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At least 415 records · Page 23

2016 Update of Hanford Glass Property Models and Constraints for Use in Estimating the Glass Mass to be Produced at Hanford by Implementing Current Enhanced Glass Formulation Efforts

Recent glass formulation and melter testing data have suggested that significant increases in waste loading in high-level waste (HLW) and low-activity waste (LAW) glasses are possible over current system planning estimates. In 2013 a set of models and constraints based on these data were developed and published (Vienna et al. 2013). Since that report roughly 200 additional glasses have been tested and lessons were learned in the application of the preliminary set of models and constraints. This report summarizes the advancements in glass formulation and glass property estimation since Vienna et al. 2013 (using the additional data and lessons learned) and updates the recommended set of enhanced glass property-composition models and constraints for use in River Protection Project (RPP) planning. The combined data (although limited in some cases) were evaluated to determine a set of constraints and models that could be used to estimate the maximum loading of specific waste compositions in glass. It is recommended that these models and constraints be used to estimate the likely HLW and LAW glass masses that would result if the current glass formulation studies are successfully completed. It is recognized that some of the models are preliminary in nature and will change in the coming years. In addition, the models do not currently address the prediction uncertainties that would be required before they could be used in plant operations. The models and constraints are only meant to give an indication of rough glass masses and are not intended to be used in quality-affecting activities or decisions. A current research program is in place to develop the data, models, and uncertainty descriptions for that purpose. A fundamental tenet underlying the research reported in this and the previous document is the attempt to be less conservative, but still realistic, than previous studies when developing constraints for the estimation of glass to be produced by implementing current enhanced glass formulation efforts. The less conservative approach documented herein should allow for the estimate of glass masses that may be realized if the current efforts in enhanced glass formulations are completed over the coming years, and are as successful as early indications suggest they may be. Because of this approach, there is an unquantifiable uncertainty in the ultimate glass mass projections due to model prediction uncertainties that must be considered, along with other system uncertainties, such as waste compositions and amounts to be immobilized, split factors between LAW and HLW, etc. A plan to estimate the impact of those uncertainties has been developed and a future update will document the results.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

A procedure for utilization of a damage-dependent constitutive model for laminated composites

Described here is the procedure for utilizing a damage constitutive model to predict progressive damage growth in laminated composites. In this model, the effects of the internal damage are represented by strain-like second order tensorial damage variables and enter the analysis through damage dependent ply level and laminate level constitutive equations. The growth of matrix cracks due to fatigue loading is predicted by an experimentally based damage evolutionary relationship. This model is incorporated into a computer code called FLAMSTR. This code is capable of predicting the constitutive response and matrix crack damage accumulation in fatigue loaded laminated composites. The structure and usage of FLAMSTR are presented along with sample input and output files to assist the code user. As an example problem, an analysis of crossply laminates subjected to two stage fatigue loading was conducted and the resulting damage accumulation and stress redistribution were examined to determine the effect of variations in fatigue load amplitude applied during the first stage of the load history. It was found that the model predicts a significant loading history effect on damage evolution.

Lo, David C.↗

Performance modeling of earth resources remote sensors

A technique is presented for constructing a mathematical model of an earth resources remote sensor. The technique combines established models of electronic and optical components with formulated models of scan and vibration effects, and it includes a model of the radiation effects of the earth's atmosphere. The resulting composite model is useful for predicting in-flight sensor performance, and a descriptive set of performance parameters is derived in terms of the model. A method is outlined for validating the model for each sensor of interest. The validation for one airborne infrared scanning system is accomplished in part by a satisfactory comparison of predicted response with laboratory data for that sensor.

Kidd, R. H.↗

A Structural Model Decomposition Framework for Hybrid Systems Diagnosis

Nowadays, a large number of practical systems in aerospace and industrial environments are best represented as hybrid systems that consist of discrete modes of behavior, each defined by a set of continuous dynamics. These hybrid dynamics make the on-line fault diagnosis task very challenging. In this work, we present a new modeling and diagnosis framework for hybrid systems. Models are composed from sets of user-defined components using a compositional modeling approach. Submodels for residual generation are then generated for a given mode, and reconfigured efficiently when the mode changes. Efficient reconfiguration is established by exploiting causality information within the hybrid system models. The submodels can then be used for fault diagnosis based on residual generation and analysis. We demonstrate the efficient causality reassignment, submodel reconfiguration, and residual generation for fault diagnosis using an electrical circuit case study.

structural model decomposition↗

Transient Creep of a Composite Lower Crust: Constitutive Theory - 1

A composite model is proposed to describe the time-dependent response of the Earth's lower crust. The motivation for such it model is twofold: First, new observations of widespread postseismic deformation indicate that the deep continental crust responds viscoelastically, having both long-and short-term decay times. Second, by any number of observationally based rationales, the lower crust is compositionally and structurally heterogeneous over many length scales. For heterogeneities that have much smaller characteristic lengths than the minimum deformation wavelength of interest, the aggregate rheology can be described by composite media theory. For wavelengths of the order of the thickness of the lower crust (approx. = 25-40 km) and larger, composite theory may be applied to heterogeneities that are smaller than about several hundred meters, or equivalent to the vertical extent of a thick lower crustal mylonitic shear zone. The composite media theory developed here is constructed using both Eshelhy-Mori-Tanaka theory for aligned generalized spheroidal inclusions and a generalized self-consistent method. The inclusions and matrix are considered to be Maxwellian viscoelastic: a rheology that is consistent with past homogeneous models of postseismic stress relaxation. The composite theory presented here introduces a transient response to a suddenly imposed stress field which does not appear in homogeneous Maxwell models. Analytic expressions for the amplitude and duration of the transient and for the effective long-and short-term viscosities of the composite are given which describe the sensitivity to inclusion concentration (phi), to shape, and to ratio of inclusion-to-matrix viscosity (R).

Ivins, Erik R.↗

X-Ray Diffraction and Product Consistency Test Results for the Phase 6 Study of Nepheline Formation in High-Level Waste Glasses

Hanford high-level waste (HLW) contains relatively high concentrations of Al 2 O 3 . A major constraint limiting the waste loading of high-Al 2 O 3 glasses is nepheline (nominally NaAlSiO 4 ) formation upon slow cooling of HLW glasses after melts are poured into steel canisters. The model currently planned to be used at the Hanford Waste Treatment and Immobilization Plant (WTP) for avoiding nepheline formation is too conservative and drastically limits waste loading. To increase operational flexibility and effectively operate the WTP, the effects of glass composition on glass properties must be determined and glass property-composition models must be developed. Determining the impacts of glass composition on nepheline formation and the effects of nepheline on Product Consistency Test (PCT) response is an important part of this effort. As a part of this effort, data related to the Hanford high-Al 2 O 3 HLW composition region was generated to supplement existing data for model development. Twenty glasses were fabricated, heat treated, and analyzed for crystallinity and PCT response. The heat treatment was designed to mimic the canister centerline cooling (CCC) profile of Hanford HLW glass canisters. It was found that only 6 of the 20 prepared glasses (#4, #7, #8, #10, #19, and #20) formed nepheline upon heat treatment. All glasses except for one (#19) precipitated spinel upon quenching and no glasses contained nepheline upon quenching. Of the 20 glasses, the PCT-normalized boron release of the quenched glasses and all but five of the CCC glasses satisfied the environmental assessment glass benchmark value (16.695 g/L). The CCC glass samples that exceeded the limit were #8 (48.21 g/L), #10 (19.77 g/L), #13 (20.17 g/L), #19 (60.85 g/L), and #20 (61.08 g/L). Those glasses coincide with the highest amounts of nepheline found in the CCC glasses, except for #13, which did not form nepheline after CCC.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

A study of the diffusional behavior of a two-phase metal matrix composite exposed to a high temperature environment

The progress of diffusion-controlled filament-matrix interaction in a metal matrix composite where the filaments and matrix comprise a two-phase binary alloy system was studied by mathematically modeling compositional changes resulting from prolonged elevated temperature exposure. The analysis treats a finite, diffusion-controlled, two-phase moving-interface problem by means of a variable-grid finite-difference technique. The Ni-W system was selected as an example system. Modeling was carried out for the 1000 to 1200 C temperature range for unidirectional composites containing from 6 to 40 volume percent tungsten filaments in a Ni matrix. The results are displayed to show both the change in filament diameter and matrix composition as a function of exposure time. Compositional profiles produced between first and second nearest neighbor filaments were calculated by superposition of finite-difference solutions of the diffusion equations.

Tenney, D. R.↗

A Multiscale Progressive Failure Modeling Methodology for Composites that Includes Fiber Strength Stochastics

A multiscale modeling methodology was developed for continuous fiber composites that incorporates a statistical distribution of fiber strengths into coupled multiscale micromechanics/finite element (FE) analyses. A modified two-parameter Weibull cumulative distribution function, which accounts for the effect of fiber length on the probability of failure, was used to characterize the statistical distribution of fiber strengths. A parametric study using the NASA Micromechanics Analysis Code with the Generalized Method of Cells (MAC/GMC) was performed to assess the effect of variable fiber strengths on local composite failure within a repeating unit cell (RUC) and subsequent global failure. The NASA code FEAMAC and the ABAQUS finite element solver were used to analyze the progressive failure of a unidirectional SCS-6/TIMETAL 21S metal matrix composite tensile dogbone specimen at 650 degC. Multiscale progressive failure analyses were performed to quantify the effect of spatially varying fiber strengths on the RUC-averaged and global stress-strain responses and failure. The ultimate composite strengths and distribution of failure locations (predominately within the gage section) reasonably matched the experimentally observed failure behavior. The predicted composite failure behavior suggests that use of macroscale models that exploit global geometric symmetries are inappropriate for cases where the actual distribution of local fiber strengths displays no such symmetries. This issue has not received much attention in the literature. Moreover, the model discretization at a specific length scale can have a profound effect on the computational costs associated with multiscale simulations.models that yield accurate yet tractable results.

Generalized Method of Cells↗

Sorption testing and generalized composite surface complexation models for determining uranium sorption parameters at a proposed in-situ recovery site

Solid-phase iron concentrations and generalized composite surface complexation models were used to evaluate procedures in determining uranium sorption on oxidized aquifer material at a proposed U in situ recovery (ISR) site. At the proposed Dewey Burdock ISR site in South Dakota, USA, oxidized aquifer material occurs downgradient of the U ore zones. Solid-phase Fe concentrations did not explain our batch sorption test results,though total extracted Fe appeared to be positively correlated with overall measured U sorption. Batch sorption test results were used to develop generalized composite surface complexation models that incorporated the full genericsorption potential of each sample, without detailed mineralogiccharacterization. The resultant models provide U sorption parameters (site densities and equilibrium constants) for reactive transport modeling. The generalized composite surface complexation sorption models were calibrated to batch sorption data from three oxidized core samples using inverse modeling, and gave larger sorption parameters than just U sorption on the measured solidphase Fe. These larger sorption parameters can significantly influence reactive transport modeling, potentially increasing U attenuation. Because of the limited number of calibration points, inverse modeling required the reduction of estimated parameters by fixing two parameters. The best-fit models used fixed values for equilibrium constants, with the sorption site densities being estimated by the inversion process. While these inverse routines did provide best-fit sorption parameters, local minima and correlated parameters might require further evaluation. Despite our limited number of proxy samples, the procedures presented provide a valuable methodology to consider for sites where metal sorption parameters are required. Furthermore, these sorption parameters can be used in reactive transport modeling to assess downgradient metal attenuation, especially when no other calibration data are available, such as at proposed U ISR sites.

54 ENVIRONMENTAL SCIENCES↗

Absorber Column CFD model validation against PNNL’s device-scale absorber column on the LCFS unit

Absorber column has been widely used for CO 2 capture in the coal-fired power plants. High-fidelity CFD models play an important role in absorber column design and solvents optimization, which help enhance the CO 2 capture efficiency and reduce the operation cost. This report provides a comprehensive description of the development of CFD absorber models at two different levels, the design and implementation of PNNL’s device-scale absorber column experiment, and the methodology to combine the CFD results, experiment data, and Aspen model for a better understanding of the interface area in packed column. A composite model is firstly proposed in the Discrete Element Method (DEM) packing process, which can model the complex geometry of various packing elements. This generates a realistic packing pattern and accurate packing porosity ε and specific area a p compared to the actual values for absorber column used in LCFS. Two level of CFD absorber models were developed, namely the full-size column model (FCM) to simulate the entire packed column with a focus on the wall/entrance effects, and the representative column model (RCM) to simulate a section of column with a focus on the sensitivity study of interface area. A Design of Experiment (DoE) plan was developed to guide the collection of 100 run CFD data and 12 experiment runs. The 100 CFD runs were carried out in the RCM with Pro-Pak packing and cover a wide operation range and solvent properties. Impact of influential factors on the interface area in packed column were investigated in details. The CFD interface area was then combined with the experimental data and Aspen model to infer some information of the effective contact angle in the column. The accuracy and uncertainties in the interface area and contact angle can be quantified.

01 COAL, LIGNITE, AND PEAT↗

CFD analysis of the STME nozzle flowfield

The Space Transportation Main Engine (STME) uses a gas generator cycle to cool the nozzle wall by a film-dump of the turbine exhaust. The ability to cool the skirt is a key concern in the design of the STME. CFD calculations were undertaken to predict the film cooling effectiveness and performance sensitivities for various configurations, operating points, and inlet conditions. The results presented here were obtained for the subscale nozzle. The computations were performed using REFLEQS. The computational analysis showed that a chemical equilibrium model was necessary to obtain correct predictions of the specific impulse. The frozen composition model underpredicts the ISP by about 6 percent. It was also observed that the coolant film was successful in maintaining the nozzle wall well below the stagnation temperature of the core flow. The effect of the coolant flow on the performance of the engine was found to be negligible. The computed heat fluxes at the wall were in good agreement with the empirical data obtained by Pratt and Whitney. Further test data from Pratt and Whitney are forthcoming for the subscale nozzle. Calculations will be performed to determine cooling efficiencies and nozzle performance over a range of conditions, and model predictions will be compared with experimental data. Information is given in viewgraph form.

Krishnan, Anantha↗

Benchmark Imagery Project: Selection of Real World Images for Creating Composite Images of Facilities

The "Benchmark Imagery" project is a DOE NA-22-funded effort whose three-year goal is to create a suite of imagery (both real and composite) that can be used to test geospatial algorithms used for extracting semantic content from overhead images of industrial facilities. A composite image is an image that contains both real elements such as photographic imagery and synthetic elements such as 3D models. Composite images have the advantage of being customizable and distributable, and they can contain complete ground truth. It is our goal to generate composite images which appear realistic to both human and algorithm. When generating composite images of facilities we use real overhead imagery to increase realism and decrease effort. To construct all elements with purely synthetic textures would require too much effort and still may not look as realistic as a real image. We use real time 3D rendering software "SceneWorks" for rendering composite images. In SceneWorks, a scene is constructed by placing 3D models of facility components on top of a base terrain. A base terrain is a 3D model constructed from digital elevation mapping (DEM) data and then textured with overhead orthorectified imagery. The base terrain is constructed to be geospatially accurate using a real location’s source data (DEM and Imagery.) This document outlines the selection criteria in selecting appropriate location and source data for constructing the base terrain. Imagery should have resolution equal or better than desired composite image resolution. The imagery should have no seams. Seams can occur when two or more different imagery data sets exist in a single area with neither set covering the entire area. Elevation data (DEM) resolution generally should be 1/9 arc second or better depending on the variability of elevation. The imagery must contain a flat clearing of land large enough for multiple facility types. There should be no high-rise buildings anywhere in the base terrain.

42 ENGINEERING↗

A continuum damage model of fatigue-induced damage in laminated composites

A model is presented which predicts the stress-strain behavior of continuous fiber reinforced laminated composites in the presence of microstructural damage. The model is based on the concept of continuum damage mechanics and uses internal state variables to characterize the various damage modes. The associated internal state variable growth laws are mathematical models of the loading history induced development of microstructural damage. The model is demonstrated by using it to predict the response of damaged AS-4/3502 graphite/epoxy laminate panels.

Harris, Charles E.↗

Defense Waste Processing Facility (DWPF) Viscosity Model: Revisions for Processing High TiO 2 Containing Glasses

Radioactive high-level waste (HLW) at the Savannah River Site (SRS) has successfully been vitrified into borosilicate glass in the Defense Waste Processing Facility (DWPF) since 1996. Vitrification requires stringent product/process (P/P) constraints since the glass cannot be reworked once it is poured into ten foot tall by two foot diameter canisters. A unique “feed forward” statistical process control (SPC) was developed for this control rather than statistical quality control (SQC). In SPC, the feed composition to the DWPF melter is controlled prior to vitrification. In SQC, the glass product would be sampled after it is vitrified. Individual glass property-composition models form the basis for the “feed forward” SPC. The models transform constraints on the melt and glass properties into constraints on the feed composition going to the melter in order to guarantee, at the 95% confidence level, that the feed will be processable and that the durability of the resulting waste form will be acceptable to a geologic repository. The DWPF SPC system is known as the Product Composition Control System (PCCS). The DWPF will soon be receiving wastes from the Salt Waste Processing Facility (SWPF) containing increased concentrations of TiO 2 , Na 2 O, and Cs 2 O . The SWPF is being built to pretreat the high-curie fraction of the salt waste to be removed from the HLW tanks in the F- and H-Area Tank Farms at the SRS. In order to process TiO 2 concentrations >2.0 wt% in the DWPF, new viscosity data were developed over the range of 1.90 to 6.09 wt% TiO 2 and evaluated against the 2005 viscosity model. An alternate viscosity model is also derived for potential future use, should the DWPF ever need to process other titanate-containing ion exchange materials. The ultimate limit on the amount of TiO 2 that can be accommodated from SWPF will be determined by the three PCCS models, the waste composition of a given sludge batch, the waste loading of the sludge batch, and the frit used for vitrification.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Quantitative interpretation of time-lapse seismic data at Farnsworth field unit: Rock physics modeling, and calibration of simulated time-lapse velocity responses

Here, this study investigates the contribution of fluid saturation variation to the time-lapse velocity response by performing fluid substitution modeling. The methodology is exemplified by the time-lapse seismic monitoring of carbon dioxide at Farnsworth field unit (FWU). In order to evaluate the fluid distribution in a matured oil reservoir, the Southwest Regional Partnership (SWP) acquired multiple vertical seismic profile (VSP) surveys at different times during the CO 2 –water alternatinggas (WAG) injection period. In this work, we present a thorough methodology for computing the elastic response of the saturated rock for different fluid saturations using a site-specific petro-elastic model (PEM). The output from the PEM was combined with results from a fluid compositional model to compute the seismic velocities at times corresponding to each VSP survey. To produce a calibrated simulated response, the measured time-lapse seismic velocities were integrated into the numerical simulation model. The mismatches between the predicted and measured time-lapse velocities were minimized through an iterative calibration process using a trained artificial neural network proxy (ANN) coupled with a particle swarm optimizer (PSO). Our study indicates that the hybrid optimization workflow can effectively perform the history matching. With an accurate prediction of the hydrodynamic properties, the migration of CO 2 within the subsurface was modeled by predicting the spatial velocity distribution for a radius of 305 m around the injection well. The technology demonstrated and the expertise gained from this study can guide similar CO 2 -WAG projects.

58 GEOSCIENCES↗

Influence of ion site occupancies on the unit cell parameters, specific volumes, and densities of M 8 (AlSiO 4 ) 6 X 2 sodalites where M = Li, Na, K, Rb, and Ag and X = Cl, Br, and I

Here, this paper discusses the effects of composition on the unit cell parameter (a), unit cell volume (V), specific volume (v), and density (ρ) of various sodalite compositions including $M^+_8$(AlSiO 4 ) 6 Cl 2 (M = Li, Na, K, Rb, and/or Ag) and Na8(AlSiO 4 ) 6 $X^-_2$(X = Cl, Br, and/or I). Compositional models were developed, and the results show that the models are successful at predicting a, V, and v (and thus ρ) within the compositional range available in the literature. Discussion is included on the correlation between the ionic radii of the alkali metals and halides in the sodalite β-cages and the measured values of a, V, v, and ρ. The data show linear increases in a and ρ with increases in the average ionic radii of the M + and X - constituents (data for v show a linear decrease).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗