of other radionuclides due to neutron activation of the concrete in this area. This analysis is provided to determine levels of residual contamination that will not cause releases to the groundwater in excess of the acceptable dose limits. The objective is to calculate a conservative relationship between the radionuclide concentration of subsurface concrete and the maximum groundwater concentration (pCi/L) for the concrete that may remain following license termination at Connecticut Yankee.

A computerized method has been developed to aid in the preliminary design of composite wind turbine blades. The method allows for arbitrary specification of the chord, twist, and airfoil geometry along the blade and an arbitrary number of shear webs. Given the blade external geometry description and its design load distribution, the Fortran code uses ultimate-strength and buckling-resistance criteria to compute the design thickness of load-bearing composite laminates. The code also includes an analysis option to obtain blade properties if a composite laminates schedule is prescribed. These properties include bending stiffness, torsion stiffness, mass, moments of inertia, elastic-axis offset, and center-of-mass offset along the blade. Nonstructural materials-gelcoat, nexus, and bonding adhesive-are also included for computation of mass. The code includes an option to format the output properties that can be directly input to advanced aeroelastic codes. This report summarizes the structural layout of composite laminates within the blade, the design approach, and the computational process. Finally, we present the results of two composite blades designed using this code in support of a project covering comparison of two- and three-blade rotors for a hypothetical turbine.

The work reported here shows the proof of principle (using a small data set) for a suite of algorithms designed to estimate the probability density function of hyperspectral background data and compute the appropriate Constant False Alarm Rate (CFAR) matched filter decision threshold for a chemical plume detector. Future work will provide a thorough demonstration of the algorithms and their performance with a large data set. The LASI (Large Aperture Search Initiative) Project involves instrumentation and image processing for hyperspectral images of chemical plumes in the atmosphere. The work reported here involves research and development on algorithms for reducing the false alarm rate in chemical plume detection and identification algorithms operating on hyperspectral image cubes. The chemical plume detection algorithms to date have used matched filters designed using generalized maximum likelihood ratio hypothesis testing algorithms [1, 2, 5, 6, 7, 12, 10, 11, 13]. One of the key challenges in hyperspectral imaging research is the high false alarm rate that often results from the plume detector [1, 2]. The overall goal of this work is to extend the classical matched filter detector to apply Constant False Alarm Rate (CFAR) methods to reduce the false alarm rate, or Probability of False …

Lawrence Livermore National Laboratory of the University of California (LLNL) operates two Class II surface impoundments that store wastewater that is discharged from a number of buildings located on the Site 300 Facility (Site 300). The wastewater is the by-product of explosives processing. Reduction in the volume of water discharged from these buildings over the past several years has significantly reduced the wastewater storage needs. In addition, the impoundments were constructed in 1984, and the high-density polyethylene (HDPE) geomembrane liners are nearing the end of their service life. The purpose of this project is to clean close the surface impoundments and provide new wastewater storage using portable, above ground storage tanks at six locations. The tanks will be installed prior to closure of the impoundments and will include heaters for allowing evaporation during relatively cool weather. Golder Associates (Golder) has prepared this Final Closure Plan (Closure Plan) on behalf of LLNL to address construction associated with the clean closure of the impoundments. This Closure Plan complies with State Water Resources Control Board (SWRCB) Section 21400 of the California Code of Regulations Title 27 (27 CCR {section}21400). As required by these regulations and guidance, this Plan provides the following information: (1) …

Observations of dead raptors at the Altamont Pass Wind Resource Area triggered concerns on the parts of regulatory agencies, environmental/conservation groups, wildlife resource agencies, and wind and electric utility industries about possible impacts to birds from wind energy development. Bird fatality rates observed at most wind projects are not currently considered significant to individual bird species populations. Although many bird species have observed fatalities, raptors have received the most attention. The primary objective of this study was to estimate and compare bird utilization, fatality rates, and collision risk indices among factors such as bird taxonomic groups, turbine types, and turbine locations within the operating wind plant in the Tehachapi Pass WRA, in south-central California between October 1996 and May 1998.

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