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Direct numerical simulation of reactor two-phase flows enabled by high-performance computing

Nuclear reactor two-phase flows remain a great engineering challenge, where the high-resolution two-phase flow database which can inform practical model development is still sparse due to the extreme reactor operation conditions and measurement difficulties. Owing to the rapid growth of computing power, the direct numerical simulation (DNS) is enjoying a renewed interest in investigating the related flow problems. A combination between DNS and an interface tracking method can provide a unique opportunity to study two-phase flows based on first principles calculations. More importantly, state-of-the-art high-performance computing (HPC) facilities are helping unlock this great potential. This paper reviews the recent research progress of two-phase flow DNS related to reactor applications. The progress in large-scale bubbly flow DNS has been focused not only on the sheer size of those simulations in terms of resolved Reynolds number, but also on the associated advanced modeling and analysis techniques. Specifically, the current areas of active research include modeling of sub-cooled boiling, bubble coalescence, as well as the advanced post-processing toolkit for bubbly flow simulations in reactor geometries. A novel bubble tracking method has been developed to track the evolution of bubbles in two-phase bubbly flow. Also, spectral analysis of DNS database in different geometries has been performed to investigate the modulation of the energy spectrum slope due to bubble-induced turbulence. In addition, the single-and two-phase analysis results are presented for turbulent flows within the pressurized water reactor (PWR) core geometries. The related simulations are possible to carry out only with the world leading HPC platforms. Furthermore, these simulations are allowing more complex turbulence model development and validation for use in 3D multiphase computational fluid dynamics (M-CFD) codes.

97 MATHEMATICS AND COMPUTING↗

GeoVision Analysis: Reservoir Maintenance and Development Task Force Report (GeoVision Analysis Supporting Task Force Report : Reservoir Maintenance and Development)

This report documents the key findings from the Reservoir Maintenance and Development (RM&D) Task of the U.S. Department of Energy's (DOE), Geothermal Technologies Office (GTO) Geothermal Vision Study (GeoVision Study). The GeoVision Study had the objective of conduc ting analyses of future geothermal growth based on sets of current and future geothermal technology developments. The RM&D Task is one of seven tasks within the GeoVision Study with the others being, Exploration and Confirmation, Potential to Penetration, Institutional Market Barriers, Environmental and Social Impacts, Thermal Applications, and Hybrid Systems. The full set of findings and the details of the GeoVision Study can be found in the final GeoVision Study report on the DOE-GTO website. As applied here, RM&D refers to the activities associated with developing, exploiting, and maintaining a known geothermal resource. It assumes that the site has already been vetted and that the resource has been evaluated to be of sufficient quality to move towards full-scale development. It also assumes that the resource is to be developed for power generation, as opposed to low-temperature or direct use applications. This document presents the key factors influencing RM&D from both a technological and operational standpoint and provides a baseline of its current state. It also looks forward to describe areas of research and development that must be pursued if the development geothermal energy is to reach its full potential.

15 GEOTHERMAL ENERGY↗

Exploring Oxygen Activity in the High Energy P2-Type Na 0.78 Ni 0.23 Mn 0.69 O 2 Cathode Material for Na-Ion Batteries

Large-scale electric energy storage is fundamental to the use of renewable energy. Recently, research and development efforts on room-temperature sodium-ion batteries (NIBs) have been revitalized, as NIBs are considered promising, low-cost alternatives to the current Li-ion battery technology for large-scale applications. Herein, we introduce a novel layered oxide cathode material, Na 0.78 Ni 0.23 Mn 0.69 O 2 . This new compound provides a high reversible capacity of 138 mAh g -1 and an average potential of 3.25 V vs Na + /Na with a single smooth voltage profile. Its remarkable rate and cycling performances are attributed to the elimination of the P2-O2 phase transition upon cycling to 4.5 V. The first charge process yields an abnormally excess capacity, which has yet to be observed in other P2 layered oxides. Metal K-edge XANES results show that the major charge compensation at the metal site during Na-ion deintercalation is achieved via the oxidation of nickel (Ni 2+ ) ions, whereas, to a large extent, manganese (Mn) ions remain in their Mn 4+ state. Interestingly, electron energy loss spectroscopy (EELS) and soft X-ray absorption spectroscopy (sXAS) results reveal differences in electronic structures in the bulk and at the surface of electrochemically cycled particles. At the surface, transition metal ions (TM ions) are in a lower valence state than in the bulk, and the O K-edge prepeak disappears. On the basis of previous reports on related Li-excess LIB cathodes, it is proposed that part of the charge compensation mechanism during the first cycle takes place at the lattice oxygen site, resulting in a surface to bulk transition metal gradient. We believe that by optimizing and controlling oxygen activity, Na layered oxide materials with higher capacities can be designed.

25 ENERGY STORAGE↗

Development of a Portable Oxygen Monitoring System for Operations in the International Space Station Airlock

NASA is currently engaged in an activity to facilitate effective operations on the International Space Station (ISS) after the Space Shuttle retires. Currently, the Space Shuttle delivers crew and cargo to and from ISS. The Space Shuttle provides the only large scale method of hardware return from ISS to the ground. Hardware that needs to be periodically repaired, refurbished, or recalibrated must come back from ISS on the Shuttle. One example of NASA flight hardware that is used on ISS and refurbished on the ground is the Compound Specific Analyzer for Oxygen (CSA-O2). The CSA-O2 is an electrochemical sensor that is used on orbit for about 12 months (depending on Shuttle launch schedules), then returned to the ground for sensor replacement. The shuttle is scheduled to retire in 2010, and the ISS is scheduled to operate until 2016. NASA needs a hand held sensor that measures oxygen in the ISS environment and has a 5-10 year service life. After conducting a survey of oxygen sensor systems, NASA selected a Tunable Diode Laser Absorption Spectrometer (TDLAS) as the method of measurement that best addresses the needs for ISS. These systems are compact, meet ISS accuracy requirements, and because they use spectroscopic techniques, the sensors are not consumed or altered after making a measurement. TDLAS systems have service life ratings of 5-10 years, based on the lifetime of the laser. NASA is engaged in modifying a commercially available sensor, the Vaisala OMT 355, for the ISS application. The Vaisala OMT 355 requires three significant modifications to meet ISS needs. The commercial sensor uses a wall mount power supply, and the ISS sensor needs to use a rechargeable battery as its source of power. The commercial sensor has a pressure correction setpoint: the sensor can be adjusted to operate at reduced pressure conditions, but the sensor does not self correct dynamically and automatically. The ISS sensor needs to operate in the airlock, and make accurate measurements in an environment that can change from 14.7 psia to 10.2 psia in 15 minutes. The commercial sensor needs to be repackaged into a configuration that is more compact, and better suited for ISS airlock operations. NASA has recently completed a prototype of the reconfigured system. The unit has been repackaged in a way that the optical path of the spectrometer is unchanged, but the electronics has been integrated into a case measuring 10.7 X 7.2 X 3.0 inches. Two flight qualified rechargeable batteries have been integrated into system. The batteries can power the sensor for 10 hours on a single charge. A pressure sensor has been added to the system. The modified unit automatically compensates for changes in pressure, and meets 0.2% accuracy requirements for oxygen measurements in an environment with 18 to 32% oxygen across a pressure range of 10.0 to 15.0 psia.

Graf, John↗

A Multi-Scale Sampling Strategy for Detecting Physiologically Significant Signals in AVIRIS Imagery

Models of photosynthetic production at ecosystem and global scales require multiple input parameters specifying physical and physiological surface features. While certain physical parameters (e.g., absorbed photosynthetically active radiation) can be derived from current satellite sensors, other physiologically relevant measures (e.g., vegetation type, water status, carboxylation capacity, or photosynthetic light-use efficiency), are not generally directly available from current satellite sensors at the appropriate geographic scale. Consequently, many model parameters must be assumed or derived from independent sources, often at an inappropriate scale. An abundance of ecophysiological studies at the leaf and canopy scales suggests strong physiological control of vegetation-atmosphere CO2 and water vapor fluxes, particularly in evergreen vegetation subjected to diurnal or seasonal stresses. For example hot, dry conditions can lead to stomatal closure, and associated "downregulation" of photosynthetic biochemical processes, a phenomenon often manifested as a "midday photosynthetic depression". A recent study with the revised simple biosphere (SiB2) model demonstrated that photosynthetic downregulation can significantly impact global climate. However, at the global scale, the exact significance of downregulation remains unclear, largely because appropriate physiological measures are generally unavailable at this scale. Clearly, there is a need to develop reliable ways of extracting physiologically relevant information from remote sensing. Narrow-band spectrometers offer many opportunities for deriving physiological parameters needed for ecosystem and global scale photosynthetic models. Experimental studies on the ground at the leaf- to stand-scale have indicated that several narrow-band features can be used to detect plant physiological status. One physiological signal is caused by xanthophyll cycle pigment activity, and is often expressed as the Photochemical Reflectance Index (PRI). Because the xanthophyll cycle pigments are photoregulatory pigments closely linked to photosynthetic function, this index can be used to derive relative photosynthetic rates. An additional signal with physiological significance is the 970 nm water absorption band, which provides a measure of liquid water content. This feature has been quantified both using a simple 2-band ratio (900/970 nm, here referred to as the "Water Band Index" or WBI;), and using the "continuum removal" method. Current atmospheric correction methods for AVIRIS imagery also obtain quantitative expressions of surface liquid water absorption based on the 970 nm water band and may be comparable to ground-based estimates of water content using this feature. However, physiological interpretations of both the PRI and the WBI are best understood at the leaf and canopy scales, where complications of atmospheric interference and complex stand and landscape features can be minimized, and where experimental manipulations can be readily applied. Currently it is not known whether these physiological indices can be used to derive meaningful physiological information from AVIRIS imagery. In addition to the problem of atmospheric interference, another challenge is that any simple physiological index can be confounded by multiple factors unrelated to physiology, and this problem can become more severe at progressively larger spatial scales. For example, previous work has suggested that both the PRI and the WBI, are strongly correlated with other optical measures of canopy structure (e.g., the Normalized Difference Vegetation Index or green vegetation fraction), indicating a confounding effect of structure on physiological signals at the larger, landscape scale. Furthermore, the normal operating mode of most imaging spectrometers does not allow simultaneous, ground truthing at a level of detail needed for physiological sampling. Additionally, manipulative experiments of physiology are difficult to apply at a geographic scale suitable for comparison with remote imagery, which often works at spatial scales that are several orders of magnitude larger than those typically used for physiological studies. These limitations require the consideration of alternative approaches to validating physiological information derived from AVIRIS data. In this report, we present a multi-scale sampling approach to detecting physiologically significant signals in narrow-band spectra. This approach explores the multi-dimensional data space provided by narrow-band spectrometry, and combines AVIRIS imagery at a large scale, with ground spectral sampling at an intermediate scale, and detailed ecophysiological measurements at a fine scale, to examine seasonally and spatially changing relationships between multiple structural and physiological variables. Examples of this approach are provided by simultaneous sampling of the Normalized Difference Vegetation Index (NDVI), an index of fractional PAR interception and green vegetation cover, the Water Band Index (WBI, an index of liquid water absorption, and the Photochemical Reflectance Index (PRI, an index of xanthophyll cycle pigment activity and photosynthetic light-use efficiency. By directly linking changing optical properties sampled on the ground with measurable physiological states, we hope to develop a basis for interpreting similar signals in AVIRIS imagery.

Gamon, John A.↗

HMI Data Driven Magnetohydrodynamic Model Predicted Active Region Photospheric Heating Rates: Their Scale Invariant, Flare Like Power Law Distributions, and Their Possible Association With Flares

There are many flare forecasting models. For an excellent review and comparison of some of them see Barnes et al. (2016). All these models are successful to some degree, but there is a need for better models. We claim the most successful models explicitly or implicitly base their forecasts on various estimates of components of the photospheric current density J, based on observations of the photospheric magnetic field B. However, none of the models we are aware of compute the complete J. We seek to develop a better model based on computing the complete photospheric J. Initial results from this model are presented in this talk. We present a data driven, near photospheric, 3 D, non-force free magnetohydrodynamic (MHD) model that computes time series of the total J, and associated resistive heating rate in each pixel at the photosphere in the neutral line regions (NLRs) of 14 active regions (ARs). The model is driven by time series of B measured by the Helioseismic & Magnetic Imager (HMI) on the Solar Dynamics Observatory (SDO) satellite. Spurious Doppler periods due to SDO orbital motion are filtered out of the time series of B in every AR pixel. Errors in B due to these periods can be significant.

Goodman, Michael L.↗

Seal Technology at Rocketdyne

Seal codes currently in use and their capabilities are discussed. Among the codes currently in use are codes for simulating floating ring seals, face seals, and load sharing seals. New codes that will extend simulation capability to barotropic fluid properties, phase change, brush seal performance, large scale roughness, and asymmetric boundary conditions are under development. Planned seal testing and fluid film bearing activity are also presented.

Scharrer, Joe↗

An Overview of Research Activity at the Launch Systems Testbed

This paper summarizes the acoustic testing and analysis activities at the Launch System Testbed (LST) of Kennedy Space Center (KSC). A major goal is to develop passive methods of mitigation of sound from rocket exhaust jets with ducted systems devoid of traditional water injection. Current testing efforts are concerned with the launch-induced vibroacoustic behavior of scaled exhaust jets. Numerical simulations are also developed to study the sound propagation from supersonic jets in free air and through enclosed ducts. Scaling laws accounting for the effects of important parameters such as jet Mach number, jet velocity, and jet temperature on the far-field noise are investigated in order to deduce full-scale environment from small-scale tests.

Vu, Bruce↗

A Plan for the Development and Demonstration of Optical Communications for Deep Space

In this article, an overall plan for the development and demonstration of optical communications for deep-space applications is presented. The current state of the technology for optical communications is presented. Then, the development and demonstration plan is presented in two parts: the overall major systems activities, followed by the generic technology developments that will enable them. The plan covers the path from laboratory subsystems demonstrations out to a full-scale flight experiment system for the proposed Mars Communications Relay Orbiter mission.

Lesh, J. R.↗

Emerging Capabilities Toward Decadal Prediction - NASA

NASA's interest and role in decadal prediction is described, along with the current capabilities and experience in prediction across weather to climate time scales. These activities span different NASA centers. In addition, plans for conducting decadal prediction at GMAO (Global Modeling and Assimilation Office) are presented, including an expansion of the present seasonal prediction system and the use of the newly developed Goddard Earth Observing System-Estimating the Circulation and Climate of the Ocean (GEOS-ECCO) system.

GEOS↗

Mid-Latitude Circulation and Extremes in a Changing Climate. Final Technical Report for DOE Award DE-SC0012599

Mid-latitude extreme weather events are responsible for a large part of climate-related damage. Yet large uncertainties remain in climate model projections of heat waves, droughts, and heavy rain/snow events on regional scales, limiting our ability to effectively use these projections for climate adaptation and mitigation. These uncertainties can be attributed to both the lack of spatial resolution in the models, and to the lack of a dynamical understanding of these extremes. The objectives of this proposal were to first to develop empirical and theoretical understanding of how fine-scale features of the atmospheric circulation that are responsible for extreme events (such as blocking, atmospheric rivers, Rossby wave breaking) are related to more easily quantifiable larger scale circulation patterns, and on the basis of this develop specific metrics that can be applied to a range of atmospheric and coupled atmosphere-ocean models to diagnose their prediction of extremes. These metrics were used to understand what model resolution is necessary to describe the probability of extreme events realistically, and will be applied to CMIP5 models and high resolution time-slice projections of future climate to better understand the potential for the shifts and intensification of extremes over North America in a changing climate. The approach was to relate the fine-scale features to the large scales in current climate simulations, seasonal re-forecasts, and climate change projections in a very wide range of models, including the atmospheric and coupled models of ECMWF over a range of horizontal resolutions (125 to 10 km), aqua-planet configuration of the Model for Prediction Across Scales and High Order Method Modeling Environments (resolutions ranging from 240 km – 7.5 km) with various physics suites, and selected CMIP5 model simulations. The large scale circulation will be quantified both on the basis of the well-tested preferred circulation regime approach, and very recently developed measures, the finite amplitude Wave Activity and its spectrum. The fine scale structures related to extremes were diagnosed following the latest approaches in the literature. The goal is to use the large scale measures as indicators of the probability of occurrence of the finer scale structures, and hence extreme events. These indicators will then be applied to the CMIP5 models and time-slice projections of a future climate. The expected outcomes of this research were: (i) a unified methodology and set of metrics that will enable modelers to assess the probability of extreme events in various current and future climate simulations, (ii) an estimate of the model resolution needed to capture extreme events in a realistic way, and (iii) a better understanding of the extreme events over North America in a changing climate.

54 ENVIRONMENTAL SCIENCES↗

Mid-Latitude Circulation and Extremes in a Changing Climate

Mid-latitude extreme weather events are responsible for a large part of climate-related damage. Yet large uncertainties remain in climate model projections of heat waves, droughts, and heavy rain/snow events on regional scales, limiting our ability to effectively use these projections for climate adaptation and mitigation. These uncertainties can be attributed to both the lack of spatial resolution in the models, and to the lack of a dynamical understanding of these extremes. The objectives of this proposal were to first to develop empirical and theoretical understanding of how fine-scale features of the atmospheric circulation that are responsible for extreme events (such as blocking, atmospheric rivers, Rossby wave breaking) are related to more easily quantifiable larger scale circulation patterns, and on the basis of this develop specific metrics that can be applied to a range of atmospheric and coupled atmosphere-ocean models to diagnose their prediction of extremes. These metrics were used to understand what model resolution is necessary to describe the probability of extreme events realistically, and will be applied to CMIP5 models and high resolution time-slice projections of future climate to better understand the potential for the shifts and intensification of extremes over North America in a changing climate. The approach was to relate the fine-scale features to the large scales in current climate simulations, seasonal re-forecasts, and climate change projections in a very wide range of models, including the atmospheric and coupled models of ECMWF over a range of horizontal resolutions (125 to 10 km), aqua-planet configuration of the Model for Prediction Across Scales and High Order Method Modeling Environments (resolutions ranging from 240 km – 7.5 km) with various physics suites, and selected CMIP5 model simulations. The large scale circulation will be quantified both on the basis of the well-tested preferred circulation regime approach, and very recently developed measures, the finite amplitude Wave Activity and its spectrum. The fine scale structures related to extremes were diagnosed following the latest approaches in the literature. The goal is to use the large scale measures as indicators of the probability of occurrence of the finer scale structures, and hence extreme events. These indicators will then be applied to the CMIP5 models and time-slice projections of a future climate. The expected outcomes of this research were: (i) a unified methodology and set of metrics that will enable modelers to assess the probability of extreme events in various current and future climate simulations, (ii) an estimate of the model resolution needed to capture extreme events in a realistic way, and (iii) a better understanding of the extreme events over North America in a changing climate.

54 ENVIRONMENTAL SCIENCES↗

Scale-up of high specific activity 186g Re production using graphite-encased thick 186 W targets and demonstration of an efficient target recycling process

Production of high specific activity 186g Re is of interest for development of theranostic radiopharmaceuticals. Previous studies have shown that high specific activity 186g Re can be obtained by cyclotron irradiation of enriched 186 W via the 186 W(d,2n) 186g Re reaction, but most irradiations were conducted at low beam currents and for short durations. In this paper, enriched 186 W metal targets were irradiated at high incident deuteron beam currents to demonstrate production rates and contaminants produced when using thick targets. Full-stopping thick targets, as determined using SRIM, were prepared by uniaxial pressing of powdered natural abundance W metal or 96.86% enriched 186 W metal encased between two layers of graphite flakes for target material stabilization. An assessment of structural integrity was made on each target preparation. To assess the performance of graphite-encased thick 186 W metal targets, along with the impact of encasing on the separation chemistry, targets were first irradiated using a 22 MeV deuteron beam for 10 min at 10, 20, and 27 μA, with an estimated nominal deuteron energy of 18.7 MeV on the 186 W target material (after energy degradation correction from top graphite layer). Gamma-ray spectrometry was performed post EOB on all targets to assess production yields and radionuclidic byproducts. The investigation also evaluated a method to recover and recycle enriched target material from a column isolation procedure. Material composition analyses of target materials, pass-through/wash solutions and recycling process isolates were conducted with SEM, FTIR, XRD, EDS and ICP-MS spectrometry. Finally, to demonstrate scaled-up production, a graphite-encased 186 W target made from recycled 186 W was irradiated for ~2 h with 18.7 MeV deuterons at a beam current of 27 μA to provide 0.90 GBq (24.3 mCi) of 186g Re, decay-corrected to the end of bombardment. ICP-MS analysis of the isolated 186g Re solution provided data that indicated the specific activity of 186g Re in this scaled-up production run was 2.6±0.5 GBq/μg (70±10 Ci/mg).

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Crystal structure of human CRMP-4: correction of intensities for lattice-translocation disorder

Crystals of human CRMP-4 showed severe lattice-translocation disorder. Intensities were demodulated using the so-called lattice-alignment method and a new more general method with simplified parameterization, and the structure is presented. Collapsin response mediator proteins (CRMPs) are cytosolic phosphoproteins that are mainly involved in neuronal cell development. In humans, the CRMP family comprises five members. Here, crystal structures of human CRMP-4 in a truncated and a full-length version are presented. The latter was determined from two types of crystals, which were either twinned or partially disordered. The crystal disorder was coupled with translational NCS in ordered domains and manifested itself with a rather sophisticated modulation of intensities. The data were demodulated using either the two-lattice treatment of lattice-translocation effects or a novel method in which demodulation was achieved by independent scaling of several groups of intensities. This iterative protocol does not rely on any particular parameterization of the modulation coefficients, but uses the current refined structure as a reference. The best results in terms of R factors and map correlation coefficients were obtained using this new method. The determined structures of CRMP-4 are similar to those of other CRMPs. Structural comparison allowed the confirmation of known residues, as well as the identification of new residues, that are important for the homo- and hetero-oligomerization of these proteins, which are critical to nerve-cell development. The structures provide further insight into the effects of medically relevant mutations of the DPYSL-3 gene encoding CRMP-4 and the putative enzymatic activities of CRMPs.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Renewable Thermal Energy Systems: Systemic Challenges and Transformational Policies (Report 2)

Two important challenges for RTES are the need for significant further innovation and deployment, particularly in the United States. In the face of continued success of other renewable energy technologies, such as solar photovoltaics (PV) and land-based wind energy for electricity, it is worthwhile to evaluate the current state of select RTES technologies in the context of technology innovation systems and energy transitions. This report marks a departure from the existing body of research we are aware of and have contributed to relating to RTES applications for industrial process heat in the United States. Our objectives for this report are fourfold: 1) Begin considering the challenges of RTES deployment in the United States through application of socio-technical and transitions frameworks; 2) Begin applying the theory of RTES as configurational technology innovation systems in the United States and for industrial process heat specifically; 3) Review RTES innovation, policies, and market formation activities in the contexts of Objectives 1 and 2; 4) Identify future paths for RTES research. Ultimately, the challenges associated with scaling the deployment of RTES in the United States are related to the need to develop a well-functioning innovation system that can overcome resistance from a highly stable socio-technical regime within a shrinking window of time to address the climate crisis, U.S. industrial competitiveness, and volatile energy commodity price shocks. Current efforts toward scaling for RTES applications in industry and buildings emphasize the need for further cost reductions, but not for interventions that support actors and their interactions and that increase the legitimacy of the technologies. As a result, there are significant opportunities to analyze the social contexts of RTES that can then be used to inform the design of effective, transformational policy portfolios.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Sensitivity Study of Multiscale and Phenomenological Elasto-Viscoplastic Grade 91 Material Models for Component-Scale Response

Many advanced nuclear reactor concepts currently being developed are targeting higher operating temperatures relative to the current fleet of light water nuclear reactors, for efficiency gains and other operational considerations. The design of high temperature structural components with reliable long-term operational performance will depend on material models that accurately capture the inelastic deformation mechanisms active in these environments. In this work, we perform a detailed parameter sensitivity analysis of two unified elasto-viscoplastic Grade 91 material models capable of capturing long term high temperature creep deformation. The first model is a phenomelogical material model from the Nuclear Engineering Material Library (NEML) developed at Argonne National Lab. The NEML model parameters and their uncertainty were fit to a range of Grade 91 experimental data using Bayesian Markov Chain Monte Carlo analysis. The second model is a LAROMance data-driven surrogate material model developed at Los Alamos National Lab. The LAROMance model is fit to a large database of responses produced by a mechanistic crystal plasticity based polycrystal model. Parameters for the LAROMance surrogate material model reflect the pedigree of the Grade 91 microstructure. Both material models have been integrated into the Grizzly code, based on the open-source MOOSE multiphysics simulation framework, to simulate both the progression of aging mechanisms and the effects of that aging on nuclear power plant structures. Grizzly is used analyze a three-dimensional Grade 91 piping system to compare the long-term inelastic response predicted by these two fundamentally different models and assess the sensitivity of the material model input parameters on this quantity of interest.

42 ENGINEERING↗

Fuel Cell Tech Team Meeting: Engineered Nano-scale Ceramic Supports for PEM Fuel Cells [Slides]

Catalyst support durability is currently a technical barrier for commercialization of polymer electrolyte membrane (PEM) fuel cells, especially for transportation applications. Degradation and corrosion of the conventional carbon supports leads to losses in active catalyst surface area and, consequently, reduced performance. As a result, the goal of this work is to develop support materials that interact strongly with Pt, yet sustain bulk-like catalytic activities with very highly dispersed particles. Ceramic materials that are prepared using conventional solid-state methods have large grain sizes and low surface areas that can only be minimally ameliorated through grinding and ball milling. Other synthesis routes to produce ceramic materials must be investigated and utilized in order to obtain desired surface areas. In this work, several different synthesis methods are being utilized to prepare electronically conductive ceramic boride, nitride, and oxide materials with high surface areas and have the potential for use as PEMFC catalyst supports. Polymer-assisted deposition (PAD) and aerosol-through plasma (A-T-P) torch are among several methods used to obtain ceramic materials with surface areas that are equal to, or exceed Vulcan XC-72R supports. Cubic Mo-based ceramic phases have been prepared with average XRD-determined crystallite sizes as low as 1.6 nm (from full profile, XRD fitting) and a BET surface area exceeding 200 m 2 /g. Additionally, black, sub-stoichiometric TiO 2-x , have been prepared with an average crystallite size in the 4 nm range and surface areas exceeding 250 m 2 /gr. Pt disposition using an incipient wetness approach produced materials with activity for hydrogen redox reactions and ORR. Cyclic voltammetry data will be shown for a variety of potential Pt/ceramic catalysts. Initial experiments indicate enhanced Pt metal-support interactions as well. Plane wave periodic density functional calculations (VASP) are being used to predict the thermodynamic and activation barriers for fundamental electrode processes occurring at platinum surfaces supported on thin films of the ceramic support materials. The results of this work will be used in order to optimize support properties.

08 HYDROGEN↗

Pursuing Cost Effective Tank Waste Characterization at the Savannah River Site - 16172

The U. S. Department of Energy Office of Environmental Management has tasked the Savannah River National Laboratory (SRNL) with developing strategies and technologies to understand, optimize, scale, and speed up tank waste characterization. This scope is part of a multi-year project with the end goal of implementing programmatic changes that accelerate tank waste processing and tank closure schedules, and at the same time reduce characterization costs, while maintaining data integrity. The project is currently in its second year. During the first year of the project, SRNL completed a series of activities focused on understanding the range of current characterization practices, needs, gaps, risks, and potential alternative approaches. Based on the results, conclusions were drawn regarding aspects of the programs that are most costly and time consuming; particular waste constituents that drive costs, schedule, and program risks; alternative characterization approaches (other than sampling and analysis) that are less expensive and more rapid; new laboratory methods holding the greatest promise for reducing characterization costs and schedule; and in whole, the primary areas where current characterization practices can be improved. SRNL's current scope is focusing on three primary activities: 1) development of a technical basis/strategy for improving the cost effectiveness and schedule of SRNL's tank closure characterization program; 2) design/assembly of hardware, plumbing, and software for automating select radiochemical separation and waste removal processes; and 3) development and testing of alternative radiochemical separation protocols most likely to improve high resource demand/time consuming analysis methods (such as Ra-226, Pa-231, Tc-99/I-129, and/or Y/trivalent actinide separations). (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗