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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 1,063 records · Page 59

Benchmark Testing of Two Residential Refrigerators Using R-600a

Household refrigerators provide a convenient and safe means of food preservation and storage. More than 100 million refrigerators are used in US homes, resulting in significant primary energy consumption and carbon emissions. As a greenhouse gas with a 100-year global warming potential of 1,430, R-134a has been banned in new US domestic refrigerators and freezers since 2021, and R-600a with a global warming potential of 3 is widely employed as a working fluid in the current US household refrigerator market. In this paper, benchmark testing was conducted for two 2023 refrigerators using R-600a. Moreover, the effect of representative customer use patterns, such as door opening and warm food storage, was studied to evaluate the effect on the energy consumption of the refrigerators. These results will provide background knowledge for facilitating the integration of new technologies to achieve significantly reduced greenhouse gas emissions in future efficient refrigerators.

Gao, Zhiming↗

TEX-HEU: Integral Experiments with Highly Enriched Uranium and Polyethylene [Slides]

This presentation discusses Thermal/Epithermal eXperiments (TEX) in relation to integral experiments spanning a wide range of fission energy spectra utilizing existing NCSP fissile material assets, TEX-Pu for plutonium, and TEX-HEU highly enriched uranium (HEU) for highly enriched uranium. It also discusses the TEX-HEU design, the use of HEU fuel, and polyethylene parts. The experiment, executed in the Nuclear Criticality Experiment Research Center of the Nevada National Security Site is discussed, specifically how it was assembled on the Comet Universal Critical Assembly Machine. Measured quantities and various critical configurations are listed. In conclusion, the presentation states that they successfully assembled and documented the baseline TEX-HEU experiments, that six critical configurations and one reproducibility measurement were produced, and that they are compiling results to submit to the International Criticality Safety Benchmark Evaluation Project. A future experiment campaign is planned in 2021 with Hafnium as a diluent.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Electrocatalytic water oxidation performance in an extended porous organic framework with a covalent alliance of distinct Ru sites

The rational synthesis of durable, earth-abundant efficient electrocatalysts for the oxygen evolution reaction (OER) from water is one of the most important routes for storing renewable energy and minimizing fossil fuel combustion. The prime hurdles for effectively utilizing commercial RuO 2 as (OER) electrocatalysts are its very low stability, catalyst deactivation, and high cost. In this work, we explored a Ru-integrated porous organic polymer (Ru@Bpy-POP) by a facile one-pot Friedel–Crafts alkylation strategy between redox-active (Ru(demob) 3 Cl 2 ) and a carbazole unit, which is composed of unique features including an extended framework unit, isolated active sites, and tunable electrode kinetics. Ru@Bpy-POP can serve as a bridge between a Metal–Organic Framework (MOF) and POP-based catalytic systems with a balanced combination of covalent bonds (structural stability) and open metal sites (single site catalysis). Ru@Bpy-POP, deposited on a three-dimensional nickel foam electrode support, exhibits a promising electrocatalytic OER activity with an ultra-low ruthenium loading compared to a benchmark RuO 2 catalyst, providing an overpotential of about 270 mV to reach 10 mA cm –2 in an alkaline medium. Moreover, a high current density of 248 mA cm –2 was achieved for the Ru@Bpy-POP catalyst at only 1.6 V (vs. RHE), which is much higher than 91 mA cm –2 for commercial RuO 2 . The robust, albeit highly conjugated, POP framework not only triggered facile electro-kinetics but also suppressed aggregation and metallic corrosion during electrolysis. In particular, the benefits of covalent integration of distinct Ru sites into the framework can modulate intermediate adsorption and charge density, which contributes to its exceptional OER activity. All of the critical steps involved in OER are complemented by Density Functional Theory (DFT) calculations, which suggest that electrocatalytic water oxidation proceeds from a closed-shell configuration to open-shell electronic configurations with high-spin states. Finally, these open-shell configurations are more stable than their closed-shell counterparts by 1 eV, improving the overall catalytic activity.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Benchmarking kinetic calculations of resistive wall mode stability

Validating the calculations of kinetic resistive wall mode (RWM) stability is important for confidently predicting RWM stable operating regions in ITER and other high performance tokamaks for disruption avoidance. Benchmarking the calculations of the Magnetohydrodynamic Resistive Spectrum—Kinetic (MARS-K) [Y. Liu et al., Phys. Plasmas 15, 112503 (2008)], Modification to Ideal Stability by Kinetic effects (MISK) [B. Hu et al., Phys. Plasmas 12, 057301 (2005)], and Perturbed Equilibrium Nonambipolar Transport (PENT) [N. Logan et al., Phys. Plasmas 20, 122507 (2013)] codes for two Solov'ev analytical equilibria and a projected ITER equilibrium has demonstrated good agreement between the codes. The important particle frequencies, the frequency resonance energy integral in which they are used, the marginally stable eigenfunctions, perturbed Lagrangians, and fluid growth rates are all generally consistent between the codes. The most important kinetic effect at low rotation is the resonance between the mode rotation and the trapped thermal particle's precession drift, and MARS-K, MISK, and PENT show good agreement in this term. The different ways the rational surface contribution was treated historically in the codes is identified as a source of disagreement in the bounce and transit resonance terms at higher plasma rotation. Calculations from all of the codes support the present understanding that RWM stability can be increased by kinetic effects at low rotation through precession drift resonance and at high rotation by bounce and transit resonances, while intermediate rotation can remain susceptible to instability. The applicability of benchmarked kinetic stability calculations to experimental results is demonstrated by the prediction of MISK calculations of near marginal growth rates for experimental marginal stability points from the National Spherical Torus Experiment (NSTX) [M. Ono et al., Nucl. Fusion 40, 557 (2000)].

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Integrated Modeling Activities for the James Webb Space Telescope: Structural-Thermal-Optical Analysis

The James Web Space Telescope (JWST) is a large, infrared-optimized space telescope scheduled for launch in 2011. This is a continuation of a series of papers on modeling activities for JWST. The structural-thermal-optical, often referred to as STOP, analysis process is used to predict the effect of thermal distortion on optical performance. The benchmark STOP analysis for JWST assesses the effect of an observatory slew on wavefront error. Temperatures predicted using geometric and thermal math models are mapped to a structural finite element model in order to predict thermally induced deformations. Motions and deformations at optical surfaces are then input to optical models, and optical performance is predicted using either an optical ray trace or a linear optical analysis tool. In addition to baseline performance predictions, a process for performing sensitivity studies to assess modeling uncertainties is described.

Johnston, John D.↗

Summary of FY15 Results of Benchmark Modeling Activities

Sandia is participating in the third phase of and is a contributing partner to a U.S.- German “Joint Project” entitled “Comparison of current constitutive models and simulation procedures on the basis of model calculations of the thermo-mechanical behavior and healing of rock salt.” The first goal of the project is to check the ability of numerical modeling tools to correctly describe the relevant deformation phenomena in rock salt under various influences. Achieving this goal will lead to increased confidence in the results of numerical simulations related to the secure storage of radioactive wastes in rock salt, thereby enhancing the acceptance of the results. These results may ultimately be used to make various assertions regarding both the stability analysis of an underground repository in salt, during the operating phase, and the long-term integrity of the geological barrier against the release of harmful substances into the biosphere, in the post-operating phase. Among the numerical modeling tools required to address this are constitutive models that are used in computer simulations for the description of the thermal, mechanical, and hydraulic behavior of the host rock under various influences and for the long-term prediction of this behavior into the future. A second goal of the project is to investigate and demonstrate the possibilities for further potential development and improvement of these constitutive models. This report summarizes the efforts undertaken during FY15 in support of this international U.S.-German benchmark initiative.

58 GEOSCIENCES↗

Search for heavy resonances and quantum black holes in eμ, eτ, and μτ final states in proton-proton collisions at $\sqrt{s}$ = 13 TeV

A search is reported for heavy resonances and quantum black holes decaying into eμ, eτ, and μτ final states in proton-proton collision data recorded by the CMS experiment at the CERN LHC during 2016–2018 at $\sqrt{s}$ = 13 TeV, corresponding to an integrated luminosity of 138 fb -1 . The eμ, eτ, and μτ invariant mass spectra are reconstructed, and no evidence is found for physics beyond the standard model. Upper limits are set at 95% confidence level on the product of the cross section and branching fraction for lepton flavor violating signals. Three benchmark signals are studied: resonant τ sneutrino production in R parity violating supersymmetric models, heavy Z' gauge bosons with lepton flavor violating decays, and nonresonant quantum black hole production in models with extra spatial dimensions. Resonant τ sneutrinos are excluded for masses up to 4.2TeV in the eμ channel, 3.7TeV in the eτ channel, and 3.6TeV in the μτ channel. A Z' boson with lepton flavor violating couplings is excluded up to a mass of 5.0TeV in the eμ channel, up to 4.3Te V in the eτ channel, and up to 4.1TeV in the μτ channel. Quantum black holes in the benchmark model are excluded up to the threshold mass of 5.6TeV in the eμ channel, 5.2TeV in the eτ channel, and 5.0TeV in the μτ channel. In addition, model-independent limits are extracted to allow comparisons with other models for the same final states and similar event selection requirements. The results of these searches provide the most stringent limits available from collider experiments for heavy particles that undergo lepton flavor violating decays.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Search for bosons of an extended Higgs sector in b quark final states in proton-proton collisions at $\sqrt{\textrm{s}}$ = 13 TeV

A search for beyond-the-standard-model neutral Higgs bosons decaying to a pair of bottom quarks, and produced in association with at least one additional bottom quark, is performed with the CMS detector. The data were recorded in proton-proton collisions at a centre-of-mass energy of 13 TeV at the CERN LHC and correspond to an integrated luminosity of 36.7–126.9 fb −1 , depending on the probed mass range. No signal above the standard model background expectation is observed. Upper limits on the production cross section times branching fraction are set for Higgs bosons in the mass range of 125–1800 GeV. The results are interpreted in benchmark scenarios of the minimal supersymmetric standard model, as well as suitable classes of two-Higgs-doublet models.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Arbitrary-order time-accurate semi-Lagrangian spectral approximations of the Vlasov–Poisson system

The Vlasov–Poisson system, modeling the evolution of non-collisional plasmas in the electrostatic limit, is approximated by a semi-Lagrangian technique. Spectral methods of periodic type are implemented through a collocation approach. Groups of particles are represented by the Fourier Lagrangian basis and evolve, for a single timestep, along a high-order accurate representation of the local characteristic lines. The time-advancing technique is based on truncated Taylor series that can be, in principle, of any order of accuracy. A variant is obtained by coupling the phase space discretization with high-order accurate Backward Differentiation Formulas (BDF). At each timestep, particle displacements are reinterpolated and expressed in the original basis to guarantee the order of accuracy in all the variables at relatively low costs. Thus, these techniques combine the excellent features of spectral approximations with high-order time integration. The resulting method has excellent conservation properties. Indeed, it can be proven that the total number of particles, proportional to the total mass and charge, is conserved up to the machine precision. Series of numerical experiments are performed in order to assess the real performance. In particular, comparisons with standard benchmarks are examined.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Absorbing boundary conditions in material point method adopting perfectly matched layer theory

This study focuses on solving the numerical challenges of imposing absorbing boundary conditions for dynamic simulations in the material point method (MPM). To attenuate elastic waves leaving the computational domain, the current work integrates the Perfectly Matched Layer (PML) theory into the implicit MPM framework. The proposed approach introduces absorbing particles surrounding the computational domain that efficiently absorb outgoing waves and reduce reflections, allowing for accurate modeling of wave propagation and its further impact on geotechnical slope stability analysis. The study also includes several benchmark tests to validate the effectiveness of the proposed method, such as several types of impulse loading and symmetric and asymmetric base shaking. The conducted numerical tests also demonstrate the ability to handle large deformation problems, including the failure of elasto-plastic soils under gravity and dynamic excitations. The findings extend the capability of MPM in simulating continuous analysis of earthquake-induced landslides, from shaking to failure.

58 GEOSCIENCES↗

ON-OFF neuromorphic ISING machines using Fowler-Nordheim annealers

We introduce NeuroSA, a neuromorphic architecture specifically designed to ensure asymptotic convergence to the ground state of an Ising problem using a Fowler-Nordheim quantum mechanical tunneling based threshold-annealing process. The core component of NeuroSA consists of a pair of asynchronous ON-OFF neurons, which effectively map classical simulated annealing dynamics onto a network of integrate-and-fire neurons. The threshold of each ON-OFF neuron pair is adaptively adjusted by an FN annealer and the resulting spiking dynamics replicates the optimal escape mechanism and convergence of SA, particularly at low-temperatures. To validate the effectiveness of our neuromorphic Ising machine, we systematically solved benchmark combinatorial optimization problems such as MAX-CUT and Max Independent Set. Across multiple runs, NeuroSA consistently generates distribution of solutions that are concentrated around the state-of-the-art results (within 99%) or surpass the current state-of-the-art solutions for Max Independent Set benchmarks. Furthermore, NeuroSA is able to achieve these superior distributions without any graph-specific hyperparameter tuning. For practical illustration, we present results from an implementation of NeuroSA on the SpiNNaker2 platform, highlighting the feasibility of mapping our proposed architecture onto a standard neuromorphic accelerator platform.

42 ENGINEERING↗

Statistical inference of anomalous thermal transport with uncertainty quantification for interpretive 2D SOL models

The critical task of inferring anomalous cross-field transport coefficients is addressed in simulations of boundary plasmas with fluid models. A workflow for parameter inference in the UEDGE fluid code is developed using Bayesian optimization with parallelized sampling and integrated uncertainty quantification. In this workflow, transport coefficients are inferred by maximizing their posterior probability distribution, which is generally multidimensional and non-Gaussian. Uncertainty quantification is integrated throughout the optimization within the Bayesian framework that combines diagnostic uncertainties and model limitations. As a concrete example, we infer the anomalous electron thermal diffusivity $\chi_\perp$ from an interpretive 2D model describing electron heat transport in the conduction-limited region with radiative power loss. The workflow is first benchmarked against synthetic data and then tested on H-, L-, and I-mode discharges to match their midplane temperature and divertor heat flux profiles. We demonstrate that the workflow efficiently infers diffusivity and its associated uncertainty, generating 2D profiles that match 1D measurements. Future efforts will focus on incorporating more complicated fluid models and analyzing transport coefficients inferred from a large database of experimental results.

Bayesian optimization↗

Upgrade and benchmarking of a 4D treatment planning system for scanned ion beam therapy

Purpose: Upgrade and benchmarking of a research 4D treatment planning system (4DTPS) suitable for realistic patient treatment planning and treatment simulations taking into account specific requirements for scanned ion beam therapy, i.e., modeling of dose heterogeneities due to interplay effects and range changes caused by patient motion and dynamic beam delivery. Methods: The 4DTPS integrates data interfaces to 4D computed tomography (4DCT), deformable image registration and clinically used motion monitoring devices. The authors implemented a novel data model for 4D image segmentation using Boolean mask volume datasets and developed an algorithm propagating a manually contoured reference contour dataset to all 4DCT phases. They further included detailed treatment simulation and dose reconstruction functionality, based on the irregular patient motion and the temporal structure of the beam delivery. The treatment simulation functionality was validated against experimental data from irradiation of moving radiographic films in air, 3D moving ionization chambers in a water phantom, and moving cells in a biological phantom with a scanned carbon ion beam. The performance of the program was compared to results obtained with predecessor programs. Results: The measured optical density distributions of the radiographic films were reproduced by the simulations to (-2 {+-} 12)%. Compared to earlier versions of the 4DTPS, the mean agreement improved by 2%, standard deviations were reduced by 7%. The simulated dose to the moving ionization chambers in water showed an agreement with the measured dose of (-1 {+-} 4)% for the typical beam configuration. The mean deviation of the simulated from the measured biologically effective dose determined via cell survival was (617 {+-} 538) mGy relative biological effectiveness corresponding to (10 {+-} 9)%. Conclusions: The authors developed a research 4DTPS suitable for realistic treatment planning on patient data and capable of simulating dose delivery to a moving patient geometry for scanned ion beams. The accuracy and reliability of treatment simulations improved considerably with respect to earlier versions of the 4DTPS.

60 APPLIED LIFE SCIENCES↗

Inferring microbial co-occurrence networks from amplicon data: a systematic evaluation

Microbes commonly organize into communities consisting of hundreds of species involved in complex interactions with each other. 16S ribosomal RNA (16S rRNA) amplicon profiling provides snapshots that reveal the phylogenies and abundance profiles of these microbial communities. These snapshots, when collected from multiple samples, can reveal the co-occurrence of microbes, providing a glimpse into the network of associations in these communities. However, the inference of networks from 16S data involves numerous steps, each requiring specific tools and parameter choices. Moreover, the extent to which these steps affect the final network is still unclear. In this study, we perform a meticulous analysis of each step of a pipeline that can convert 16S sequencing data into a network of microbial associations. Through this process, we map how different choices of algorithms and parameters affect the co-occurrence network and identify the steps that contribute substantially to the variance. We further determine the tools and parameters that generate robust co-occurrence networks and develop consensus network algorithms based on benchmarks with mock and synthetic data sets. The Microbial Co-occurrence Network Explorer, or MiCoNE (available at https://github.com/segrelab/MiCoNE) follows these default tools and parameters and can help explore the outcome of these combinations of choices on the inferred networks. We envisage that this pipeline could be used for integrating multiple data sets and generating comparative analyses and consensus networks that can guide our understanding of microbial community assembly in different biomes.

16S rRNA↗

Evapotranspiration partitioning estimates from 8 methods from 47 NEON sites, 2019-2021

This dataset provides daily estimates of evapotranspiration (ET) and the transpiration-to-evapotranspiration ratio (T/ET) across 47 terrestrial National Ecological Observatory Network (NEON) sites spanning diverse environmental and biome conditions in the United States across three years of data (2019-2021). Daily ET is reported in both energy units (MJ m⁻² day⁻¹) and equivalent water depth (mm day⁻¹), assuming a constant latent heat of vaporization of 2.45 MJ/kg. The primary method uses a hybrid recurrent neural network–Penman–Monteith framework (RNN-PM), which integrates physically based surface energy balance constraints with data-driven learning to partition ET into transpiration and evaporation components. Model inputs include in situ meteorological observations (air temperature, vapor pressure deficit, wind speed, and radiation) combined with satellite-derived land surface temperature, leaf area index, and soil moisture. For benchmarking and uncertainty assessment, T/ET estimates from seven additional models are included: Priestley-Taylor Jet Propulsion Laboratory (PT-JPL), Penman-Monteith (P-M), Two-Source Energy Balance (TSEB), Support Vector Regression (SVR), and Categorical Boosting (CatBoost), among others—spanning empirical, machine-learning, and process-based approaches (see methods section or linked publication for detailed descriptions). Data Package Contents: The dataset a csv files containing daily ET and T/ET estimates for each site and model, along with associated metadata files these variables. Data can be accessed using common spreadsheet software (e.g., Microsoft Excel, LibreOffice) or programming environments such as R or Python. Together, these data support cross-site comparisons of ecosystem water use, evaluation of ET partitioning methods, and development of improved land–atmosphere exchange models.

EARTH SCIENCE > ATMOSPHERE↗

Development of a LOCA Experimental Benchmark for BISON - Milestone L2:FMC.P15.08

Since 2013 CASL has been planning and working towards a PWR LOCA Challenge Problem. Since BISON is the CASL fuel rod simulation platform, it plays a central role in that activity. The goal of the FY-17 CASL milestone reported here was to develop an Experimental Benchmark for LOCA analysis using BISON. Activities encompassed both code development and validation. This report provides a current snapshot of BISON’s capability for LOCA behavior including: 1) a summary of code extensions to facilitate accident analysis, 2) a series of separate effects tests, and 3) initial code validation to complex integral rod LOCA behavior. Conclusions from each of these main activities are summarized below. The key material and behavior models required to address transient high-temperature phenomena occurring during LOCAs in a standard PWR have now been implemented in BISON. These apply specifically to UO2 fuel, Zircaloy cladding and water coolant. During FY-17 important new capability to address axial UO2 fuel relocation (for 1.5D geometry) and account for oxidation energy deposition in cladding, were included. Planned future development efforts include extending the axial fuel relocation model from 1.5D to 2D/3D and improving BISON’s fission gas release model to include transient gas release associated with the high burnup structure (HBS) in high burnup fuel. Additionally, investigation of potential anisotropic creep behavior in Zircaloy cladding is planned, assuming sufficient experimental data are available to support this effort. A substantial number of separate effects validation cases (42 tests from 3 experimental series) have been completed to compare BISON predictions to measured ballooning and burst behavior for Zircaloy cladding. Such experiments include a wide variety of pressures, temperatures and loading rates. In general, BISON predictions of burst temperature, pressure and burst time are very reasonable. For one experimental series, however, involving both very high temperatures and strain rates, BISON systematically over-predicts the cladding hoop strain. Investigation of this discrepancy is an important and planned activity. With another experiment an effort was made to investigate 3D cladding response due to an azimuthal temperature variation. Results indicated 3D effects are potentially important in fuel rod analysis during LOCAs and will be further investigated in the future. BISON validation to a series of integral fuel rod experiments has also been completed. These experiments involve all fuel and cladding phenomena relevant to LOCA conditions, and can include complexities associated with irradiated fuel relative to fresh fuel. Such experiments also generally include complex thermal-hydraulic boundary conditions. Four experiments (6 rods) have been considered to date including simulated fuel (ZrO2) and both fresh and high-burnup UO2. Test rods ranged from rodlets to full length commercial PWR fuel rods. As with the separate effects experiments, BISON predictions of burst temperature, pressure and burst time are generally very reasonable. Comparisons to cladding peak strain and rod outer diameter axial profiles are less satisfactory, and identify material models and possibly modeling approximations (e.g., 2D-RZ vs 3D geometries) requiring additional investigation. Validation of BISON for integral rod LOCA behavior is by no means complete, with additional cases planned.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Algal Biomass Production via Open Pond Algae Farm Cultivation: 2019 State of Technology and Future Research

NREL’s algae state of technology benchmarking efforts focus both on front-end algal biomass production and separately on back-end conversion to fuels through NREL’s “combined algae processing” (CAP) pathway. The production model is based on outdoor long-term cultivation data, enabled by comprehensive algal biomass production trials conducted under Development of Integrated Screening, Cultivar Optimization, and Verification Research (DISCOVR) consortium efforts, driven by data furnished by Arizona State University (ASU) at the Arizona Center for Algae Technology and Innovation (AzCATI) testbed site. The CAP model is based on experimental efforts conducted under NREL R&D projects. This report focuses on front-end algal biomass production, documenting the pertinent algal biomass cultivation parameters that were input to the NREL open pond algae farm model and reports on key process sustainability indicators for the biomass production stage including annual biomass yields, facility power demand, and water consumption.

09 BIOMASS FUELS↗