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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 793 records · Page 44
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Practical considerations for amino acid isotope analysis

Over the last few decades, isotopic analysis of amino acids at the compound- and position-specific levels has been rapidly advancing across diverse fields. As these techniques progress, evaluation of isotopic fractionation associated with sample workup is essential. This critical review of analytical methods through the lens of isotope geochemistry provides a benchmark for researchers across disciplines seeking to make compound- and position-specific amino acid isotope measurements. We focus on preparation, acid hydrolysis, clean-up, derivatization, separation, and C, H, N, and S isotope measurement. Despite substantial customizability across these steps, the following general recommendations should maximize recovery while minimizing isotopic fractionation. Samples should be freeze-dried and stored anoxically at ≤ –20 °C prior to conventional acid hydrolysis (6N HCl, 110 °C, 20–24 h, anoxic), which suffices for many residues. Both gas and liquid chromatographic (GC and LC, respectively) techniques are well-established and separate about 15 amino acids; LC bypasses the need for derivatization, while GC provides higher sensitivity. Furthermore, when derivatization is needed, n-acetyl and alkoxycarbonyl esters provide the most reproducible C isotope ratios. For compound-specific analyses, online GC–IRMS and LC–IRMS systems offer the easiest workflow, but EA–IRMS enables potential multi-element isotope analysis. Emerging techniques like high-resolution mass spectrometry are also promising for multi-element analysis and recover position-specific isotopic information. Looking forward to the next decade of innovation, isotope geochemists and ecologists can improve amino acid isotope analysis by focusing on streamlining multi-element analysis and standardizing calibration practices across laboratories.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Comparison of Radiation Models for a Turbulent Piloted Methane/Air Jet Flame: A Frozen-Field Study

Numerical modeling of radiative transfer in nongray reacting media is a challenging problem in computational science and engineering. The choice of radiation models is important for accurate and efficient high-fidelity combustion simulations. Different applications usually involve different degrees of complexity, so there is yet no consensus in the community. In this paper, the performance of different radiative transfer equation (RTE) solvers and spectral models for a turbulent piloted methane/air jet flame are studied. The flame is scaled from the Sandia Flame D with a Reynolds number of 22,400. Three classes of RTE solvers, namely the discrete ordinates method, spherical harmonics method, and Monte Carlo method, are examined. The spectral models include the Planck-mean model, the full-spectrum k-distribution (FSK) method, and the line-by-line (LBL) calculation. The performances of different radiation models in terms of accuracy and computational cost are benchmarked. The results have shown that both RTE solvers and spectral models are critical in the prediction of radiative heat source terms for this jet flame. The trade-offs between the accuracy, the computational cost, and the implementation difficulty are discussed in detail. The results can be used as a reference for radiation model selection in combustor simulations.

David, Chloe↗
DOE OSTI2012

Estimating the Maximum Potential Revenue for Grid Connected Electricity Storage: Arbitrage and Regulation

The valuation of an electricity storage device is based on the expected future cash flow generated by the device. Two potential sources of income for an electricity storage system are energy arbitrage and participation in the frequency regulation market. Energy arbitrage refers to purchasing (storing) energy when electricity prices are low, and selling (discharging) energy when electricity prices are high. Frequency regulation is an ancillary service geared towards maintaining system frequency, and is typically procured by the independent system operator in some type of market. This paper outlines the calculations required to estimate the maximum potential revenue from participating in these two activities. First, a mathematical model is presented for the state of charge as a function of the storage device parameters and the quantities of electricity purchased/sold as well as the quantities offered into the regulation market. Using this mathematical model, we present a linear programming optimization approach to calculating the maximum potential revenue from an electricity storage device. The calculation of the maximum potential revenue is critical in developing an upper bound on the value of storage, as a benchmark for evaluating potential trading strategies, and a tool for capital finance risk assessment. Then, we use historical California Independent System Operator (CAISO) data from 2010-2011 to evaluate the maximum potential revenue from the Tehachapi wind energy storage project, an American Recovery and Reinvestment Act of 2009 (ARRA) energy storage demonstration project. We investigate the maximum potential revenue from two different scenarios: arbitrage only and arbitrage combined with the regulation market. Our analysis shows that participation in the regulation market produces four times the revenue compared to arbitrage in the CAISO market using 2010 and 2011 data. Then we evaluate several trading strategies to illustrate how they compare to the maximum potential revenue benchmark. We conclude with a sensitivity analysis with respect to key parameters.

electricity storage↗
DOE OSTI2016

Final Report on DTRA Basic Research Project #BRCALL08-Per3-C-2-0006 "High-Z Non-Equilibrium Physics and Bright X-ray Sources with New Laser Targets"

This project had two major goals. Final Goal: obtain spectrally resolved, absolutely calibrated x-ray emission data from uniquely uniform mm-scale near-critical-density high-Z plasmas not in local thermodynamic equilibrium (LTE) to benchmark modern detailed atomic physics models. Scientific significance: advance understanding of non-LTE atomic physics. Intermediate Goal: develop new nano-fabrication techniques to make suitable laser targets that form the required highly uniform non-LTE plasmas when illuminated by high-intensity laser light. Scientific significance: advance understanding of nano-science. The new knowledge will allow us to make x-ray sources that are bright at the photon energies of most interest for testing radiation hardening technologies, the spectral energy range where current x-ray sources are weak. All project goals were met.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2014

Three Analytic Benchmarks in COG

Analytic benchmarks are valuable tools to test the algorithms in Monte Carlo codes not related to geometry or interaction data. COG was used to calculate three analytic benchmarks: Kobayashi’s benchmarks for simple geometries and void regions; Shmakov’s benchmarks using the back and-forth approximation; and Thomas et al’s critical problem for an infinite cylinder.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2013

High-Z Non-­Equilibrium Physics and Bright X-­ray Sources with New Laser Targets (Annual Report FY 2013)

This project has two major goals, as follows, Final Goal: obtain spectrally resolved, absolutely calibrated x-ray emission data from uniquely uniform mm-scale near-critical-density high-Z plasmas not in local thermodynamic equilibrium (LTE) to benchmark modern detailed atomic physics models. Scientific significance: advance understanding of non-LTE atomic physics. Intermediate Goal: develop new nano-fabrication techniques to make suitable laser targets that form the required highly uniform non-LTE plasmas when illuminated by high-intensity laser light. Scientific significance: advance understanding of nano-science. Relation to DTRA C-WMD mission: The new knowledge will allow us to make x-ray sources that are bright at the photon energies of most interest for testing radiation hardening technologies, the spectral energy range where current x-ray sources are weak.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Integral Experiment Final Design for Thermal/Epithermal eXperiments with 233U3O8 ZPR Fuel Elements and Polyethylene (IER-329 CED-2 Report)

This report documents the integral experiment final design for IER-329, Thermal/Epithermal eXperiments (TEX) with 233 U 3 O 8 Zero Power Reactor (ZPR) Fuel Elements and Polyethylene. IER-329 (TEX-23) is the third baseline design in the Thermal/Epithermal eXperiments (TEX) series led by Lawrence Livermore National Laboratory (LLNL) and funded by the DOE’s Nuclear Criticality Safety Program. This experiment was designed to address the existing 233U integral benchmark experiments over prediction in k eff by up to 2% for thermal systems and under-prediction in k eff by up to 4% for intermediate systems. The TEX-23 design utilizes assemblies of 233 U 3 O 8 Zero Power Reactor (ZPR) fuel elements moderated and reflected by high-density polyethylene. This design is similar to the existing TEX-Pu and TEX-HEU designs, utilizing an adjustable moderator to tune the neutron energy spectra and modular layers for the incorporation of diluent materials.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Surrogate modeling of the leaching process in a rare earth elements recovery plant

The data are summarized in the slides for a poster as presented at the 2024 AIChE annual meeting in San Diego, California, USA. The slides summarize our work on the PrOMMiS project over the past year. The slides describe the systematic design and optimization of a flowsheet for the recovery of critical minerals and rare earth elements. Then, it summarizes the results of our benchmarking of surrogate modeling methodologies for the optimization of these flowsheets.

Fardis, Dimitrios↗
DOE OSTI2026

Participation in and Assessment of the Third DNCSH Public Workshop

Advanced reactor development and deployment is introducing fuel forms, materials, and configurations that differ from those used in traditional light-water reactors (LWRs), including tristructural-isotropic (TRISO)-based fuels, moderators, high-temperature materials, and compact core designs. These attributes can fall outside the range of applicability of existing criticality safety validation bases and may require additional work in code validation and benchmark applicability.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2013

Toward textbook multigrid efficiency for fully implicit resistive magnetohydrodynamics

Multigrid methods can solve some classes of elliptic and parabolic equations to accuracy below the truncation error with a work-cost equivalent to a few residual calculations – so-called “textbook” multigrid efficiency. We investigate methods to solve the system of equations that arise in time dependent magnetohydrodynamics (MHD) simulations with textbook multigrid efficiency. We apply multigrid techniques such as geometric interpolation, full approximate storage, Gauss-Seidel smoothers, and defect correction for fully implicit, nonlinear, second-order finite volume discretizations of MHD. We apply these methods to a standard resistive MHD benchmark problem, the GEM reconnection problem, and add a strong magnetic guide field, which is a critical characteristic of magnetically confined fusion plasmas. We show that our multigrid methods can achieve near textbook efficiency on fully implicit resistive MHD simulations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2015

Accumulation of gadolinium isotopes in used nuclear fuel - 14374

For the criticality safety control of damaged nuclear fuel, i.e., fuel debris, accounting for burnup credit (BUC) may become important if higher initial-uranium-enrichment fuel almost 5 wt% loaded into the reactor. In this case, if the presence of fission products (FP) could be confirmed, the negative reactivity effect of FP allows us to treat a substantially greater quantity of fuel debris in one removal and storage operation. In the technical development of the criticality safety control for fuel debris from the Fukushima accident in Japan, adopting BUC assuming the presence of the FP is being considered because the fuel used in the Fukushima Daiichi Nuclear Power Plant had a higher initial {sup 235}U enrichment, i.e., almost 5 wt%, than the fuel used at TMI-2. The Expert Group on Burnup Credit Criticality Safety (EGBUC) under the Working Party on Nuclear Criticality Safety (WPNCS) in the OECD/NEA Nuclear Science Committee carried out international burnup calculation benchmarks 'Phase-IIIB' and 'Phase-IIIC' for BWR fuel assemblies. In these benchmarks, the differences in the {sup 155}Gd calculation results of the participants generated keen interest because these differences were rather large. As the coordinators of the Phase-IIIC benchmark, the authors have conducted additional analyses on the accumulation of the gadolinium isotopes in used nuclear fuel during burnup. Without cooling time, the assembly-averaged amount of {sup 155}Gd against the burnup value depends on the burnout property of gadolinium in burnable poison rods. This is because the amount of gadolinium isotopes accumulated owing to the fission reaction is less than the residual gadolinium in the burnable poison rods. After the burnout of gadolinium isotopes in the burnable poison rods, the amount of {sup 155}Gd isotopes remains almost constant, which is defined by the balance between depletion due to the neutron capture reaction and generation due to beta-decay of {sup 155}Eu generated by the fission reaction. However, after a few years of cooling, the amount of {sup 155}Gd drastically increases owing to {sup 155}Eu decay. This effect is important for higher burnup fuel. In this case, the amount of gadolinium isotopes in the burnable poison rods is of less importance. This means that for better prediction of {sup 155}Gd, the adopted parameters and data pertaining to {sup 155}Eu generation have significantly greater importance than the burnup treatment of the burnable poison rods. The release behavior of europium as well as gadolinium during the severe accident should be examined. This paper provides basic information for considering {sup 155}Gd in the criticality safety evaluation of fuel debris. (authors)

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
NASA NTRS1995

Critical radiation fluxes and luminosities of black holes and relativistic stars

The critial luminosity at which the outward force of radiation balances the inward force of gravity plays an important role in many astrophysical systems. We present expressions for the radiation force on particles with arbitrary cross sections and analyze the radiation field produced by radiating matter, such as a disk, ring, boundary layer, or stellar surface, that rotates slowly around a slowly rotating gravitating mass. We then use these results to investigate the critical radiation flux and, where possible, the critical luminosity of such a system in genral relativity. We demonstrate that if the radiation source is axisymmetric and emission is back-front symmetric with repect to the local direction of motion of the radiating matter, as seen in the comoving frame, then the radial component of the radiation flux and the diagonal components of the radiation stress-energy tensor outside the source are the same, to first order in the rotation rates, as they would be if the radiation source and gravitating mass were not rotating. We argue that the critical radiation flux for matter at rest in the locally nonrotating frame is often satisfactory as an astrophysical benchmark flux and show that if this benchmark is adopted, many of the complications potentially introduced by rotation of the radiation source and the gravitating mass are avoided. We show that if the radiation field in the absence of rotation would be spherically symmetric and the opacity is independent of frequency and direction, one can define a critical luminosity for the system that is independent of frequency and direction, one can define a critical luminosity for the system that is independent of the spectrum and angular size of the radiation source and is unaffected by rotation of the source and mass and orbital motion of the matter, to first order. Finally, we analyze the conditions under which the maximum possible luminosity of a star or black hole powered by steady spherically symmetric radial accretion is the same in general relativity as in the Newtonian limit.

Lamb, Frederick K.↗
DOE OSTI2026

New framework for benchmarking decadal predictions leveraging the PCMDI Metric Package with interactive visualization

Reliable climate predictions across multiple timescales are increasingly critical as climate-related risks continue to rise. With the growing number and diversity of climate prediction systems, systematic intercomparison has become essential. Here, we present a comprehensive evaluation framework based on the PCMDI Metric Package to assess the performance of multiple decadal climate prediction systems. Unlike uninitialized simulations, initialized predictions exhibit bias and predictive skill that evolve with forecast lead time. To address this, we introduce (1) model-by-lead-time portrait plots, which efficiently summarize metrics of global temperature, precipitation, and Arctic/Antarctic sea-ice extent, and (2) an HTML-based interactive visualization platform that provides detailed regional and seasonal diagnostics of model bias, skill scores, and ensemble spread for each model and lead time. Comparisons with uninitialized simulations further quantify the relative impacts of initialization and external forcing on prediction skill. The proposed framework provides a scalable and transparent approach for multi-model climate prediction assessments and can be readily extended to a wide range of operational and research forecasting systems.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Nuclear Data Adjustment with Whisper for Criticality Safety Applications [Slides]

Nuclear data adjustment is used by Whisper to compute residual nuclear data uncertainties within a full suite of benchmarks; in order to do so, a complete set of nuclear data covariances, benchmarks and k-effective sensitivity profiles (for both benchmarks and applications) is required. For applications that are similar to the full benchmark suite, the residual uncertainties add a small margin to the overall USL calculation. For applications that are dissimilar to the full benchmark suite, the residual uncertainties add a reasonable margin to the overall USL calculation (more conservative). This methodology helps to overcome any issues in the released covariance libraries where nuclear data uncertainties appear to be too large.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2016

Prompt Neutron Decay Constants in a Highly Enriched Uranium-Lead Copper Reflected System

Rossi-{alpha} measurements were performed on highly enriched uranium (HEU)-lead copper reflected systems to determine the prompt neutron decay constants. These constants represent an eigenvalue characteristic of these particular critical configurations, which can be experimentally measured by the Rossi-a or pulse neutron source techniques and calculated by a deterministic or Monte Carlo method. In the measurements presented in this summary, highly enriched uranium interleaved with lead plates and reflected with copper were assembled to a high multiplication and the prompt neutron decay constants were determined by the Rossi-{alpha} technique. This research intended to benchmark the lead neutron cross sections; it was a collaboration between the Japanese Atomic Energy Agency (JAEA) Fast Critical Assembly Facility (FCA) in Tokai, Japan and the Los Alamos National Laboratory (LANL) in the U.S. (authors)

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2021

Whisper Use of Nuclear Data Covariances [Slides]

Whisper is statistical analysis code using sensitivity/uncertainty-based methods to determine baseline upper subcritical limit (USL) for nuclear criticality safety. Features of Whisper 1.1 include: GLLS method implemented to compute adjusted covariance based on current benchmark suite (1,100+ ICSBEP models), BLO “low-fidelity” covariance data used (44 energy groups), adjusted covariance is pre-computed and saved, and adjusted cross sections are NOT computed. Potential future efforts include: an extension to include angular distributions in benchmark selection and in GLLS adjustment, a move toward more modern covariance data (ENDF/B-VIII.0) and different group structure, and compute and store adjusted cross sections (trivial).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

IRDFF-II: A New Neutron Metrology Library

High quality nuclear data is the most fundamental underpinning for all neutron metrology applications. This paper describes the release of version II of the International Reactor Dosimetry and Fusion File (IRDFF-II) that contains a consistent set of nuclear data for fission and fusion neutron metrology applications up to 60 MeV neutron energy. The library is intended to support: a) applications in research reactors; b) safety and regulatory applications in the nuclear power generation in commercial fission reactors; and c) material damage studies in support of the research and development of advanced fusion concepts. The paper describes the contents of the library, documents the thorough verification process used in its preparation, and provides an extensive set of validation data gathered from a wide range of neutron benchmark fields. The new IRDFF-II library includes 119 metrology reactions, four cover material reactions to support self-shielding corrections, five metrology metrics used by the dosimetry community, and cumulative fission products yields for seven fission products in three different neutron energy regions. In support of characterizing the measurement of the residual nuclei from the dosimetry reactions and the fission product decay modes, the present document lists the recommended decay data, particle emission energies and probabilities for 68 activation products. It also includes neutron spectral characterization data for 29 neutron benchmark fields for the validation of the library contents. Additional six reference fields were assessed (four from plutonium critical assemblies, two measured fields for thermal-neutron induced fission on 233U and 239Pu targets) but not used for validation due to systematic discrepancies in C/E reaction rate values or lack of reaction-rate experimental data. Another ten analytical functions are included that can be useful for calculating average cross sections, average energy, thermal spectrum average cross sections and resonance integrals. The IRDFF-II library and comprehensive documentation is available online at www-nds.iaea.org/IRDFF/. Evaluated cross sections can be compared with experimental data and other evaluations at www-nds.iaea.org/exfor/endf.htm. The new library is expected to become the international reference in neutron metrology for multiple applications.

IAEA IRDFF↗
DOE OSTI2012

CLOMP_TM

The CLOMP_TM benchmark was developed to measure the overheads of various mechanisms used to guarantee the generation of correct results in threaded code even when multiple threads might be accessing and/or updating the same memory location at the same time. This includes widely supported mechanisms like OpenMP Atomic and Open MP Critical as well as new mechanisms like Transactional Memory (TM) and Speculative Execution (SE) of threads. The CLOMP_TM benchmark is highly configurable to allow a variety of problem sizes, atomic update region sizes, and potential race condition opportunities to be studied. A wide variety of checks are done on the results to verify the expected answer was actually generated. Thus CLOMP_TM can be used both to measure the overhead for various mechanisms and to check the correctness of their implementation.

Gyllenhaal, J.↗