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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 217 records · Page 12

Accomplishments of Thermal Neutron Scattering Research at North Carolina State University [Slides]

Thermal neutron scattering law (TSL) data evaluations have been completed and contributed to ENDF. New evaluations are underway. FLASSH is developing as a modern platform for thermal neutron data analysis featuring an enhanced user experience and low learning overhead. Advanced TSL techniques in combination with Doppler analysis have been developed, which were incorporated into FLASSH. ML/DL NeTS method development has been initiated. Experimental capabilities for validation have been developed at the PULSTAR reactor.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Approach to Defect-Free Lifetime and High Electron Density in CdTe

Achieving simultaneously high carrier density and lifetime is crucial to II-VI semiconductor-based applications such as photovoltaics and infrared detectors; yet, it is a challenging task. In this work, high purity CdTe single crystals doped with indium (In) were grown by vertical Bridgman melt growth under carefully controlled stoichiometry. Two-photon excitation time-resolved photoluminescence was employed to measure bulk recombination lifetime by eliminating surface recombination effects. By adjusting stoichiometry with post growth annealing, high-net free carrier density approaching 10 18 cm -3 was attained simultaneously with lifetime approaching the radiative limit by suppressing non-radiative recombination centers.

14 SOLAR ENERGY↗

BTRIC Technical Support for Appalachia: FY 2024 Summary Report on Net Negative Carbon Building Demonstration with AgPod

This report investigates the effects of various concentrations of CO 2 on the photosynthesis and biomass accumulation of crops growing in an AgPod, using kale as the test crop. In the first year of the study, increasing the CO 2 concentration in the AgPod was found to promote higher photosynthetic rates in kale plants up to 1,300 ppm (the highest CO 2 concentration measured). An interesting finding was that net photosynthetic rates of kale leaves remain unsaturated until reaching unusually high levels of photosynthetically active radiation (PAR, > 1,200 µmol m -1 s -1 ) and CO 2 concentration (> 1,100 ppm). Such high levels of saturating PAR and CO 2 concentration values rarely occur under natural conditions, suggesting a promising potential for carbon capture via enriched controlled environment agriculture (ECEA). During the second year of the study, a second crop was planted to confirm the actual effects on growth with increased CO 2 concentrations. Our results suggest that growing kale plants in the AgPod system at higher CO 2 levels resulted in a successful and highly productive crop, up to three times the amount grown at 415 CO 2 . Further, the kale plants grown under higher CO 2 conditions (1000 ppm) are not CO 2 saturated and can potentially further improve yield at even higher CO 2 environments.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Progress on Pu-238 Production at Idaho National Laboratory From February 2022 to December 2022

Idaho National Laboratory (INL) has continued to qualify irradiation positions in the Advanced Test Reactor (ATR) for Pu-238 production to support NASA deep space missions. Over the past year, INL qualified Np-237 targets for ATR’s North East Flux Trap (NEFT), inner A, and H positions. Work has begun to requalify the South Flux Trap (SFT) and qualify the East Flux Trap (EFT) for the ATR GEN I target and is midway through the qualification process. This paper gives an overview of operational and technical activities from February 2022 to December 2022.

07 ISOTOPE AND RADIATION SOURCES↗

Effect of Confinement of SIA Cluster Diffusion by Impurities on Radiation Defect Accumulation due to 14MeV neutrons in Tungsten

Impurities acting as traps, reduce the self-interstitial atom (SIA) cluster mobility, thereby increasing recombination and in turn enhancing radiation-resistance of polycrystalline materials. However, at elevated temperatures, depending on SIA-trap (impurity) binding energy, SIA clusters may trap and detrap (detach) numerous times. In tungsten, SIA clusters of all sizes glide one-dimensionally (1D) along their Burgers vector direction. Hence, detrapped SIAs would retrace their path, confining their 1D-glide between traps. However, small SIA clusters can change the direction of their 1D-glide by overcoming a rotation barrier. In addition, impurities or solutes are known to reduce this barrier. A lower rotation barrier can result in detrapped SIA clusters that diffuse in a random 1D direction, effectively leading to 3D (net-3D) diffusion. Here we investigate the effect of two cases of SIA diffusion, namely confined-1D diffusion and net-3D diffusion, on the damage accumulation in polycrystalline tungsten under 14 MeV neutron irradiation using the object kinetic Monte Carlo method. Simulations were performed using cascade debris obtained from molecular dynamics simulations with primary knock-on atom (PKA) energies corresponding to 14 MeV neutrons. In the simulations with net-3D diffusion, SIA clusters of all sizes diffuse in a random 1D direction after the clusters detrap. While for the confined 1D diffusion case, SIA clusters larger than size 5 retain their original direction of 1D-glide. In both types of simulations, trapped vacancies are assumed to be permanently immobilized. Unexpectedly, the damage accumulation was lower with confined 1D diffusion than that with net-3D. We present a systematic comparison of the influence of the two cases of SIA diffusion on the radiation damage accumulation as a function of dose rate, detrapping barrier, and impurity concentration at 1025 K.

Accumulation and recovery of lattice damage, tungs↗

Neural Thermal Scattering (NeTS) Modules for Graphite & Beryllium [Slides]

This presentation discusses the motivations behind the project, which include facilitating compact formulation for TSL data, extending AI knowledge, and providing advanced reactor simulation framework. It also discusses how the project accounts for beryllium and graphite complexity, including atomistic, dynamical, and neural. Additionally, new material-informed neural thermal scattering (NeTS) Modules are examined. The implications, conclusions, and plan future work for the project are also discussed.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Assessing Global and Local Radiative Feedbacks Based on AGCM Simulations for 1980–2014/2017

In order to avoid contamination of unobservable and uncertain effective radiative forcing (ERF) on the diagnosis of radiative feedbacks based on short-term climate variability, we verify the Kernel-Gregory feedback calculation method using atmospheric model experiments with prescribed ERF. We show that both clear-sky radiative fluxes and all-sky radiative feedbacks have a closure between model simulations and kernel derivations. A near-zero global mean net cloud feedback is found in the simulation with prescribed ERF, which results in a more negative global net climate feedback, -2 W m -2 K -1 . Consistent with AMIP6 ensemble mean results, the lapse rate feedback is the largest contributor among all feedbacks to temperature amplification over the three poles (Arctic, Antarctic and Tibetan Plateau), followed by surface albedo feedback and Planck feedback deviation from its global mean. Except for the higher surface albedo feedback in the Antarctic, other feedbacks are almost same between the Arctic and Antarctic.

54 ENVIRONMENTAL SCIENCES↗

The Unexpected Oceanic Peak in Energy Input to the Atmosphere and Its Consequences for Monsoon Rainfall

Abstract Monsoons have historically been understood to be caused by the low thermal inertia of land, allowing more energy from summer insolation to be transferred to the overlying atmosphere than over adjacent ocean. Here, we show that during boreal summer, the global maximum net energy input (NEI) to the atmosphere unexpectedly lies over the Indian Ocean, not over land. Observed radiative fluxes suggest that cloud‐radiative effects (CRE) almost double the NEI over ocean, shifting the NEI peak from land to ocean. Global climate model experiments with both land and interactive sea surface temperatures confirm that CRE create the oceanic NEI maximum. Interactions between CRE, NEI, circulation, and land‐sea contrast in surface heat capacity shift precipitation from Southeast to South Asia. CRE thus alter the global partitioning of precipitation between land and ocean and the spatial structure of Earth's strongest monsoon, in ways that can be understood through the NEI.

54 ENVIRONMENTAL SCIENCES↗

Local radiative feedbacks over the Arctic based on observed short-term climate variations

We compare various radiative feedbacks in response to short-term climate variations estimated from reanalysis, satellite, and global climate model datasets using the combined Kernel-Gregory approach over the Arctic (60-90°N). Except for the shortwave cloud feedback, all feedbacks are positive over the Arctic. Lapse rate feedback is comparable with surface albedo feedback. Relative to the tropics (30°S-30°N), the temperature feedback (lapse rate feedback plus Planck feedback deviation from its global mean) is the largest contributor to Arctic amplification among all feedbacks, followed by surface albedo feedback. The choice of meteorological fields has a small impact on the cloud feedback estimate, but different top-of-the-atmosphere clear-sky fluxes datasets can result in a wide spread of estimated cloud feedbacks. The net cloud feedback over the Arctic is positive due to a larger positive in longwave than the negative shortwave feedback, but has the largest uncertainty. Relative to the tropics, the longwave cloud feedback largely contributes to the Arctic amplification.

Zhang, Rudong↗

Application of Refractory High-Entropy Alloys for Higher-Reliability and Higher-Efficiency Brayton Cycles and Advanced Nuclear Reactors

An exceptional set of newly-discovered advanced superalloys known as refractory high-entropy alloys (RHEAs) can provide near-term solutions for wear, erosion, corrosion, high-temperature strength, creep, and radiation issues associated with supercritical carbon dioxide (sCO2) Brayton Cycles and advanced nuclear reactors. In particular, these superalloys can significantly extend their durability, reliability, and thermal efficiency, thereby making them more cost-competitive, safer, and reliable. For this project, it was endeavored to manufacture and test certain RHEAs, to solve technical issues impacting the Brayton Cycle and advanced nuclear reactors. This was achieved by leveraging Sandia’s patents, technical advances, and previous experience working with RHEAs. Herein, three RHEA manufacturing methods were applied: laser engineered net shaping, spark plasma sintering, and spray coating. Two promising RHEAs were selected, HfNbTaZr and MoNbTaVW. To demonstrate their performance, erosion, structural, radiation, and hightemperature experiments were conducted on the RHEAs, stainless steel (SS) 316 L, SS 1020, and Inconel 718 test coupons, as well as bench-top components. The experimental data is presented, analyzed, and confirms the superior performance of the HfNbTaZr and MoNbTaVW RHEAs vs. SS 316 L, SS 1020, and Inconel 718. In addition, to gain more insights for larger-scale RHEA applications, the erosion and structural capabilities for the two RHEAs were simulated and compared with the experimental data. The experimental data confirm the superior performance of the HfNbTaZr and MoNbTaVW RHEAs vs. SS and Inconel. Most importantly, the erosion and the coating material experimental data show that erosion in sCO2 Brayton Cycles can be eliminated completely if RHEAs are used. The experimental suite and validations confirm that HfNbTaZr is suitable for harsh environments that do not include nuclear radiation, while MoNbTaVW is suitable for harsh environments that include radiation.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

In Situ High-Cycle Fatigue Reveals Importance of Grain Boundary Structure in Nanocrystalline Cu-Zr

The radiation tolerance of metals can be improved through the incorporation of surfacesand interfaces within the material. Nanocrystalline metals are especially attractive due to theirlarge interfacial volume fraction in the form of grain boundaries, but grain growth duringirradiation usually degrades any improvement in radiation tolerance. Therefore, methods to limitgrain growth and simultaneously improve the radiation tolerance of nanocrystalline metals areneeded. Amorphous intergranular films are unique grain boundary structures that are predicted tohave improved sink efficiencies compared to traditional ordered grain boundaries due to theirincreased thickness and amorphous structure. In addition, amorphous intergranular films havebeen shown to improve the grain size stability of nanocrystalline alloys since they arethermodynamically-preferred at very high temperatures and also can kinetically slow migrationdue to the interface being heavily doped. In this study, ball milled nanocrystalline Cu-Zr alloysare heat treated to either have only ordered grain boundaries or to contain amorphous intergranularfilms distributed throughout the grain boundary network, and are then subjected to in situtransmission electron microscopy irradiation and ex situ bulk irradiation. Differences in defectdensity and grain growth due to grain boundary structural transitions are then investigated. Whenamorphous intergranular films are incorporated within the material, not only is the net sinkefficiency of the entire grain boundary network increased, but grain growth is also limited, leadingto nanocrystalline alloys with improved radiation tolerance.

36 MATERIALS SCIENCE↗

An Alternative Conceptual Model for the Spent Nuclear Fuel–Water Interaction in Deep Geologic Disposal Conditions

For the long-term safety assessment of direct disposal of spent nuclear fuel in deep geologic repositories, knowledge on the radionuclide release rate from the UO 2 matrix is essential. This work provides a conceptual model to explain the results of leaching experiments involving used nuclear fuel or simulant materials in confirmed reducing conditions. Key elements of this model are: direct effect of radiation from radiolytic species (including defects and excited states) in the solid and in the first water layers in contact with its surface; and excess H 2 may be produced due to processes occurring at the surface of the spent fuel and in confined water volumes, which may also play a role in keeping the spent fuel surface in a reduced state. The implication is that the fractional radionuclide release rate used in most long-term safety assessments (10 -7 year -1 ) is over estimated because it assumes that there is net UO 2 oxidation caused by radiolysis, in contrast with the alternative conceptual model presented here. Furthermore, conventional water radiolysis models and radiation chemical yields published in the literature are not directly applicable to a heterogeneous system such as the spent fuel–water interface. Suggestions are provided for future work to develop more reliable models for the long-term safety assessment of spent nuclear fuel disposal.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Radiation GRMHD Models of Accretion onto Stellar-mass Black Holes. I. Survey of Eddington Ratios

We summarize results from a survey of radiation-dominated black hole accretion flows across a wide range of mass accretion rates, as well as two values of black hole spin and initial magnetic field geometry. These models apply an algorithm targeting direct solutions to the radiation transport equation in full general relativity and have been enabled by access to modern exascale computing systems. Super-Eddington accretion flows form geometrically thick radiation-pressure-supported disks that drive powerful equatorial outflows. A narrow funnel-shaped photosphere in the inner region results in very low radiative efficiencies in this regime. The structure of near- and sub-Eddington accretion depends on whether there is net vertical magnetic flux at the midplane of the disk. With net flux, the disk forms a thin, dense layer at the midplane surrounded by a magnetically dominated corona, whereas without net flux, the disk remains magnetically dominated everywhere. Although none of our models achieve the magnetically arrested disk regime, those with net vertical flux and a rapidly spinning black hole still produce powerful relativistic jets. Our calculations adopt simple opacity models (with scalings appropriate to stellar-mass black hole accretion). We discuss the application of our results to observations of X-ray binaries and ultraluminous X-ray sources such as Cyg X-3 and SS433. We also speculate on the application of our super-Eddington models to the interpretation of little red dots recently discovered by JWST.

79 ASTRONOMY AND ASTROPHYSICS↗

Reticular exploration of uranium-based metal—organic frameworks with hexacarboxylate building units

We report that the rational reticular design of metal–organic frameworks (MOFs) from building units of known geometries is essential for enriching the diversity of MOF structures. Unexpected and intriguing structures, however, can also arise from subtle changes in the rigidity/length of organic linkers and/or synthetic conditions. Herein, we report three uranium-based MOF structures—i.e., NU-135X (X = 0, 1, 2)—synthesized from trigonal planar uranyl nodes and triptycene-based hexacarboxylate ligands with variable arm lengths. A new chiral 3,6-connected nuc net was observed in NU-1350, while the extended versions of the ligand led to 3-fold catenated MOFs (NU-1351 and NU-1352) with rare 3,6-connected cml-c3 nets. Lastly, the differences in the topology of NU-1350 and NU-1351/NU-1352 could be attributed to the slight distortions of the shorter linker in the former from the ideal trigonal prism geometry to an octahedral geometry when coordinated to the trigonal planar uranyl nodes.

3,6-connected net↗

Leaf isoprene and monoterpene emission data-set across hyperdominant tree genera in the Amazon basin

This data package contains the analyzed data used to support the publication "Leaf isoprene and monoterpene emission distribution across hyperdominant tree genera in the Amazon basin," Phytochemistry, in-press. Data was collected from 162 trees across four sites in the Amazon. For all leaf samples studied for volatile isoprenoid emissions, branch cuttings were conducted in the upper canopy with sun exposed leaves with the assistance of a tree climber utilizing a pole pruner or directly accessed from flux towers. Large branches were removed from the upper canopy (up to 0.5-1.0 meter in length) and rapidly recut on the ground under water to maintain the transpiration stream. Net photosynthesis and isoprene and monoterpene emission rates were quantified from leaves during controlled changes in photosynthetically active radiation (PAR) using a commercial leaf photosynthesis system (LI-6400XT, LI-COR Inc., USA) interfaced with a gas chromatograph-mass spectrometer (GC-MS, 5975C series, Agilent Technologies, USA). For detailed methods and raw data, refer to the publication and related material cited in Dataset References.

54 ENVIRONMENTAL SCIENCES↗

Machine learning opportunities for nucleosynthesis studies

Nuclear astrophysics is an interdisciplinary field focused on exploring the impact of nuclear physics on the evolution and explosions of stars and the cosmic creation of the elements. While researchers in astrophysics and in nuclear physics are separately using machine learning approaches to advance studies in their fields, there is currently little use of machine learning in nuclear astrophysics. We briefly describe the most common types of machine learning algorithms, and then detail their numerous possible uses to advance nuclear astrophysics, with a focus on simulation-based nucleosynthesis studies. We show that machine learning offers novel, complementary, creative approaches to address many important nucleosynthesis puzzles, with the potential to initiate a new frontier in nuclear astrophysics research.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Multiscale Modeling of Plutonium Radiation Chemistry in Nitric Acid Solutions. 1. Cobalt-60 Gamma Irradiation of Pu(IV)

We report careful manipulation of the plutonium oxidation states is essential in the study and utilization of its rich redox chemistry. To achieve this level of control, a comprehensive mechanistic understanding of radiation-induced plutonium redox chemistry is critical due to the unavoidable exposure of plutonium to ionizing radiation fields, both inherent and from in-process applications. To this end, we have developed an experimentally evaluated multiscale computer model for the prediction of gamma radiation-induced Pu(IV) redox chemistry in concentrated nitric acid solutions (1.0, 3.0, and 6.0 M). Under these acidic, aqueous solution conditions, cobalt-60 gamma irradiation afforded marginal net conversion of Pu(IV) to Pu(VI), the extent of which was dependent on the concentration of HNO 3 and absorbed gamma dose. Multiscale calculations, which are in excellent agreement with experimental data, indicate that this observation is due to a combination of inherent plutonium disproportionation reactions and several radiation-induced processes, including redox cycling between Pu(IV) and Pu(III), as achieved by the reduction of Pu(IV) by nitrous acid and hydrogen peroxide, the oxidation of Pu(III) by nitrate and hydroxyl radicals, and the sequential oxidation of Pu(IV) to Pu(V) and Pu(VI) by the remaining available yield of nitrate radicals.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Integrating Aquatic Metabolism and Net Ecosystem CO2 Balance in Short- and Long-Hydroperiod Subtropical Freshwater Wetlands

Abstract How aquatic primary productivity influences the carbon (C) sequestering capacity of wetlands is uncertain. We evaluated the magnitude and variability in aquatic C dynamics and compared them to net ecosystem CO 2 exchange (NEE) and ecosystem respiration ( R eco ) rates within calcareous freshwater wetlands in Everglades National Park. We continuously recorded 30-min measurements of dissolved oxygen (DO), water level, water temperature ( T water ), and photosynthetically active radiation (PAR). These measurements were coupled with ecosystem CO 2 fluxes over 5 years (2012–2016) in a long-hydroperiod peat-rich, freshwater marsh and a short-hydroperiod, freshwater marl prairie. Daily net aquatic primary productivity (NAPP) rates indicated both wetlands were generally net heterotrophic. Gross aquatic primary productivity (GAPP) ranged from 0 to − 6.3 g C m −2 day −1 and aquatic respiration ( R Aq ) from 0 to 6.13 g C m −2 day −1 . Nonlinear interactions between water level, T water , and GAPP and R Aq resulted in high variability in NAPP that contributed to NEE. Net aquatic primary productivity accounted for 4–5% of the deviance explained in NEE rates. With respect to the flux magnitude, daily NAPP was a greater proportion of daily NEE at the long-hydroperiod site (mean = 95%) compared to the short-hydroperiod site (mean = 64%). Although we have confirmed the significant contribution of NAPP to NEE in both long- and short-hydroperiod freshwater wetlands, the decoupling of the aquatic and ecosystem fluxes could largely depend on emergent vegetation, the carbonate cycle, and the lateral C flux.

Malone, Sparkle L.↗