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At least 37 records · Page 2

Yield degradation mechanisms for two-shock capsules evaluated through simulations

An investigation of twenty two-shock campaign indirectly driven capsules on the National Ignition Facility was conducted using the xRAGE computer code. The two-shock platform was developed to look at the sensitivity of fuel–ablator mix with shock timing, asymmetry, surface roughness, and convergence on roughly ignition size scale capsules. This platform used CH/CD (plastic/deuterated plastic) shell capsules that were about 685-μm outer radius and filled with D2 or hydrogen-tritium (HT) gas. The experimental radius and velocity vs time, neutron yield, burn averaged ion temperature (Tion), burn width, and self-emission image size were compared to one-dimensional (1D) and two-dimensional (2D) simulations. Our 2D simulations suggest that the mixing of glass from the fill tube was the dominant source of impurity in the gas region of the capsule during burn, along with fuel–ablator mix. The mass of glass mixed in is about 5–10 ng. Our 2D simulations capture most of the yield trends from different degradation mechanisms, and they match the observed burn width and Tion measurements. Our 2D models match all the available data to within 2.5 times the normalized experimental error for 19 of 20 capsules.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DARHT-II Beam Position Monitor B-Dot Owner’s Manual

Azimuthal arrays of magnetic and electric field detectors are used to measure the position of the centroid of the DARHT relativistic electron beams. These arrays consist of four detectors with 90-degree azimuthal separation. Differencing the opposing detectors and normalizing to the sum of all four gives the position of the beam, subject to negligibly small errors as discussed in Attachment A. This measurement yields the centroid of the current density, independent of the beam azimuthal asymmetry.

42 ENGINEERING↗

Evaluation of CMIP6 models in simulating the statistics of extreme precipitation over Eastern Africa

We report the Eastern Africa region experiences frequent extreme precipitation events that can cause destruction of property and environment, and loss of lives. Thus, there is a need to understand how these events may change in the future and how well the global climate models that are used to make projections can simulate precipitation extremes in this region before they can be used in downscaling or flood and drought impact assessment studies. In this work, we evaluated the ability of sixteen Coupled Model Intercomparison Project Phase 6 (CMIP6) models to simulate present-day precipitation extremes over the Eastern Africa region during the two rainy seasons (March–May and September–November). We used nine extreme precipitation indices (including seven (one) indices of wet (dry) extremes) defined by the Expert Team on Climate Change Detection and Indices. The CMIP6 models were evaluated against two gridded observation datasets: Global Precipitation Climatology Project One-Degree Daily Dataset and Tropical Rainfall Measuring Mission Multi-satellite Precipitation Analysis 3B42. Three model performance metrics (percentage bias, normalized root-mean-square error, and pattern correlation coefficient) were employed to further assess the strengths and weakness of the models. Our results show that the multi-model ensemble mean generally provides a better representation of observed precipitation and related extremes compared to individual models when considering all metrics and seasons. Several consistent biases are evident across CMIP6 models, which tend to overestimate the total-wet day precipitation and consecutive wet days, and underestimate very wet days and maximum 5-day precipitation in both seasons. Furthermore, no single model consistently performs best, model performance varies with the season and index under consideration and is generally independent of horizontal resolution.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Optical functions of uniaxial rutile and anatase (TiO 2 ) revisited

In this study, the optical functions of uniaxial rutile and anatase (TiO2) were determined from 200 to 850 nm (6.2 to 1.46 eV) using several of four optical techniques: (1) standard spectroscopic two-modulator generalized ellipsometry (2-MGE), (2) near-normal-incidence two-modulator generalized ellipsometry microscopy (2-MGEM), (3) Mueller matrix transmission of rutile, and (4) polarized transmission of rutile. The 2-MGE measurements yielded highly accurate values of the dielectric functions and error estimates from 1.46 to 6.2 eV, whereas the polarization-dependent transmission yielded more accurate values of the absorption coefficient below the band edge of rutile. The 2-MGEM also measured the diattenuation, which is related to the birefringence, and other parameters but at near-normal incidence at a single wavelength (577 nm).

36 MATERIALS SCIENCE↗

Using DAPPER to extract the photon strength function of 58 Fe using the inverse Oslo and shape methods

The photon strength function of 58 Fe has been extracted using both the Oslo and Shape methods from particle–γ coincidence data measured using the Detector Array for Photons, Protons, and Exotic Residues, which probes nuclei utilizing (d,p) reactions in inverse kinematics. Four particle–γ coincidence matrices, each constructed with different treatments of the γ–ray energies, are explored in order to observe the impact on the resulting nuclear level density and photon strength. The final photon strength function reported is found to agree well with previous Oslo measurements of other iron isotopes. Systematic uncertainties are included, using different model parameters and their reported errors to perform the Oslo method normalization. The model-independent Shape method is explored and the functional form of the photon strength function obtained is in agreement with the Oslo method results. A low-energy enhancement is not reported for 58 Fe in this work given possible subtraction issues originating from strongly populated states.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

3D CFD Model Validation Using Benchmark Data of 1/16th Scaled VHTR Upper Plenum and Development of Wall Heat-Transfer Correlation For Laminar Flow

With support from the U.S. Department of Energy-Office of Nuclear Energy’s (DOE-NE’s) Nuclear Energy Advanced Modeling and Simulation (NEAMS) program, an effort has been pursued to support high-temperature gas-cooled reactor (HTGR) technology development and its modeling and simulation needs. There is a particular need for advanced modeling and simulation tools to predict thermal-fluid behavior in the nuclear reactor primary system, especially in the core and the lower and upper plena, during safety-related transients. In this report, two main such activities are presented relevant to the HTGRs: (1) three-dimensional (3D) computational fluid dynamics (CFD) validation using benchmark data from the upper plenum of Texas A&M University’s 1/16th scaled very-high-temperature gas-cooled reactor (VHTR), and (2) development of wall heat-transfer correlation for laminar flow in a wall-heated pipe. The CFD tool validation exercises can be helpful to choose the models and CFD tools to simulate and design specific components of the HTRGs such as upper plenum where jet mixing is a complex phenomenon. In a loss of forced circulation event, the laminar flow can be observed during the development of natural circulation flow. This work includes the development and validation of heat transfer correlations for laminar flow using the Nek5000 CFD code due to limited available experimental data for laminar flow conditions to guide low-order models (1D). In this report, the flow characteristics of a single isothermal jet discharging into the upper plenum was investigated using the Nek5000 Large-Eddy Simulation (LES) CFD tool. Several numerical simulations were performed for various jet-discharged Reynolds numbers ranging from 3,413 to 12,819. A grid-independent study was performed. The numerical results of mean velocity, root-mean-square fluctuating velocity, and Reynolds stress were compared against the benchmark data. Good agreement was obtained between simulated and measured data for axial mean velocities, except near the upper plenum hemisphere. The maximum predicted errors for axial mean velocities at various normalized coolant channel diameter heights of 1, 5, and 10 are 1.56%, 1.88%, and 3.82%, respectively. In addition, the predicted root-mean-square fluctuating velocity and Reynolds stress are qualitatively in agreement with the experimental data. The Nek5000 code was used to develop wall-heat transfer correlation for laminar flow in a cylindrical tube. Several simulations were performed for various Reynolds flow and wall-heat fluxes. A new heat transfer correlation was developed using data from Nek5000 simulation results and regression functions in Matlab. The developed heat transfer correlation is valid for various Reynolds flows from 200 to 2000. The predicted R² value for model fit was 0.875, which ensures that 87.5% of the model data lies on the Nek5000 data. Moreover, a machine learning (ML) tool was used to train and test the Nek5000 data. A good fit of the ML-based model was observed with the test data.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Using DAPPER to extract the photon strength function of 58Fe using the inverse Oslo and shape methods

The photon strength function of 58 Fe has been extracted using both the Oslo and Shape methods from particle-γ coincidence data measured using the Detector Array for Photons, Protons, and Exotic Residues, which probes nuclei utilizing (d,p) reactions in inverse kinematics. Four particle-γ coincidence matrices, each constructed with different treatments of the γ-ray energies, are explored in order to observe the impact on the resulting nuclear level density and photon strength. The final photon strength function reported is found to agree well with previous Oslo measurements of other iron isotopes. Systematic uncertainties are included, using different model parameters and their reported errors to perform the Oslo method normalization. The model-independent Shape method is explored and the functional form of the photon strength function obtained is in agreement with the Oslo method results. A low-energy enhancement is not reported for 58 Fe in this work given possible subtraction issues originating from strongly populated states.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Physics-guided machine learning for improved accuracy of the National Solar Radiation Database

The National Solar Radiation Database (NSRDB) provides high-resolution spatiotemporal solar irradiance data for the entire globe. The NSRDB uses a two-step Physical Solar Model (PSM) to compute the effects of clouds and other atmospheric variables on the solar radiation reaching the surface of the Earth. Physical and optical cloud properties are fundamental inputs to the PSM and are derived from the National Oceanic and Atmospheric Administration's Geostationary Operational Environmental Satellites. This paper describes recent improvements to the NSRDB driven by physics-guided machine learning methods for cloud property retrieval. The impacts of these new methods on the NSRDB irradiance data are validated using an extensive set of ground measurement sites, showing significant improvement for all sites. We report on average, the mean absolute percentage error for global horizontal irradiance and direct normal irradiance show reductions of 2.16 and 3.95 percentage points respectively for all daylight conditions, 5.92 and 17.39 percentage points respectively for cloudy conditions, and 9.00 and 22.59 percentage points respectively for gap-filled cloudy conditions. These new methods will help improve the quality and accuracy of the irradiance and cloud data in the NSRDB.

14 SOLAR ENERGY↗

Performance Comparison of Circular and Spherical Error Probable Estimators

This report compares the performance of three Circular Error Probable (CEP) estimators: the Grubbs-Patnaik estimator, a new, non-iterative, radial-integration estimator, and a median estimator. It also compares the performance of two Spherical Error Probable (SEP) estimators. The performance of each estimator is assessed in terms of bias, uncertainty, robustness, and computational complexity. Robustness is evaluated with respect to outliers, variations in the underlying statistical distribution characterizing munition impact positions, and impact-position measurement errors. The performance assessments indicate the radial-integration and Grubbs-Patnaik estimators perform nearly identically providing the statistical distribution of impact-position coordinates is jointly normal with zero means. In that case, both estimators outperform the median estimator by about 2% relative to the true CEP in terms of estimator uncertainty. The bias performance of the radial-integration and median estimators is close to zero for jointly normal impacts, however, the Grubbs-Patnaik estimator can be significantly biased for jointly normal impacts with non-zero means. When the statistical distribution characterizing impact positions is known, but not jointly normal, the radial-integration estimator is superior. In this case, the median estimator also outperforms the Grubbs-Patnaik estimator but is not quite as good as the radial-integration estimator. If the statistical distribution characterizing impacts is unknown and not jointly normal, or if distribution parameters are difficult or impractical to estimate, or if test data is corrupted with outliers, then the median estimator dramatically outperforms the other estimators, especially in terms of estimation bias. Unexpectedly, measurement noise did not significantly degrade the performance of any of the estimators, except for cases with signal to noise ratios less than five. Although the Grubbs-Patnaik estimator has remained the gold standard for CEP estimation for over half a century, the performance assessments indicate the new, non-iterative, radial-integration estimator and the median estimator offer significant advantages and, in most practical real-world conditions, are superior estimators. These estimators are also useful for SEP estimation whereas the Grubbs-Patnaik estimator does not extend to three dimensions.

97 MATHEMATICS AND COMPUTING↗

Composition Measurements of the LAW Phase 5 Glasses

This report provides the results from the chemical analyses of glass compositions for the Low-Activity Waste Phase 5 study glasses, a series of simulated nuclear waste glasses fabricated at Pacific Northwest National Laboratory. These data will be used in the development of enhanced property/composition models for waste glass vitrification at Hanford. Chemical analyses were performed on a representative sample of each of the quenched glasses to allow for comparisons with targeted compositions. The relative differences between the targeted and measured concentrations of CaO, Cl - , K 2 O, Li 2 O, and SO 3 for some of the glasses were greater than 10%. Several of these glass samples were rerun to verify original measurements; however, there were no significant changes in the measurements to indicate errors in preparation or analysis of the samples. These results can be used in further characterization of this series of glasses, including the normalization of Product Consistency Test results.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

N - V –Diamond Magnetic Microscopy Using a Double Quantum 4-Ramsey Protocol

We introduce a double quantum (DQ) 4-Ramsey measurement protocol that enables wide-field magnetic imaging using nitrogen-vacancy (N-V) centers in diamond, with enhanced homogeneity of the magnetic sensitivity relative to conventional single quantum (SQ) techniques. The DQ 4-Ramsey protocol employs microwave-phase alternation across four consecutive Ramsey (4-Ramsey) measurements to isolate the desired DQ magnetic signal from any residual SQ signal induced by microwave pulse errors. In a demonstration experiment employing a 1-μm-thick N-V layer in a macroscopic diamond chip, the DQ 4-Ramsey protocol provides a volume-normalized dc magnetic sensitivity of η V = 34nTHz –1/2 μm 3/2 across a 125 μm × 125 μm field of view, with about 5× less spatial variation in sensitivity across the field of view compared to a SQ measurement. Furthermore, the improved robustness and magnetic sensitivity homogeneity of the DQ 4-Ramsey protocol enables imaging of dynamic broadband magnetic sources such as integrated circuits and electrically active cells.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Classroom aerosol dispersion modeling: experimental assessment of a low-cost flow simulation tool

The purpose of this study was to assess the utility of a low-cost flow simulation tool for an indoor air modeling application by comparing its outputs with the results of a physical experiment, as well as those from a more advanced computational fluid dynamics (CFD) software package. In this study, five aerosol dispersion tests were performed in two different classrooms by releasing a CO 2 tracer gas from six student locations. Resultant steady-state concentrations were monitored at 13 locations around the periphery of the room. Subsequently, the experiments were modeled using both a low-cost tool (SolidWorks Flow Simulation) and a more sophisticated tool (STAR-CCM+). Models were evaluated based on their ability to predict the experimentally measured concentrations at the 13 monitoring locations by calculating four performance parameters commonly used in the evaluation of dispersion models: fractional mean bias (FB), normalized mean-square error (NMSE), fraction of predicted value within a factor of two (FAC2), and normalized absolute difference (NAD). The more sophisticated model performed better in 15 of the 20 possible cases (five tests at four parameters each), with parameters meeting acceptance criteria in 19 of 20 cases. However, the lower-cost tool was only slightly worse, with parameters meeting acceptance criteria in 18 of 20 cases, and it performed better than the other tool in 3 of 20 cases. Because it provides useful results at a fraction of the monetary and training cost and is already widely accessible to many institutions, such a tool may be worthwhile for many indoor aerosol dispersion applications, especially for students or researchers just beginning CFD modeling.

54 ENVIRONMENTAL SCIENCES↗

Enhancing the representation of water management in global hydrological models

Abstract. This study enhances an existing global hydrological model (GHM), Xanthos, by adding a new water management module that distinguishes between the operational characteristics of irrigation, hydropower, and flood control reservoirs. We remapped reservoirs in the Global Reservoir and Dam (GRanD) database to the 0.5∘ spatial resolution in Xanthos so that a single lumped reservoir exists per grid cell, which yielded 3790 large reservoirs. We implemented unique operation rules for each reservoir type, based on their primary purposes. In particular, hydropower reservoirs have been treated as flood control reservoirs in previous GHM studies, while here, we determined the operation rules for hydropower reservoirs via optimization that maximizes long-term hydropower production. We conducted global simulations using the enhanced Xanthos and validated monthly streamflow for 91 large river basins, where high-quality observed streamflow data were available. A total of 1878 (296 hydropower, 486 irrigation, and 1096 flood control and others) out of the 3790 reservoirs are located in the 91 basins and are part of our reported results. The Kling–Gupta efficiency (KGE) value (after adding the new water management) is ≥ 0.5 and ≥ 0.0 in 39 and 81 basins, respectively. After adding the new water management module, model performance improved for 75 out of 91 basins and worsened for only 7. To measure the relative difference between explicitly representing hydropower reservoirs and representing hydropower reservoirs as flood control reservoirs (as is commonly done in other GHMs), we use the normalized root mean square error (NRMSE) and the coefficient of determination (R2). Out of the 296 hydropower reservoirs, the NRMSE is > 0.25 (i.e., considering 0.25 to represent a moderate difference) for over 44 % of the 296 reservoirs when comparing both the simulated reservoir releases and storage time series between the two simulations. We suggest that correctly representing hydropower reservoirs in GHMs could have important implications for our understanding and management of freshwater resource challenges at regional-to-global scales. This enhanced global water management modeling framework will allow the analysis of future global reservoir development and management from a coupled human–earth system perspective.

13 HYDRO ENERGY↗

A non-intrusive optical (NIO) approach to characterize heliostats in utility-scale power tower plants: Methodology and in-situ validation

No reliable in-situ optical characterization tool is available that can efficiently and accurately measure various optical errors of individual heliostats in a utility-scale power-tower plant. Here, an innovative non-intrusive optical (NIO) approach is proposed to measure mirror surface slope error, mirror facet canting error, and heliostat tracking error based on reflection images using the natural target—the tower—in a heliostat field. The NIO approach adopts various techniques in photogrammetry, reflectometry, and geometrical optics to first determine the camera position and the actual tower position with respect to the heliostat. Then, Snell’s law is applied to find the surface normal at the reflection point or line of a reflection image and derive the surface slope error, mirror facet canting error, and heliostat tracking error accordingly. In addition, an in-situ validation is performed to demonstrate the feasibility of the NIO approach. Analysis with multiple sets of reflection images on one single heliostat of interest demonstrates that the NIO method can achieve a measurement uncertainty of 0.22 mrad for mirror facet slope error (root-mean-square) at the given test conditions. The sensitivity of measurement uncertainty to various parameters will be presented in a separate work. In the future, state-of-the-art unmanned aerial systems (UAS) are planned to perform the efficient image collection with a goal to complete the survey across a utility-scale field of over 10,000 heliostats within one or a few days depending on the number of UASs. The development of the NIO approach is expected to fill the critical gap for successful solar-field operation and maintenance, which is necessary for the global growth of the solar power-tower technology. The NIO approach can also be applied to any relevant industry requiring high-precision mirror surface shape characterization.

14 SOLAR ENERGY↗

Bias Correction in Urban Building Energy Modeling for Chicago Using Machine Learning

Urban-scale building energy modeling (UBEM) holds promise for optimizing energy usage across extensive geographic regions. However, there is a recognized bias between simulated energy consumption and actual measured data. This study, based on building data from Chicago, delved into bias correction techniques for enhancing the accuracy of UBEM energy consumption estimates. Initially, the AutoBEM simulation yielded a normalized mean bias error (NMBE) of 1.1% and 51% of Coefficient of the Variation of the Root Mean Square Error (CVRMSE) after outlier exclusion. To address this, three bias correction methods were deployed: Average Mean Bias Error based bias correction, Quantile mapping bias correction, and Machine learning-based bias correction using Linear Regression and Random Forest models. Post-correction results exhibited marked improvement. The NMBE values were diminished to 0 for Average MBE-based, 0.36 for Quantile Mapping, and 0 for Machine Learning-based corrections. Concurrently, the CVRMSE values registered reductions from an original 51 to 50.8 for Quantile Mapping, and 38.56 for Machine Learning-based corrections, pointing towards the effectiveness of specific bias correction methods in refining the precision of UBEM energy predictions. Such accurate estimations are paramount for informed energy planning and urban policy-making.

Chowdhury, Shovan↗

Graph convolutional networks applied to unstructured flow field data

Abstract Many scientific and engineering processes produce spatially unstructured data. However, most data-driven models require a feature matrix that enforces both a set number and order of features for each sample. They thus cannot be easily constructed for an unstructured dataset. Therefore, a graph based data-driven model to perform inference on fields defined on an unstructured mesh, using a graph convolutional neural network (GCNN) is presented. The ability of the method to predict global properties from spatially irregular measurements with high accuracy is demonstrated by predicting the drag force associated with laminar flow around airfoils from scattered velocity measurements. The network can infer from field samples at different resolutions, and is invariant to the order in which the measurements within each sample are presented. The GCNN method, using inductive convolutional layers and adaptive pooling, is able to predict this quantity with a validation R 2 above 0.98, and a Normalized Mean Squared Error below 0.01, without relying on spatial structure.

Ogoke, Francis (ORCID:0000000224327783)↗

Evaluation of intracoronary hemodynamics identifies perturbations in vorticity

Coronary artery disease (CAD) is highly prevalent and associated with adverse events. Challenges have emerged in the treatment of intermediate coronary artery stenoses. These lesions are often interrogated with fractional flow reserve (FFR) testing to determine if a stenosis is likely to be causative for ischemia in a cardiac territory. This invasive test requires insertion of a pressure wire into a coronary vessel. Recently computational fluid dynamics (CFD) has been used to noninvasively assess fractional flow reserve in vessels reconstructed from medical imaging data. However, many of these simulations are unable to provide additional information about intravascular hemodynamics, including velocity, endothelial shear stress (ESS), and vorticity. We hypothesized that vorticity, which has demonstrated utility in the assessment of ventricular and aortic diseases, would also be an important hemodynamic factor in CAD. Three-dimensional (3D), patient-specific coronary artery geometries that included all vessels >1 mm in diameter were created from angiography data obtained from 10 patients who underwent diagnostic angiography and FFR testing (n = 9). A massively parallel CFD solver (HARVEY) was used to calculate coronary hemodynamic parameters including pressure, velocity, ESS, and vorticity. These simulations were validated by comparing velocity flow fields from simulation to both velocities derived from in vitro particle image velocimetry and to invasively acquired pressure wire-based data from clinical testing. There was strong agreement between findings from CFD simulations and particle image velocimetry experimental testing (p < 0.01). CFD-FFR was also highly correlated with invasively measured FFR (ρ = 0.77, p = 0.01) with an average error of 5.9 ± 0.1%. CFD-FFR also had a strong inverse correlation with the vorticity (ρ = -0.86, p = 0.001). Simulations to determine the effect of the coronary stenosis on intravascular hemodynamics demonstrated significant differences in velocity and vorticity (both p < 0.05). Further evaluation of an angiographically normal appearing non-FFR coronary vessel in patients with CAD also demonstrated differences in vorticity when compared with FFR vessels (p < 0.05). The use of highly accurate 3D CFD-derived intravascular hemodynamics provides additional information beyond pressure measurements that can be used to calculate FFR. Vorticity is one parameter that is modified by a coronary stenosis and appears to be abnormal in angiographically normal vessels in patients with CAD, highlighting a possible use-case in preventative screening for early coronary disease.

59 BASIC BIOLOGICAL SCIENCES↗

Improving multiwell petrophysical interpretation from well logs via machine learning and statistical models

Well-log interpretation estimates in situ rock properties along well trajectory, such as porosity, water saturation, and permeability, to support reserve-volume estimation, production forecasts, and decision making in reservoir development. However, due to measurement errors, variability of well logs caused by multiple measurement vendors, different borehole tools, and nonuniform drilling/borehole conditions, estimations of rock properties with original well logs without proper preprocessing may not be accurate, especially in the context of multiwell estimation. Well-log normalization techniques such as two-point scaling and mean-variance normalization are commonly used to improve the robustness of multiwell rock-property estimation. However, these techniques do not consider the correlation between well logs and require subjective knowledge for their effective implementation. To reduce uncertainties and processing time associated with multiwell rock-property estimation from well logs, we develop discriminative adversarial (DA) and linear constraint models for well-log normalization and rock-property estimation. The DA neural network model developed for well-log normalization and interpretation can perform linear and nonlinear well-log normalization while considering the joint distribution of each well log and rock properties. However, the linear constraint model uses an ensemble of predictions from linear models to constrain well-log normalization and rock-property estimation. We also develop a divergence-based type well identification method to select type (training) wells for a test well based on the statistical similarity of associated well-log distributions instead of the interwell distance. We apply the DA model to perform well-log normalization and prediction of permeability for the Seminole San Andres Unit carbonate reservoir. Compared with the permeability predicted with the classical machine learning model without well-log normalization and models with two-point scaling normalization, the DA model yields the most accurate permeability prediction by decreasing the mean-squared error of permeability prediction by 20%–50%.

Geochemistry & Geophysics↗