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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 91 records · Page 5

Multi-year and Multi-site Establishment of the Perennial Biomass Crop Miscanthus × giganteus Using a Staggered Start Design to Elucidate N Response

Much field research on perennial bioenergy crops confounds effects of plant age with those of the growing season, which increases uncertainty and the potential for erroneous conclusions, particularly in maturing stands. Most studies rely on stands planted in a single year and measured across multiple subsequent seasons. These “single-start” designs lack statistical power to separate temporal from environment effects. We used here a staggered start experimental design to learn if increased statistical power clarified understanding of Miscanthus × giganteus nitrogen (N) needs. We conducted a staggered start experiment with three planting years and five N rates during the M. × giganteus yield-building phase at three sites across IA, USA. Third-year yields were 21.0, 25.0, and 27.1 Mg dry matter (DM) ha -1 at the northwest (NW), central, and southeast (SE) sites, respectively. Nitrogen fertilization effects changed with establishment conditions, but not with plant age. At the most N responsive site, N fertilizer changed yields at all stand ages, but not in every year. Yield increases of 150%, 36%, and 40% were observed in 1-, 2-, and 3-year-old stands, respectively, with N addition. Nitrogen effects on 1-year-old stands were positive in SE IA (2.7 kg DM kg -1 N added), negative (-2.3 kg DM kg -1 N) in NW IA, and variable in central IA (-2.2–9.6 kg DM kg -1 N), suggesting a site–year-specific response. Yield increases between the first and second years varied by > 100% depending on establishment conditions, highlighting the need for repeated planting before determining economic and agronomic crop viability.

09 BIOMASS FUELS↗

Tailored approach to study Legionella infection using a lattice light sheet microscope (LLSM)

Legionella is a genus of ubiquitous environmental pathogens found in freshwater systems, moist soil, and composted materials. More than four decades of Legionella research has provided important insights into Legionella pathogenesis. Although standard commercial microscopes have led to significant advances in understanding Legionella pathogenesis, great potential exists in the deployment of more advanced imaging techniques to provide additional insights. The lattice light sheet microscope (LLSM) is a recently developed microscope for 4D live cell imaging with high resolution and minimum photo-damage. We built a LLSM with an improved version for the optical layout with two path-stretching mirror sets and a novel reconfigurable galvanometer scanner ( RGS ) module to improve the reproducibility and reliability of the alignment and maintenance of the LLSM. We commissioned this LLSM to study Legionella pneumophila infection with a tailored workflow designed over instrumentation, experiments, and data processing methods. Our results indicate that Legionella pneumophila infection is correlated with a series of morphological signatures such as smoothness, migration pattern and polarity both statistically and dynamically. Our work demonstrates the benefits of using LLSM for studying long-term questions in bacterial infection. Our free-for-use modifications and workflow designs on the use of LLSM system contributes to the adoption and promotion of the state-of-the-art LLSM technology for both academic and commercial applications.

59 BASIC BIOLOGICAL SCIENCES↗

Optimal experimental design: Formulations and computations

Questions of ‘how best to acquire data’ are essential to modelling and prediction in the natural and social sciences, engineering applications, and beyond. Optimal experimental design (OED) formalizes these questions and creates computational methods to answer them. This article presents a systematic survey of modern OED, from its foundations in classical design theory to current research involving OED for complex models. We begin by reviewing criteria used to formulate an OED problem and thus to encode the goal of performing an experiment. We emphasize the flexibility of the Bayesian and decision-theoretic approach, which encompasses information-based criteria that are well-suited to nonlinear and non-Gaussian statistical models. We then discuss methods for estimating or bounding the values of these design criteria; this endeavour can be quite challenging due to strong nonlinearities, high parameter dimension, large per-sample costs, or settings where the model is implicit. A complementary set of computational issues involves optimization methods used to find a design; we discuss such methods in the discrete (combinatorial) setting of observation selection and in settings where an exact design can be continuously parametrized. Finally we present emerging methods for sequential OED that build non-myopic design policies, rather than explicit designs; these methods naturally adapt to the outcomes of past experiments in proposing new experiments, while seeking coordination among all experiments to be performed. Throughout, we highlight important open questions and challenges.

97 MATHEMATICS AND COMPUTING↗

Buoyancy-driven air flow within plenum-to-plenum facility down-comer channel

Reliable measurements of thermal and velocity fields were experimentally investigated under different natural circulation intensities in a dual channel facility designed and developed with a representative geometry of prismatic modular reactor core. Experiments were conducted under steady state conditions to obtain statistically stationary time series signals of temperature and velocity. Insignificant radial temperature variation was observed along the down-comer channel implying that the majority of supplied heat is removed through the upper plenum. Velocity results obtained emphasize the delicate nature of natural circulation phenomena in terms of flow destabilization, and recirculation penetration length. Observed air velocity distribution reveals that downward velocity is proportional to the extent of cooling applied to the setup. The calculated values of the dimensionless group Froude number ( Fr ) in the range of 2 to 10 indicate that air is dominated by momentum and is exiting the channel as a jet. Quantification of turbulent intensities implies that flow destabilization is noticeable along the down-comer channel particularly for the case of high cooling intensity. For 5 °C cooling water temperature, turbulent intensity ($v$ rms / $v$) peaks at the mid-channel (z/L = 0.5) reaching a value of 0.5. This value of turbulent intensity is much higher than the inlet (z/L = 0.96) and outlet (z/L = 0.04) turbulent intensities of 0.2 and 0.06 respectively. This destabilization is because of the flow reversal and heat conduction effects through stainless steel flanges connecting both channels. In conclusion, current results provide detailed velocity and temperature variation which can be useful for validating computational fluid dynamics codes.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Design of Premoderated Pulsed-Neutron Die-Away Experiments for Validating Beryllium Thermal Neutron Scattering Laws

Accurate thermal scattering laws (TSLs) are essential for reliable neutron transport simulations, particularly for systems with low-energy neutrons. Pulsed-neutron die-away (PNDA) experiments provide a highly sensitive platform for TSL validation but face challenges from fast neutron leakage and material constraints in nonhydrogenous targets such as beryllium. This work investigates the use of high-density polyethylene (HDPE) as a premoderator to reduce leakage, improve thermalization, and shorten experimental run times while preserving sensitivity to the Be TSL. Here, three premoderated configurations, encapsulation, slab, and interstitial, were evaluated using MCNP6.3® simulations with ENDF/B-VIII.0 nuclear data. The effects of the Be TSL was quantified by comparing decay constants from simulations with and without 𝑆⁡(𝛼,𝛽) treatments for both beryllium and HDPE. The results show that premoderation enables the use of as little as 5.20% of the beryllium volume required for an unreflected geometry, achieving uncertainties below 0.5% and reducing run time by up to 72.2% in the studied configurations. The interstitial configuration achieved the best balance between low statistical uncertainty and high TSL sensitivity, outperforming the slab and encapsulation designs. These findings demonstrate that carefully optimized premoderation can significantly enhance the efficiency, feasibility, and precision of PNDA experiments for Be TSL validation.

Integral Experiments↗

Understanding the fusion yield dependencies in OMEGA DT-layered implosion experiments using a physics-based statistical mapping model

Improving the performance of inertial confinement fusion implosions requires physics models that can accurately predict the response to changes in the experimental inputs. Good predictive capability has been demonstrated for the fusion yield using a statistical mapping of simulated outcomes to experimental data [Gopalaswamy et al., Nature 565(771), 581–586 (2019)]. In this paper, a physics-based statistical mapping approach is used to extract and quantify all the major sources of degradation of fusion yield for direct-drive implosions on the OMEGA laser. Here, the yield is found to be dependent on the age of the deuterium tritium fill, the ℓ = 1 asymmetry in the implosion core, the laser beam-to-target size ratio, and parameters related to the hydrodynamic stability. A controlled set of experiments were carried out where only the target fill age was varied while keeping all other parameters constant. The measurements were found to be in excellent agreement with the fill age dependency inferred using the mapping model. In addition, a new implosion design was created, guided by the statistical mapping model by optimizing the trade-offs between increased laser energy coupling at larger target size and the degradations caused by the laser beam-to-target size ratio and hydrodynamic instabilities. When experimentally performed, an increased fusion yield was demonstrated in targets with larger diameters.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Comparing different generations of idealized solar geoengineering simulations in the Geoengineering Model Intercomparison Project (GeoMIP)

Abstract. Solar geoengineering has been receiving increased attention in recent years as a potential temporary solution to offset global warming. One method of approximating global-scale solar geoengineering in climate models is via solar reduction experiments. Two generations of models in the Geoengineering Model Intercomparison Project (GeoMIP) have now simulated offsetting a quadrupling of the CO2 concentration with solar reduction. This simulation is idealized and designed to elicit large responses in the models. Here, we show that energetics, temperature, and hydrological cycle changes in this experiment are statistically indistinguishable between the two ensembles. Of the variables analyzed here, the only major differences involve highly parameterized and uncertain processes, such as cloud forcing or terrestrial net primary productivity. We conclude that despite numerous structural differences and uncertainties in models over the past two generations of models, including an increase in climate sensitivity in the latest generation of models, the models are consistent in their aggregate climate response to global solar dimming.

54 ENVIRONMENTAL SCIENCES↗

High throughput battery failure experimental platform

Addressing the need to increase the sample set to understand the causes of lithium battery thermal runaway, we conceived of an experimental platform with capability to increase the number of runaway experiments (currently 3-5 per week), while also collecting detailed electrochemical impedance spectroscopy measurements (EIS). Once expanded, the platform would enable data collection on 10s to 100s of cells that all experience runaway, thereby creating a statistical database necessary to identify early indication of risk. A primary containment unit to house cylindrical cells of variety NMC811 and of size 21700 (21 mm diameter by 70 mm length) was designed with features such as debris containment, preloaded cells in an exchangeable port, nitrogen ventilation, and exhaust containment. We performed the first overcharge abuse experiments of several 21700 cells, handpicked because of different initial EIS, and demonstrated that EIS changes dramatically during early stages of overcharge, but in a different manner than previous pouch cell experiments. The abuse experiments also revealed the discharge pattern and debris field created during runaway, as well as the cell temperature control and overheat, that must be considered in the primary containment apparatus. We designed and built a switching relay system to permit measurement of EIS without an active charging circuit, and created instrument control software for charging, EIS, and cell temperature control. The late-start funding was insufficient to fully construct the primary containment unit, but the foundational design and knowhow is available for any future work.

25 ENERGY STORAGE↗

Continuous and fast calibration of the CMS experiment: design of the automated workflows and operational experience

The exploitation of the full physics potential of the LHC experiments requires fast and efficient processing of the largest possible dataset with the most refined understanding of the detector conditions. To face this challenge, the CMS collaboration has setup an infrastructure for the continuous unattended computation of the alignment and calibration constants, allowing for a refined knowledge of the most time-critical parameters already a few hours after the data have been saved to disk. This is the prompt calibration framework which, since the beginning of the LHC Run-I, enables the analysis and the High Level Trigger of the experiment to consume the most up-to-date conditions optimizing the performance of the physics objects. In the Run-II this setup has been further expanded to include even more complex calibration algorithms requiring higher statistics to reach the needed precision. This imposed the introduction of a new paradigm in the creation of the calibration datasets for unattended workflows and opened the door to a further step in performance. The paper reviews the design of these automated calibration workflows, the operational experience in the Run-II and the monitoring infrastructure developed to ensure the reliability of the service.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Preliminary Design of Critical Experiments Involving Commercially Available B 4 C Neutron Absorber Plates with Low-Enriched UO 2 Fuel

The International Criticality Safety Benchmark Evaluation Project (ICSBEP) is an initiative to provide high-quality benchmark data in a standardized format for criticality safety analysts to use to validate calculational tools and nuclear data. In the last released 2022 version, the ICSBEP handbook contains over 5,000 critical experiment descriptions, results, and associated models. This paper describes the critical configurations proposed and calculations performed as part of the conceptual design phase of Integral Experiment Request (IER) 554 (IER-554). The goal of IER-554 is to add to the benchmark experiments available to the criticality safety community by designing critical experiments that can analyze how adding commercially available Boralcan plates to an assembly of low-enriched UO2 fuel rods affects the effective neutron multiplication factor (k eff ). Boralcan, a neutron absorber product developed by Rio Tinto, is made of B4C in an Al 1100 matrix and is commonly used for criticality suppression in fuel storage pools. In the current version of the ICSBEP handbook, only a few dated critical experiments involve B4C materials, and none involve Boralcan in a thin plate shape. The experiments designed as part of IER-554 are intended to be performed at the Sandia Pulsed Reactor Facility/Critical Experiments (SPRF/CX) apparatus at Sandia National Laboratories. SPRF/CX is a well-characterized assembly considered trustworthy by the benchmarking community because of the numerous high-quality evaluations with very low experimental uncertainties included in the ICSBEP handbook. Figure 1 illustrates the assembly for a particular configuration from LCT-078, one of the published benchmarks in the ICSBEP handbook. The experiments will be moderated and reflected by light water at ambient atmospheric pressure. Before the plates are inserted in the critical assembly, they will be characterized with x-ray computed tomography (XCT) to identify the sizes and distribution of the B 4 C powder particles inside the plates. The preliminary design calculations were performed with SCALE 6.3.0 using the KENO V.a sequence for the criticality calculations, the CE-TSUNAMI-3D sequence for the sensitivity and uncertainty studies, and the ENDF/B-VII.1 Continuous Energy cross section library. All the calculation results presented have 10 pcm statistical uncertainties. A set of critical experiments with Boralcan plates could increase the confidence of the criticality safety community in its modeling methods when using this type of neutron absorber material. Experiments would also help validate k eff calculations, and the industry could use these validations to change the B loading credit limits from the US Nuclear Regulatory Commission standard review plan for dry cask storage of spent nuclear fuel. This paper summarizes only part of the analysis documented in the preliminary design report.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Quinoa, Version 0.2

Quinoa is a set of computational tools that enables research and numerical analysis in fluid dynamics. At this time it remains a test-bed to experiment with various algorithms using fully asynchronous runtime systems. Currently, Quinoa consists of the following tools: (1) Walker, a numerical integrator for systems of stochastic differential equations in time. It is a mathematical tool to analyze and design the behavior of stochastic differential equations. It allows the estimation of arbitrary coupled statistics and probability density functions and is currently used for the design of statistical moment approximations for multiple mixing materials in variable-density turbulence. (2) Inciter, an overdecomposition-aware finite element field solver for partial differential equations using 3D unstructured grids. Inciter is used to research asynchronous mesh-based algorithms and to experiment with coupling asynchronous to bulk-synchronous parallel code. Two planned new features of Inciter, compared to the previous release (LA-CC-16-015), to be implemented in 2017, are (a) a simple Navier-Stokes solver for ideal single-material compressible gases, and (b) solution-adaptive mesh refinement (AMR), which enables dynamically concentrating compute resources to regions with interesting physics. Using the NS-AMR problem we plan to explore how to scale such high-load-imbalance simulations, representative of large production multiphysics codes, to very large problems on very large computers using an asynchronous runtime system. (3) RNGTest, a test harness to subject random number generators to stringent statistical tests enabling quantitative ranking with respect to their quality and computational cost. (4) UnitTest, a unit test harness, running hundreds of tests per second, capable of testing serial, synchronous, and asynchronous functions. (5) MeshConv, a mesh file converter that can be used to convert 3D tetrahedron meshes from and to either of the following formats: Gmsh, http://www.geuz.org/gmsh, Netgen, http://sourceforge.net/apps/mediawiki/netgen-mesher, ExodusII, http://sourceforge.net/projects/exodusii, HyperMesh, http://www.altairhyperworks.com/product/HyperMesh.

Bakosi, Jozsef↗

Correlated materials design: prospects and challenges

The design of correlated materials challenges researchers to combine the maturing, high throughput framework of DFT-based materials design with the rapidly-developing first-principles theory for correlated electron systems. We review the field of correlated materials, distinguishing two broad classes of correlation effects, static and dynamics, and describe methodologies to take them into account. We introduce a material design workflow, and illustrate it via examples in several materials classes, including superconductors, charge ordering materials and systems near an electronically driven metal to insulator transition, highlighting the interplay between theory and experiment with a view towards finding new materials. We review the statistical formulation of the errors of currently available methods to estimate formation energies. We formulate an approach for estimating a lower-bound for the probability of a new compound to form. Correlation effects have to be considered in all the material design steps. Furthermore, these include bridging between structure and property, obtaining the correct structure and predicting material stability. We introduce a post-processing strategy to take them into account.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

On the importance of phase saturation heterogeneity in the analysis of laboratory studies of hydrate dissociation

Methane hydrates (MHs) have been considered as the future source of energy because of its vast resource volume and high energy density. Energy recovery from MH-bearing sediments has attracted intensifying research activities. Fundamentally, heat transfer, fluid flow through porous media, and the kinetics of hydrate reaction are the three key processes controlling the behavior of MH dissociation and the associated fluid production. Earlier studies have suggested that heterogeneous spatial distribution of SH is inevitable in MH-bearing samples synthesized in laboratory. In this paper, we extend our study to analyze numerically the simulation results from the two realizations of the samples (homogeneous and heterogeneous) to identify differences in the fluid production and to determine if they are sufficiently different. Additionally, we conduct a sensitivity analysis and a statistical analysis on the key transport and kinetic rate parameters that could affect hydrate dissociation and fluid production in the context of a heterogeneous hydrate-bearing sample, in an effort to provide insights that could lead to improved designs for laboratory experiments and (possibly) field applications. Our results suggest that the approximation of an artificial hydrate-bearing core with heterogeneous phase saturations by an assumption of uniform phase saturation distributions results in practically similar fluid production profile except for the very early stage with maximum 20.0% deviation in the water production. From the sensitivity and statistical analysis, we determine that gas production depends strongly on the kinetic rate constant, K d 0 and the composite thermal conductivity of the hydrate-bearing sediments, λ θ ; while, water production is very sensitive to K d 0 and the absolute permeability of the sandy medium, k. Understanding the effect of phase heterogeneity and the relative importance of key parameters on the production behavior of hydrate-bearing sediments could provide basis for novel production technologies that lead to enhanced gas production and energy efficiency in the energy recovery process.

42 ENGINEERING↗

An Efficient Pipeline for Abdomen Segmentation in CT Images

Computed tomography (CT) scans usually include some disadvantages due to the nature of the imaging procedure, and these handicaps prevent accurate abdomen segmentation. Discontinuous abdomen edges, bed section of CT, patient information, closeness between the edges of the abdomen and CT, poor contrast, and a narrow histogram can be regarded as the most important handicaps that occur in abdominal CT scans. Currently, one or more handicaps can arise and prevent technicians obtaining abdomen images through simple segmentation techniques. In other words, CT scans can include the bed section of CT, a patient’s diagnostic information, low-quality abdomen edges, low-level contrast, and narrow histogram, all in one scan. These phenomena constitute a challenge, and an efficient pipeline that is unaffected by handicaps is required. In addition, analysis such as segmentation, feature selection, and classification has meaning for a real-time diagnosis system in cases where the abdomen section is directly used with a specific size. A statistical pipeline is designed in this study that is unaffected by the handicaps mentioned above. Intensity-based approaches, morphological processes, and histogram-based procedures are utilized to design an efficient structure. Performance evaluation is realized in experiments on 58 CT images (16 training, 16 test, and 26 validation) that include the abdomen and one or more disadvantage(s). The first part of the data (16 training images) is used to detect the pipeline’s optimum parameters, while the second and third parts are utilized to evaluate and to confirm the segmentation performance. The segmentation results are presented as the means of six performance metrics. Thus, the proposed method achieves remarkable average rates for training/test/validation of 98.95/99.36/99.57% (jaccard), 99.47/99.67/99.79% (dice), 100/99.91/99.91% (sensitivity), 98.47/99.23/99.85% (specificity), 99.38/99.63/99.87% (classification accuracy), and 98.98/99.45/99.66% (precision). In summary, a statistical pipeline performing the task of abdomen segmentation is achieved that is not affected by the disadvantages, and the most detailed abdomen segmentation study is performed for the use before organ and tumor segmentation, feature extraction, and classification.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Formal Experimentation and Analysis of Handheld RFID Readers as a Tool for Nuclear Material Accounting

Commercial, off-the-shelf Radio Frequency Identification (RFID) systems have been successfully deployed for inventory tracking in numerous industries, but their viability in the tracking of complex environments containing nuclear material is less understood. Of primary interest in this setting is a RFID tracking system for nuclear material accounting which can reliably identify as many tags as possible with high accuracy, while also reducing an operator’s exposure to radiation. In this work, we develop a formal statistical approach to identify relevant handheld RFID reader settings which optimize tagging performance. To achieve this goal, we design a full factorial split-plot experiment for a static shelf configuration scene with 50 randomly placed nuclear material containers affixed with RFID tags. We use Bayesian inference to fit a second-order response surface model which expresses the probability of a successful match for each container as a function of the experimental factors. Such effects are allowed to vary across individual containers and the containers’ population in its entirety to estimate overall effects. Uncertainties of estimates and predictions are quantified via their corresponding posterior distributions. Following extensive model checking and validation, the fitted model is used to identify experimental factors which maximize matching probabilities at both the container-level and for the full shelf configuration scene. We also analyze sensitivity of performance to relevant factors.

25 ENERGY STORAGE↗

Making inertial confinement fusion models more predictive

Computer models of inertial confinement fusion (ICF) implosions play an essential role in experimental design and interpretation as well as our understanding of fundamental physics under the most extreme conditions that can be reached in the laboratory. Building truly predictive models is a significant challenge, with the potential to greatly accelerate progress to high yield and ignition. One path to more predictive models is to use experimental data to update the underlying physics in a way that can be extrapolated to new experiments and regimes. We describe a statistical framework for the calibration of ICF simulations using data collected at the National Ignition Facility (NIF). We perform Bayesian inferences for a series of laser shots using an approach that is designed to respect the physics simulation as much as possible and then build a second model that links the individual-shot inferences together. We show that this approach is able to match multiple X-ray and neutron diagnostics for a whole series of NIF “BigFoot” shots. Within the context of 2D radiation hydrodynamic simulations, our inference strongly favors a significant reduction in fuel compression over other known degradation mechanisms (namely, hohlraum issues and engineering perturbations). This analysis is expanded using a multifidelity technique to pick fuel-ablator mix from several candidate causes of the degraded fuel compression (including X-ray preheat and shock timing errors). Finally, we use our globally calibrated model to investigate the extra laser drive energy that would be required to overcome the inferred fuel compression issues in NIF BigFoot implosions.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗