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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 181 records · Page 10
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Canted antiferromagnetic order and spin dynamics in the honeycomb-lattice compound Tb 2 Ir 3 Ga 9

Here, single-crystal neutron diffraction, inelastic neutron scattering, bulk magnetization measurements, and first-principles calculations are used to investigate the magnetic properties of the honeycomb lattice Tb 2 Ir 3 Ga 9 . While the R ln 2 magnetic contribution to the low-temperature entropy indicates a J eff = 1 / 2 moment for the lowest-energy crystal-field doublet, the Tb 3 + ions form a canted antiferromagnetic structure below 12.5 K. Due to the Dzyaloshinskii-Moriya interactions, the Tb moments in the a b plane are slightly canted towards b with a canted moment of 1.22 μ B per formula unit. A minimal x x z spin Hamiltonian is used to simultaneously fit the spin-wave frequencies along the high-symmetry directions and the field dependence of the magnetization along the three crystallographic axes. Long-range magnetic interactions for both in-plane and out-of-plane couplings up to the second nearest neighbors are needed to account for the observed static and dynamic properties. The z component of the exchange interactions between Tb moments is larger than the x and y components. This compound also exhibits bond-dependent exchange with negligible nearest-neighbor exchange coupling between moments parallel and perpendicular to the 4 f orbitals. Despite the J eff = 1 / 2 moments, the spin Hamiltonian is denominated by a large in-plane anisotropy K z ~ – 1 meV . DFT calculations confirm the antiferromagnetic ground state and the substantial interplane coupling at larger Tb-Tb distances.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Quantum oscillations in the field-induced ferromagnetic state of MnBi 2-x Sb x Te 4

The intrinsic antiferromagnetic topological insulator MnBi2Te4 undergoes a metamagnetic transition in a c-axis magnetic field. It has been predicted that ferromagnetic MnBi2Te4 is an ideal Weyl semimetal with a single pair of Weyl nodes. Here we report measurements of quantum oscillations detected in the field-induced ferromagnetic phase of MnBi 2-x Sb x Te 4 , where Sb substitution tunes the majority carriers from electrons to holes. Single-frequency Shubnikov–de Haas oscillations were observed in a wide range of Sb concentrations (0.54≤x≤1.21). The evolution of the oscillation frequency and the effective mass shows reasonable agreement with the Weyl semimetal band structure of ferromagnetic MnBi 2 Te 4 predicted by density functional calculations. Intriguingly, the quantum oscillation frequency shows a strong temperature dependence, indicating that the electronic structure depends sensitively on magnetism.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Spin-Orbit-Lattice Entangled State in A 2 ⁢MgReO 6 (A = Ca, Sr, Ba) Revealed by Resonant Inelastic X-Ray Scattering

The 5d 1 ordered double perovskites present an exotic playground for studying novel multipolar physics due to large spin-orbit coupling. Here, we present Re L 3 edge resonant inelastic Xray scattering (RIXS) results that reveal the presence of the dynamic Jahn-Teller effect in the A 2 MgReO 6 (A = Ca, Sr, Ba) family of 5d 1 double perovskites. The spin-orbit excitations in these materials show a strongly asymmetric lineshape and exhibit substantial temperature dependence, indicating that they are dressed with lattice vibrations. Our experimental results are explained quantitatively through a RIXS calculation based on a spin-orbit-lattice entangled electronic ground state with the dynamic Jahn-Teller effect taken into consideration. We find that the spin-orbitlattice entangled state is robust against magnetic and structural phase transitions as well as against significant static Jahn-Teller distortions. Our results illustrate the importance of including vibroniccoupling for a complete description of the ground state physics of 5d 1 double perovskites.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2020

A Comparative Study of Imidazolium-Based Ionic Liquid-Single-Walled Carbon Nanotube Composites with Enhanced Conductivity Properties for Supercapacitor Applications

Mixtures of ionic liquids (ILs) containing single-walled carbon nanotubes (SWCNTs) were prepared and characterized to obtain electrolytes with optimized transport properties for use in energy storage devices such as supercapacitors. Imidazolium ILs bearing cations with side chains of different functionality coupled with bis(trifluoromethylsulfonyl)amide (NTf 2- ) or bis(fluorosulfonyl)-amide (FSA-) anions, were used in mixtures containing up to 5 wt% SWCNTs. At and above 2 wt% nanotube loading, the mixtures exhibited higher conductivities than the pure ILs, in spite of the extremely high viscosities. Loadings of 5 wt% produced very high conductivities, and studies of the temperature dependence indicated a change in the charge transport mechanism between 2 and 5 wt% loading. At 5 wt% loading, the highest conductivities (up to 540 mS/cm at 25 °C) were obtained for the ILs containing the NTf 2- anion. Overall, these results can significantly contribute to the development of improved energy storage devices.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Stacked-mosaic amplifier and diode delivery concept for kJ-class inertial fusion energy laser driver

We report on a laser amplifier architecture designed as a modular element for scaling to multi-megajoule laser facilities intended for inertial fusion energy (IFE) power plants. This kilojoule-class module features a stacked mosaic of gain media integrated with a diode delivery system for efficient optical pumping of the mosaic-structured gain medium, enabling high-repetition-rate operation at high wall plug efficiencies, necessary for an IFE driver. Details of a diode delivery system capable of pumping the mosaic architecture are presented. Comprehensive numerical modeling demonstrates that the stacked-mosaic approach reduces transverse gain by five orders of magnitude compared to a conventional full-aperture Yb:YAG based amplifier, substantially suppressing transverse amplified spontaneous emission (TASE) and enabling enhanced longitudinal energy extraction. Detailed analysis of thermal management and wavefront distortion in a 4 × 4 mosaic array indicates that temperature gradients and thermally induced aberrations are effectively controlled using gas cooling and commercially available phase-plate and deformable mirror technologies. We further discuss the applicability of a stacked-mosaic architecture to direct-drive IFE schemes, where broad spectral bandwidth is critical, and its compatibility with frequency conversion modules for up-conversion to blue wavelengths. Finally, an example point design for a 10 kJ, 10 Hz Yb:YAG module operating at 175 K with wall-plug efficiency exceeding 10 % is presented, underscoring the feasibility of this approach for next-generation high-energy lasers for IFE drivers. The results establish the stacked-mosaic amplifier as a scalable, robust platform not only for IFE but also for a broad range of advanced scientific and industrial laser applications.

Lasers↗
DOE OSTI2023

Carbon flux measurements from chambers collected between July to October 2022 at Old Woman Creek, Huron, Ohio.

This dataset contains carbon dioxide and methane flux measurements collected via chamber sampling at Old Woman Creek National Estuarine Research Reserve in Huron, OH. These data were generated to understand temporal and vegetation patterns associated with wetland carbon cycling. Specifically, this dataset intends to answer how carbon dioxide and methane fluxes change monthly and hourly across sites with vegetation and without vegetation. Data includes chamber measurements that were measured in both sites with vegetation and without vegetation and that were collected hourly, for 12 hours, and monthly, for four months. The file soilrespiration_data.csv contains these data, and the metadata file (soilrespiration_chammetadata.csv) and location metadata file (soilrespiration_locationmetadata.csv) have information on locations where the chambers were placed and sampled in the wetland. Data processing was done on raw methane fluxes (Flux_CH4) to remove the influence of ebullition (Flux_CH4_ebullition) to get a diffusive flux (Flux_CH4_diffusive).

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Carbon flux measurements from chambers collected between April to October 2023 at Old Woman Creek, Huron, Ohio

This dataset contains carbon dioxide and methane gas flux measurements collected via chamber sampling at Old Woman Creek National Estuarine Research Reserve in Huron, OH. These data were generated to understand temporal and vegetation patterns associated with wetland carbon cycling. Specifically, this dataset intends to answer how carbon dioxide and methane fluxes change monthly and hourly across sites with vegetation and without vegetation. Data includes chamber measurements that were measured in both sites with vegetation and without vegetation and that were collected hourly (7 AM to 7 PM or 5 AM to 10 PM and monthly (April to October). The file soilrespiration_data23.csv contains these data, and the metadata file (soilrespiration_chammetadata23.csv) and location metadata file (soilrespiration_locationmetadata23.csv) have information on locations where the chambers were placed and sampled in the wetland. Data processing was done on raw methane fluxes (Flux_CH4) to remove the influence of ebullition (Flux_CH4_ebullition) to get a diffusive flux (Flux_CH4_diffusive).

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Deformation and strength of mantle relevant garnets: Implications for the subduction of basaltic-rich crust

Garnet is an important mineral phase in the upper mantle as it is both a key component in bulk mantle rocks, and a primary phase at high pressure within subducted basalt. In this work, we focus on the strength of garnet and the texture that develops within garnet during accommodation of differential deformational strain. We use X-ray diffraction in a radial geometry to analyze texture development in situ in three garnet compositions under pressure at 300 K: a natural garnet (Prp 60 Alm 37 ) to 30 GPa, and two synthetic majorite-bearing compositions (Prp 59 Maj 41 and Prp 42 Maj 58 ) to 44 GPa. All three garnets develop a modest (100) texture at elevated pressure under axial compression. Elasto-viscoplastic self-consistent (EVPSC) modeling suggests that two slip systems are active in the three garnet compositions at all pressures studied: {110}<$1\bar{1}1$> and {001}<110>. We determine a flow strength of ~5 GPa at pressures between 10 to 15 GPa for all three garnets; these values are higher than previously reported yield strengths measured on natural and majoritic garnets. Strengths calculated using the experimental lattice strain differ from the strength generated from those calculated using EVPSC. Prp 67 Alm 33 , Prp 59 Maj 41 , and Prp 42 Maj 58 are of comparable strength to each other at room temperature, which indicates that majorite substitution does not greatly affect the strength of garnets. Additionally, all three garnets are of similar strength as lower mantle phases such as bridgmanite and ferropericlase, suggesting that garnet may not be notably stronger than the surrounding lower mantle/deep upper mantle phases at the base of the upper mantle.

58 GEOSCIENCES↗
DOE OSTI2022

Heat Loss Characteristics and Energy Use of Piperazine with the Advanced Stripper (PZAS) at the UT-SRP Pilot Plant

Heat duty and heat loss were measured at the pilot plant at UT Austin. Heat loss was measured with energy balances using water. Heat loss was studied using surface temperature measurements over 68 different locations at the pilot plant. Surface temperature measurements indicated that bare metal surfaces were the primary source of heat loss from the pilot plant. Heat loss from bare metal surfaces was at least 50% controlled by natural convection and in many cases was as high as 75% natural convection controlled. Measured heat loss at the pilot plant was 20100 BTU/hr and overall heat loss did not show any dependence on the heat rate of the plant. Compared to PZAS™ at the National Carbon Capture Center, heat loss relative to heat rate was higher at 38%. The relative heat loss at the pilot plants was found to decrease by 20% per MW of added capacity. Measured net heat duty was found to be dependent on measured lean loading and cold rich bypass flow rate. Measured net heat duty was between 2.2 and 2.4 GJ/tonne at an optimum lean loading of 0.2–0.21 mol/mol. Data reconciliation by Aspen Plus® Data Fit™ underpredicted CO2 flow rate by 20% due to an overprediction of lean loading by 19%, indicating a necessary change in thermodynamic parameters in the model. This resulted in an over prediction of heat duty by 33% on average.

Amine scrubbing, stripper, energy requirement, hea↗
DOE OSTI2026

Watershed response of the Feather River Basin, California, United States of America to future climate changes

Increasing mean annual temperatures under climate change are expected to reduce seasonal snowpack, increase evapotranspiration (ET), and alter summer baseflow in headwater watersheds worldwide. Strong regional variability in hydrologic responses highlights the need for catchment-scale, physically based models to assess future flood risk and water availability. This study examines climate-driven changes in the hydrologic response of the Upper Feather River watershed in the Sierra Nevada Mountains, California. Four priority climate models and two representative concentration pathways (RCP4.5 and RCP8.5) are used to evaluate future hydrologic responses of the watershed. Hydrologic processes are simulated using an objectively calibrated Soil and Water Assessment Tool Plus model for a historical baseline (1986–2005) and a future period 2070–2099), driven by observed and projected precipitation and temperature. Results indicate a declining contribution of snowfall to annual precipitation, with peak snowfall and water yield shifting 1–3 months earlier. Long-term annual maximum flows are projected to increase considerably, whereas low-flow responses are mixed, with both increases and decreases projected by the end of the century. These findings highlight the need for adaptive watershed management to enhance flood protection, water storage, and drought resilience. Future water resource planning should also account for one-to-three-month shifts in peak water yield and surface runoff due to changes in snowmelt timing and a lower snowfall-to-rainfall ratio under climate change. The modeling framework and insights are transferable to other snow-dominated headwater watersheds experiencing climate-driven change.

Tigabu, T [UC Davis]↗
DOE OSTI2020

Helium Bubble Growth and Retention Characteristics in Aging Palladium Tritide

The helium-related characteristics of aged palladium tritide, including tritium loss, the formation of He bubbles from tritium decay-induced He atoms, and He thermal desorption behavior are computed using a continuum model of bubble evolution that incorporates the log-normal bubble spacing distribution deduced from 3 He nuclear magnetic resonance (NMR) measurements. This spacing distribution produces significant differences between mean (expectation) values of the bubble size and pressure and the average (median) values of these aging characteristics obtained by a previous calculation. The new calculations find much of the He is retained in a large quantity of smaller bubbles with higher bubble pressures, improving the overall stability of the bubbles and extending the age of He retention. By contrast, the integrated tritide material characteristics of swelling and tritium pressure are found relatively insensitive to details of the bubble spacing distribution. Inter-bubble fracture is predicted to begin with small, closely-spaced bubbles and progress to include larger bubbles near the onset of rapid He release. The critical concentration for this onset increases almost linearly with material tensile strength and decreases with shear modulus. Release of He from the aging solid is modeled as a growing network of fractured inter-bubble ligaments. For small particle or small grain material, the physical size of the fracture cluster, relative to the material dimensions, becomes important. In contrast with normal aging, inter-bubble fracture occurring during thermal desorption appears to begin with large, widely-spaced bubbles, indicating elevated temperature techniques may be of limited use for evaluating development of the bubble fracture network.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2020

As-run thermal-hydraulic analysis of the EPRI-3 experiment

The EPRI-3 experiment was designed to irradiate various types of reactor internal component steels at a temperature of 288°C. The specimens were irradiated in an instrumented test train inside a pressurized water loop in the center lobe of the ATR during cycles 155B and 158B. Temperature was monitored using thermocouples placed at the top of the test train and melt wires placed within the test train. The purpose of this analysis is to calculate specimen temperature using measured data on reactor power and as-run calculations of heating rates of the test train. The experiment contains four thermocouples and several melt wires spanning the temperature range 239°C to 327°C. The accuracy of the model is assessed by comparing the measured and calculated in-pile tube inlet to outlet temperature difference, comparing the measured and calculated thermocouple temperatures, and comparing the calculated melt wire temperature to the temperature range indicated by examination of the melt wires.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2020

Doses and fluxes in the proton-irradiated Big Target: A MARS15 analysis

This work is aimed at determination of secondary particle fluxes, prompt and residual doses as well as energy deposition in and around the Big Target, a 20-tonnes cylindrical target made of natural uranium with the lead core and a stainless-steel yoke, which is being considered to be irradiated by a 0.16-μA 600-MeV proton beam of the JINR Phasotron accelerator. The simulations were performed with the use of the MARS15 particle transport code employing the LAQGSM and CEM generators and based on the ENDFB-VIII neutron cross section library. The calculations for 12-hour, 100-hour, and 3-day irradiations with the aforementioned conditions indicate that temperature rise due to the beam does not require target cooling, the target can be safely handled soon after the end of irradiation, and its decommissioning is possible three years past the irradiation. Doses

43 PARTICLE ACCELERATORS↗
DOE OSTI2021

Thermal energy storage apparatus, controllers and thermal energy storage control methods

Thermal energy storage apparatus, controllers and thermal energy storage control methods are described. According to one aspect, a thermal energy storage apparatus controller includes processing circuitry configured to access first information which is indicative of surpluses and deficiencies of electrical energy upon an electrical power system at a plurality of moments in time, access second information which is indicative of temperature of a thermal energy storage medium at a plurality of moments in time, and use the first and second information to control an amount of electrical energy which is utilized by a heating element to heat the thermal energy storage medium at a plurality of moments in time.

Hammerstrom, Donald J.↗
DOE OSTI2021

DESIGN AND PROTOYPING OF A FISSILE-BEARING CHLORIDE SALT IRRADIATION EXPERIMENT

Limited data exists on the properties of irradiated fueled chloride-based salts for use in advanced nuclear reactors. The design and prototyping of a salt irradiation experiment is underway. Mechanical design will integrate the experiment into existing assemblies in TRIGA type cores. Neutronics modeling demonstrated how targeted power densities can be reached and provide insight on radionuclide source term generation within the experiment. Thermal-hydraulic and computational fluid dynamics (CFD) analysis indicated that temperature ranges in the salt can satisfy both safety and programmatic requirements. Initial prototyping tests provided confidence in the ability to extract the salt post-irradiation, and in the heater performance. Future planned prototyping will provide an integral assessment of the proposed design prior to insertion in the reactor.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2024

Chemical Environment and Structural Variations in High Entropy Oxide Thin Film Probed with Electron Microscopy

For this work, we employ analytical transmission electron microscopy (TEM) to correlate the structural and chemical environment variations within a stacked epitaxial thin film of the high entropy oxide (HEO) Mg 0.2 Co 0.2 Ni 0.2 Cu 0.2 Zn 0.2 O (J14), with two layers grown at different substrate temperatures (500 and 200 °C) using pulsed laser deposition (PLD). Electron diffraction and atomically resolved STEM imaging reveal the difference in out-of-plane lattice parameters in the stacked thin film, which is further quantified on a larger scale using four-dimensional STEM (4D-STEM). In the layer deposited at a lower temperature, electron energy loss spectroscopy (EELS) mapping indicates drastic changes in the oxidation states and bonding environment for Co ions, and energy-dispersive X-ray spectroscopy (EDX) mapping detects more significant cation deficiency. Ab initio density functional theory (DFT) calculations validate that vacancies on the cation sublattice of J14 result in significant electronic and structural changes. The experimental and computational analyses indicate that low temperatures during film growth result in cation deficiency, an altered chemical environment, and reduced lattice parameters while maintaining a single phase. Our results demonstrate that the complex correlation of configurational entropy, kinetics, and thermodynamics can be utilized for accessing a range of metastable configurations in HEO materials without altering cation proportions, enabling further engineering of functional properties of HEO materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Vitamin B12 conveys a protective advantage to phycosphere-associated bacteria at high temperatures

Abstract Many marine microbes require vitamin B12 (cobalamin) but are unable to synthesize it, necessitating reliance on other B12-producing microbes. Thus, phytoplankton and bacterioplankton community dynamics can partially depend on the production and release of a limiting resource by members of the same community. We tested the impact of temperature and B12 availability on the growth of two bacterial taxa commonly associated with phytoplankton: Ruegeria pomeroyi, which produces B12 and fulfills the B12 requirements of some phytoplankton, and Alteromonas macleodii, which does not produce B12 but also does not strictly require it for growth. For B12-producing R. pomeroyi, we further tested how temperature influences B12 production and release. Access to B12 significantly increased growth rates of both species at the highest temperatures tested (38 °C for R. pomeroyi, 40 °C for A. macleodii) and A. macleodii biomass was significantly reduced when grown at high temperatures without B12, indicating that B12 is protective at high temperatures. Moreover, R. pomeroyi produced more B12 at warmer temperatures but did not release detectable amounts of B12 at any temperature tested. Results imply that increasing temperatures and more frequent marine heatwaves with climate change will influence microbial B12 dynamics and could interrupt symbiotic resource sharing.

Mars Brisbin, Margaret (ORCID:0000000177560039)↗
DOE OSTI2020

Violation of the T –1 Relationship in the Lattice Thermal Conductivity of Mg 3 Sb 2 with Locally Asymmetric Vibrations

Most crystalline materials follow the guidelines of T –1 temperature-dependent lattice thermal conductivity (κ L ) at elevated temperatures. Here, we observe a weak temperature dependence of κ L in Mg 3 Sb 2 , T –0.48 from theory and T –0.57 from measurements, based on a comprehensive study combining ab initio molecular dynamics calculations and experimental measurements on single crystal Mg 3 Sb 2 . These results can be understood in terms of the so-called “phonon renormalization” effects due to the strong temperature dependence of the interatomic force constants (IFCs). The increasing temperature leads to the frequency upshifting for those low-frequency phonons dominating heat transport, and more importantly, the phonon-phonon interactions are weakened. In-depth analysis reveals that the phenomenon is closely related to the temperature-induced asymmetric movements of Mg atoms within MgSb 4 tetrahedron. With increasing temperature, these Mg atoms tend to locate at the areas with relatively low force in the force profile, leading to reduced effective 3 rd -order IFCs. The locally asymmetrical atomic movements at elevated temperatures can be further treated as an indicator of temperature-induced variations of IFCs and thus relatively strong phonon renormalization. The present work sheds light on the fundamental origins of anomalous temperature dependence of κ L in thermoelectrics.

36 MATERIALS SCIENCE↗