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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 109 records · Page 6

Partnership Center for High-fidelity Boundary Plasma Simulation

The University of Colorado Boulder contributed to the DOE Partnership Center for High‑fidelity Boundary Plasma Simulation (award DE‑SC0018271) by advancing gyrokinetic modeling of core–edge plasma interactions in tokamaks. Using the GEM and XGC codes, the project investigated turbulence spreading from the plasma edge to the core, finding that while edge‑driven trapped electron mode turbulence enhances core ion heat flux in DIII‑D L‑mode plasmas, it does not fully explain experimentally observed transport shortfalls, indicating a need for flux‑driven models. The team also demonstrated that edge micro‑instabilities are highly sensitive to small variations in magnetic equilibrium, particularly near the pedestal and edge, highlighting the importance of accurately characterizing equilibrium uncertainties. Significant progress was made in spatially coupling the core GEM and edge XGC simulations, with successful validation against standalone XGC results in realistic tokamak geometries, laying the groundwork for future extensions to kinetic electrons and electromagnetic effects.

42 ENGINEERING↗

The influence of recent and future climate change on spring Arctic cyclones

In recent decades, the Arctic has experienced rapid atmospheric warming and sea ice loss, with an ice-free Arctic projected by the end of this century. Cyclones are synoptic weather events that transport heat and moisture into the Arctic, and have complex impacts on sea ice, and the local and global climate. However, the effect of a changing climate on Arctic cyclone behavior remains poorly understood. This study uses high resolution (4 km), regional modeling techniques and downscaled global climate reconstructions and projections to examine how recent and future climatic changes alter cyclone behavior. Results suggest that recent climate change has not yet had an appreciable effect on Arctic cyclone characteristics. However, future sea ice loss and increasing surface temperatures drive large increases in the near-surface temperature gradient, sensible and latent heat fluxes, and convection during cyclones. The future climate can alter cyclone trajectories and increase and prolong intensity with greatly augmented wind speeds, temperatures, and precipitation. Such changes in cyclone characteristics could exacerbate sea ice loss and Arctic warming through positive feedbacks. The increasing extreme nature of these weather events has implications for local ecosystems, communities, and socio-economic activities.

54 ENVIRONMENTAL SCIENCES↗

Milestone 2.8: Preliminary Radiolytic Gas Generation Measurements from Helium-Backfilled Samples

The Department of Energy (DOE) is currently managing nearly 13 metric tons of aluminum-clad spent nuclear fuel (ASNF) with the intention of extended (> 50 years) dry storage in helium-backfilled canisters. Due to in-reactor and cooling pond conditions, oxyhydroxide corrosion layers have formed on the surface of the ASNF elements. These corrosion layers are susceptible to radiolysis and the formation of molecular hydrogen gas (H 2 ) due to the fuel’s inherent radiation field. Consequently, a rigorous evaluation of the effect of helium gas on radiolytic H 2 production is necessary to support the Technical Considerations and Challenges for Extended (> 50 yrs) Dry Storage of ASNF program, especially as previous Task 2 - Oxyhydroxide Layer Radiolytic Gas Generation Resolution work demonstrated a significant effect of gas composition on the radiolytic yield (G-value) of H 2 . Here we report preliminary G-values for the radiolytic formation of H 2 from the gamma irradiation of pre-corroded aluminum alloy 1100 coupons flame sealed in helium environments. Irradiations yielded G(H 2 ) values of (5.1 ± 0.5) x 10 –4 and (9.4 ± 0.9) x 10 –4 µmol J –1 for pristine coupons, and (10.1 ± 0.4) x 10 –4 and (15.1 ± 1.2) x 10 –4 µmol J –1 for pre-corroded coupons for 0% and 50% relative humidity, respectively. These helium environment G(H 2 ) values are between 28% and 58% higher than previously reported values for argon environments. This enhancement is attributed to the significant difference in first ionization energy between helium (24.59 eV) and argon (15.76) facilitating additional processes, e.g., Penning ionization. These new preliminary helium environment G(H 2 ) values will be employed by Task 3 - Sealed and Vented System Episodic Breathing and Gas Generation Prediction to model the effect of radiolytic H 2 accumulation in helium environments to evaluate the practicality of the extended storage standard canister design.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Comparing Global Spray Combustion Characteristics and Local Shot-to-Shot Variations in a Reacting n -Heptane Spray

In support of efforts to develop improved models of turbulent spray behavior and combustion in diesel engines, experimental data and analysis must be obtained for guidance and validation. For Reynolds-averaged Navier–Stokes (RANS)-based Computational fluid dynamics (CFD) modeling approaches, representative ensemble average experimental results are important. For high-fidelity models such as large eddy simulations (LES)-based CFD, precise individual experimental results are desirable. However, making comparisons between a given experiment and LES is a challenge since local parameters cannot be directly compared. In this work, an optically accessible constant pressure flow rig (CPFR) is utilized to acquire diesel-like fuel injection and reaction behavior simultaneously with three optical diagnostic techniques: rainbow Schlieren deflectometry (RSD), OH* chemiluminescence (OH*), and two-color pyrometry (2CP). The CPFR allows a large number of repeated injection experiments to be performed for statistical analysis and convergence using ensemble-averaging techniques, while maintaining highly repeatable test conditions. Even for stable test conditions, variations in local turbulent fuel–air mixing introduce variability, which manifests as significant differences in OH* and 2CP results. Experimental measurements of characteristic parameters including liquid and vapor jet penetration, liftoff length, soot temperature and concentration, and turbulent flame speed, along with the shot-to-shot variability of each dataset, are presented and discussed. Finally, a statistical method is utilized to analyze the extent of this variability, and to identify superlative injections within the dataset for discussion and analysis of shot-to-shot variations.

42 ENGINEERING↗

Blind photovoltaic modeling intercomparison: A multidimensional data analysis and lessons learned

The Photovoltaic (PV) Performance Modeling Collaborative (PVPMC) organized a blind PV performance modeling intercomparison to allow PV modelers to blindly test their models and modeling ability against real system data. Measured weather and irradiance data were provided along with detailed descriptions of PV systems from two locations (Albuquerque, New Mexico, USA, and Roskilde, Denmark). Participants were asked to simulate the plane-of-array irradiance, module temperature, and DC power output from six systems and submit their results to Sandia for processing. The results showed overall median mean bias (i.e., the average error per participant) of 0.6% in annual irradiation and –3.3% in annual energy yield. While most PV performance modeling results seem to exhibit higher precision and accuracy as compared to an earlier blind PV modeling study in 2010, human errors, modeling skills, and derates were found to still cause significant errors in the estimates.

14 SOLAR ENERGY↗

Thermophysical Properties of Mixtures of Thorium and Uranium Nitride

Abstract The miscibility, lattice parameter, and thermophysical properties of (Th 0.2 U 0.8 )N and (Th 0.5 U 0.5 )N have been investigated. It is shown that additions of thorium nitride (ThN) to uranium nitride (UN) increases the thermophysical performance of the mixed nitride fuel form in comparison to reference UN. In the more dilute limit, additions of ThN serve as a burnable neutronic poison and reduces the change in k eff over the lifecycle of the fuel. At higher concentrations, additions of ThN serve as a significant fertile source of 233 U. Where appropriate, comparisons to previous work on UN + PuN mixtures are made, as this is a comparable fuel form for potential fast reactor concepts, and a suitable point of contrast in the possible design space afforded by mixed (Th x U 1 − x )N fuel forms. The data from this work are the input parameters for finite element modeling of the temperature distribution in a compact reactor. The results of modeling and simulation of this core design are shown for the case of steady-state operation and during double, adjacent heat pipe failure.

Parker, S. S. (ORCID:000000018597440X)↗

CISME report on experiments with HMX powder, PBX 9501 prills, and heated PBX 9501

The ability to predict post-ignition explosive response is relevant to explosives safety, particularly weapons assembly/disassembly operations that must operate under a sufficiently conservative safety basis to meet risk mitigation criteria for inadvertent nuclear detonation (IND). In particular, hazard determinations hinge on whether the PBX 9501 main charge can ultimately attain detonation from an initial, non-shock, ignition stimulus. The CISME experiment uses a spherical explosive charge, which is thermally ignited in the center using a fiber-delivered infrared laser pulse. This ignition mechanism - i.e. a localized thermal hotspot - is representative of the ignition-causing insults typical in accident scenarios, including low-velocity impact, drop, skid, and punch events. In fiscal year 2018 CISME experiments were conducted with pristine PBX 9501 spheres, confined and unconfined. Sub-detonative, low-violence reactions were observed. Here we report experiments conducted since 2018. The explosive charge was varied: experiments were conducted with room temperature pour-density HMX powder and prills of PBX 9501, and heated, thermally damaged PBX 9501. Experiments were conducted in a confined configuration, with two 4 mm-thick stainless-steel hemispherical shells bolted around the sphere. Detonation, via DDT (deflagration-to-detonation transition) was observed in the 3-inch diameter powdered HMX and the 6-inch diameter heated and thermally-damaged PBX 9501 tests. No transition to DDT was observed in smaller diameters for those configurations, and no DDT was observed for pour-density prills of PBX 9501 of any diameter. The original test series demonstrated that the response of pristine, undamaged PBX 9501 to a central ignition is relatively benign. This new test series shows that increased porosity, lack of polymer binders and thermal damage can greatly increase the violence of the post-ignition response, up to and including detonation. These results bridge the explosive response of PBX 9501 from sub-detonative through detonation as a function of diameter and provide valuable test cases for modeling efforts that strive to capture the DDT threshold. By exploring explosive response in a more representative 3D geometry, we can also benchmark these new results to more plentiful DDT datasets generated from testing in 1D tube confinement (the historical test configuration)–the configuration upon which almost all DDT models were developed.

42 ENGINEERING↗

Hawai'i Pathways to Decarbonization: Act 238, Session Laws of Hawai'i 2022

Act 238 mandated the Hawaii State Energy Office (HSEO) generate a report analyzing the pathways to achieve state and economy-wide 50% emissions reductions from 2005 levels by 2030 and net zero emissions by 2045. NREL supported HSEO in analyzing the electric sector impacts of these decarbonization pathways by performing a capacity expansion modeling analysis for the Oahu, Hawai'i island, Kaua'i, Maui, Moloka'i, and Lana'i island electric grids. NREL used the Engage capacity expansion modeling tool and PRAS resource adequacy tool to perform these analysis.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Nature of transonic sub-Alfvénic turbulence and density fluctuations in the near-Sun solar wind

Context. Recent Parker Solar Probe (PSP) measurements have revealed that solar wind (SW) turbulence transits from a subsonic to a transonic regime near the Sun, while remaining sub-Alfvénic. These observations call for a revision of the existing SW models, where turbulence is considered to be both subsonic and sub-Alfvénic. Aims. In this work, we introduce a new magnetohydrodynamic (MHD) model of transonic sub-Alfvénic turbulence (TsAT). Methods. We used 3D MHD simulations initialized with parameters measured by PSP to investigate the properties of the new near-Sun SW transonic turbulent regime. We then derived a reduced set of MHD equations in the transonic sub-Alfvénic limit to interpret our numerical results. Results. Our TsAT model shows that turbulence is effectively nearly incompressible (NI) and has a 2D + slab (quasi-2D) geometry not only in the subsonic limit, but also in the transonic regime, as long as it remains sub-Alfvénic, a condition essentially enforced everywhere in the heliosphere by the strong local magnetic field. These predictions are consistent with 3D MHD simulations, showing that transonic turbulence is dominated by low-frequency quasi-2D incompressible structures, while compressible fluctuations are a minor component corresponding to low-frequency slow modes and high-frequency fast modes. Conclusions. Our new TsAT model extends existing NI theories of turbulence, and is potentially relevant for the theoretical and numerical modeling of space and astrophysical plasmas, including the near-Sun SW, the solar corona, and the interstellar medium.

79 ASTRONOMY AND ASTROPHYSICS↗

ComStock Reference Documentation (V.1)

The commercial building sector stock model, or ComStock™, is a highly granular, bottom-up model that uses multiple data sources, statistical sampling methods, and advanced building energy simulations to estimate the annual sub-hourly energy consumption of the commercial building stock across the United States. ComStock asks and answers two questions: how is energy used in the U.S. building stock and what are the impact of energy saving technologies. Specifically, ComStock identifies where energy is being consumed geographically, in what building types and end uses, and at what times of day. Simultaneously, it identifies the impact of efficiency measures: how much energy do efficiency measures save; where, or in what use cases do measures save energy; when, or at what time of day do savings occur; and which building stock segments have the biggest savings potential. This document contains the methodology and assumptions behind ComStock and serves as a guide to its use.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Cluster structure of 3⁢𝛼+𝑝 states in 13 N

Cluster states in 13 N are extremely difficult to measure due to the unavailability of 9 B +𝛼 elastic-scattering data. Using 𝛽-delayed charged-particle spectroscopy of 13 O, clustered states in 13 N can be populated and measured in the 3⁢𝛼+𝑝 decay channel. One-at-a-time implantation and decay of 13 O was performed with the Texas Active Target Time Projection Chamber. 149⁢𝛽⁢3⁢𝛼⁢𝑝 decay events were observed and the excitation function in 13 N reconstructed. Four previously unknown 𝛼-decaying excited states were observed in 13 N at an excitation energy of 11.3, 12.4, 13.1, and 13.7 MeV decaying via the 3⁢𝛼+𝑝 channel. These states are seen to have a [ 9 B ⁡(g.s) ⁢⨂𝛼/𝑝 + 12 C ⁡(0$^+_2$)], [ 9 B ⁡($\frac{1}{2}$ + )⁢ ⨂𝛼], [ 9 B ⁡($\frac{5}{2}$ + )⁢ ⨂𝛼], and [ 9 B⁡ ($\frac{5}{2}$) ⁢⨂𝛼] structure, respectively. A previously seen state at 11.8 MeV was also determined to have a [𝑝+ 12 C ⁡(g.s.)/𝑝+ 12 C ⁡(0$^+_2$)] structure. The overall magnitude of the clustering is not able to be extracted, however, due to the lack of a total width measurement. Clustered states in 13 N (with unknown magnitude) seem to persist from the addition of a proton to the highly 𝛼-clustered 12 C . Evidence of the $\frac{1}{2}$ + state in 9 B was also seen to be populated by decays from 13 N ★ .

Physics↗

Dairy Methane Emissions in California's San Joaquin Valley Inferred With Ground‐Based Remote Sensing Observations in the Summer and Winter

Abstract The dairy industry in the San Joaquin Valley (SJV) is one of California’s largest methane (CH 4 ) sources. Reducing dairy emissions is a priority for the state’s climate change plans. Observations of current dairy CH 4 emissions are key to monitoring actions taken toward this goal. To help support this, we present new ground‐based measurements of atmospheric column‐averaged CH 4 mixing ratio (XCH 4 ) gradients across a group of 600 dairies in the central SJV using EM27/SUN solar spectrometers. We used measurements from the 2019 summer and 2020 winter seasons for a top‐down emission inversion based on the WRF‐STILT model. Our top‐down estimates of the region’s dairy emissions range from 90% to 183% of the current CALGEM inventory’s emissions of 277 Gg/yr. In contrast to the strong temperature dependence found by earlier dairy CH 4 emission studies, we also find that our top‐down emissions during the winter measurement days are comparable to the summer measurement days, possibly due to seasonal changes in dairy management practices and meteorological conditions. Furthermore, we find significant interday variability in our measurements and find that our emission estimates overlap with earlier top‐down studies and bottom‐up inventories in this region. Our study demonstrates how analysis of ground‐based remotely sensed CH 4 gradient observations can help improve our understanding of CH 4 sources at scales relevant to mitigation policy. It also reflects the need for long‐term monitoring of CH 4 emissions in the region and at individual facilities to better understand their emissions.

54 ENVIRONMENTAL SCIENCES↗

First coupled GENE–XGC microturbulence simulations

Covering the core and the edge region of a tokamak, respectively, the two gyrokinetic turbulence codes Gyrokinetic Electromagnetic Numerical Experiment (GENE) and X-point Gyrokinetic Code (XGC) have been successfully coupled by exchanging three-dimensional charge density data needed to solve the gyrokinetic Poisson equation over the entire spatial domain. Certain challenges for the coupling procedure arise from the fact that the two codes employ completely different numerical methods. This includes, in particular, the necessity to introduce mapping procedures for the transfer of data between the unstructured triangular mesh of XGC and the logically rectangular grid (in a combination of real and Fourier space) used by GENE. Constraints on the coupling scheme are also imposed by the use of different time integrators. First, coupled simulations are presented. We have considered collisionless ion temperature gradient turbulence, in both circular and fully shaped plasmas. Coupled simulations successfully reproduce both GENE and XGC reference results, confirming the validity of the code coupling approach toward a whole device model. Here, many lessons learned in the present context, in particular, the need for a coupling procedure as flexible as possible, should be valuable to our and other efforts to couple different kinds of codes in pursuit of a more comprehensive description of complex real-world systems and will drive our further developments of a whole device model for fusion plasmas.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Understanding Microstructure Variability in Vapor-Deposited Energetic Materials by Using Phase-Field Methods

Critical components, such as detonators, in Sandia's stockpile contain heterogeneous materials whose performance and reliability depend on accurate, predictive models of coupled, complex phenomena to predict their synthesis, processing, and operation. Ongoing research in energetic materials has shown that microstructural properties, such as density, pore-size, morphology, and specific surface area are correlated to their initiation threshold and detonation behavior. However, experiments to study these specific characteristics of energetic materials are challenging and time consuming. Therefore, in this work, we turn to mesoscale modeling methods that may be capable of reproducing some observed phenomena to refine and predict outcomes beforehand. Even so, we have no physics-based modeling capability to predict how the microstructure of an energetic material will evolve over near- and long-term time scales. Thus, the goal of this work is to (i) identify any knowledge gaps in how the underlying microstructure forms and evolves during the synthesis process, and (ii) develop and test a mesoscale phase-field model for vapor deposition to capture critical mechanisms of microstructure formation, evolution, and variability in vapor-deposited energetic materials, such as processing conditions, material properties, and substrate interactions. Based on this work, the phase-field method is shown to be a valuable tool for developing the necessary models containing coupled, complex phenomena to investigate and understand the synthesis and processing of energetic materials.

36 MATERIALS SCIENCE↗