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SULI Intern Final Report: Computationally Investigating Hydrogen Thermo-Diffusion in Yttrium Hydride Using Multiscale Methods

The renaissance of nuclear energy has arrived, heralding an age of abundant inexpensive clean energy, and renewed space exploration. In nuclear-powered spacecraft and microreactors, safety and size are of utmost importance. Yttrium Hydride (YHx) is being researched for its utility as a neutron moderator in nuclear reactors; the hydrogen in YHx slows down neutrons, enabling a continuous nuclear reaction in the reactor. This has the benefit of allowing reactors to be more safe, compact, and efficient. The goal of this effort is to computationally predict the coefficient of temperature-dependent hydrogen diffusion within YHx, the Soret coefficient. This parameter is essential for determining the safe operating modes of YHx moderators. Zirconium Hydride (ZrHx) is used in the Training, Research, Isotopes, General Atomics (TRIGA) reactor, is the reference material for these calculations. In this work, nanoscale atomic modeling in the Vienna Ab initio Simulation Package (VASP) is combined with the mesoscale finite element phase-field module in the Multiphysics Object-Oriented Simulation Environment (MOOSE); this culminates in a new multiscale computational method to simulate Soret diffusion of hydrogen in YHx. This data is useful for predicting experimental outcomes. This workflow involves convergence testing followed by static, Nudged Elastic Band (NEB), Quasi-Harmonic Approximation (QHA), and Molecular Dynamics (MD) calculations - linked with phase field simulation. NEB simulates hydrogen migration, while QHA and MD predict temperature-dependent properties. The static calculations align with literature, and preliminary NEB and QHA calculations yield accurate results. Once the atomic calculations are complete, we will incorporate Electron Backscatter Diffraction (EBSD) images and VASP-generated parameters into the phase field module to simulate intra- and intergranular transport of hydrogen in ZrHx and YHx. Future research will extend our approach to fuel-moderator materials systems such as Uranium-Yttrium Hydride (U-YHx). This work contributes to the development of advanced nuclear energy solutions for space travel.

36 - MATERIALS SCIENCE

Synthesizing intermetallic thermoelectric materials using metal flux growth method

With zero energy poverty by 2050 goals, exploring innovative energy technologies is essential. Thermoelectric materials (TEMs) have the potential to harness waste heat and convert it to electricity (e.g., for spacecraft power, sensors, and cryogenic cooling). Two limitations of thermoelectric compounds are their low efficiency and limited pool of materials. Optimizing the efficiency of TEMs is challenging due to the interdependent relationship between electrical and thermal conductivity. A deeper understanding of electronic properties and lattice thermal conductivity is necessary to “understand, predict and ultimately control” the thermoelectric properties of TEMs. Understanding the influence of light-atom-doping and intrinsic defects on the electronic properties of the f-element containing TEMs are important questions that need to be answered to design and synthesize TEMs with optimal parameters. The purpose of this work is to understand how doping f-element based TEMs with light elements, such as carbon and boron, would impact the crystal structure, bond lengths, band gaps, and thermoelectric characteristics. High-quality f¬-element containing intermetallic single crystals are grown in metal flux media. In molten metal flux growth method, one or more low-melting metals such as aluminum, gallium, tin, and bismuth are used in excess as the reaction medium. As these are solution-state reactions, we can use lower temperatures than solid-state reactions and isolate the kinetic products instead of the thermodynamically stable compound. Then these are characterized using X-ray diffraction, scanning electron microscopy, energy dispersive spectroscopy, magnetization, electrical and thermal conductivities, and thermoelectric power.

37 - INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL C

Alpha Decay Chains as Thermal Power Sources: Analysis and Applications for RTGs

Radioactive sources can provide power in remote and environmentally harsh locations such as the arctic or space. The generators powered by such sources are rugged and can withstand extreme temperatures, lack of sunlight, and require no human intervention for multiple years. Radioisotopes are used in thermoelectric generators to provide power at remote sites and deep in space. Isotopes like Pu-238, Cm-244, and Am-241 are used in these generators by NASA for power in space probes and spacecrafts. These power sources deliver a steady supply of energy over extended periods of time. Alpha particles created during decay do not travel far in a material. Their kinetic energy is transferred to heat that we can then convert into energy. Unlike beta and gamma decay, the slower-moving alpha particles stop in the material, making their energy available for use. Energy from these natural decay processes provides a reliable source of power. Spontaneous fission is rare and unreliable, and unlike induced fission processes, alpha decay occurs naturally and does not require external management or ignition. The ideal properties of an isotope for use as a power source depend upon the intended use. For use in an Arctic research base over a period of several years, but less than a decade, an isotope that provides high power output over a shorter lifespan may be the most suitable option. Whereas, for deep space missions where a consistent power source for decades or perhaps more than 100 years is needed that would require a very different isotope. One with a much longer half-life that would provide consistent power throughout that time and survive in that state in for these extended periods of time. These examples represent two extreme sides in terms of time frames. By analyzing the power produced by different radioactive decay processes over time, we can evaluate the suitability of various isotope decay chains for specific uses. Some unstable isotopes undergo a series of radioactive decays, transforming into different isotopes at each step and resulting in a stable isotope. The lists of isotopes in these decay processes are known as decay chains. Some of these chains, illustrated in the figures below, are currently being investigated for use in radioisotope thermoelectric generators (RTGs) designed for a range of operational durations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS

Space Power

For almost 50 years, the National Laboratory of the Rockies (NLR) has developed solar cells to power satellites and spacecraft. Today, NLR is working to improve the durability, performance, and affordability of several photovoltaic (PV) materials for space and power beaming applications. The lab works closely with partners to ensure this research can be quickly and widely adopted.

14 SOLAR ENERGY

LuSEE-night power distribution system design

The Lunar Surface Electromagnetic Experiment at Night (LuSEE-Night) is a low-frequency, 0.5 to 50 MHz, radio experiment on the radio-quiet far side of the Moon. The instrument will be launched by NASA Commercial Lunar Payload Services in 2026. The LuSEE-Night instrument core is composed of a radio frequency spectrometer (SPT) processing signals from four antennas, the Data Controller Board (DCB), low electromagnetic interference (EMI) Picket Fence Power Supply (PFPS), and Power Distribution Unit (PDU). The battery powers the instrument during the lunar night and stores energy harvested by the solar panel array during the lunar day. The battery charging is controlled by the Power Conditioning and Distribution Unit (PCDU). The unregulated power is supplied either by the SpaceCraft (S/C) or the battery and gets distributed to the PFPS, communication radio, heaters, and deployables through the PDU. The PFPS generates all regulated low-voltage rails using switching regulation synchronized to the LuSEE-Night clock, which ensures self-generated EMI will be confined to well-defined frequency bins. Here, we discussed the unregulated power distribution system architecture and functionality. The PDU engineering and flight modules are developed and characterized to confirm compliance with LuSEE-Night requirements. At the time of writing, all power subsystem components have been integrated into the payload.

47 OTHER INSTRUMENTATION

helioLuna: Prospect for cislunar spacecraft and near-earth asteroid detection using heliostat fields at night

We experimentally and computationally investigate a proposed frequency-domain method for detecting and tracking cislunar spacecraft and near-earth asteroids using heliostat fields at night. Unlike imaging, which detects spacecraft and asteroids by their streak in sidereally-fixed long-exposure photographs, our proposed detection method oscillates the orientation of heliostats concentrating light from the stellar field and measures the light’s photocurrent power spectrum at sub-milliHertz resolution. If heliostat oscillation traces out an ellipse fixed in the galactic coordinate system, spacecraft or asteroids produce a peak in photocurrent power spectrum at a frequency slightly shifted from the starlight peak. The frequency shift is on the scale of milliHertz and proportional to apparent angular rate relative to sidereal. Relative phase corresponds to relative angular position, enabling tracking. A potential advantage of this frequency-domain method over imaging is that detectivity improves with apparent angular rate and number of heliostats. Since heliostats are inexpensive compared to an astronomical observatory and otherwise unused at night, the proposed method may cost-effectively augment observatory systems such as NASA’s Asteroid Terrestrial-impact Last Alert System (ATLAS).

79 ASTRONOMY AND ASTROPHYSICS

In-flight performance of the XRISM/Resolve detector system

The Resolve instrument was launched on board the XRISM observatory in early September 2023. The Resolve spectrometer is based on a high-sensitivity X-ray calorimeter detector system (DS) that has been successfully deployed in many ground and sub-orbital spectrometers. However, the Resolve instrument is the first long-term implementation in space. The instrument will provide essential diagnostics for nearly every class of X-ray emitting objects, from galactic supernova remnants to the outskirts of galaxy clusters, without degradation for spatially extended objects. The Resolve DS consists of a 36-pixel microcalorimeter array operated at a heat sink temperature of 50 mK. In pre-flight testing, the DS demonstrated a resolving power of better than 1300 at 6 keV with a simultaneous bandpass from below 0.3 keV to above 12 keV and a timing precision better than 100μs. An anti-coincidence detector placed directly behind the microcalorimeter array effectively suppresses background. The detector energy-resolution budget included terms for interference from the Resolve cooling system and the spacecraft. Additional terms for energy-scale stability, on-orbit effects, and use of mid-grade events were also included, predicting an end-of-life, on-orbit performance for high- and mid-resolution grade events that meet the requirement of 7 eV FWHM at 6 keV. Here, we discuss the actual on-orbit performance of the Resolve DS and compare this with the performance in pre-flight testing, on-orbit predictions, and the almost identical Hitomi/SXS instrument. We will also discuss the on-orbit gain stability, an assessment of on-orbit interference, and measurements of the on-orbit background.

Astronomy and AstroPhysics

The OSIRIS-REx Sample Return Capsule re-entry: A coordinated seismo-acoustic observational campaign for the study of meteor phenomena

Objects entering Earth’s atmosphere at hypersonic velocities may generate powerful acoustic waves. Depending on atmospheric conditions and acoustic propagation paths, they may be captured using ground or balloon-borne microbarometers and microphones. Impacts into the Earth’s atmosphere by asteroids in a meter-size range are sporadic and unannounced, and thus, well-documented scientific observations of asteroids are rare and generally happen by chance. Arriving from interplanetary space at hypervelocity, spacecraft are considered analogues for low velocity meteoroids and asteroids impacting the Earth’s atmosphere, and as such provide unprecedented and unique opportunity to carry out planned observational campaigns and perform detailed studies of meteor phenomena. However, since the end of the Apollo era, only four instances of a hypersonic re-entry of an artificial body from interplanetary space with an incident speed of 11-12 km/s have been observed and studied. These were the Sample Return Capsules (SRCs) that brought physical samples of extraterrestrial material back to Earth (Genesis, Stardust, Hayabusa 1, Hayabusa 2). These re-entries were also detected by infrasound and/or seismic sensors. The next opportunity to observe an artificial meteor will be on 24 September 2023 with the re-entry of NASA’s OSIRIS-REx SRC that will bring samples of the carbonaceous near-Earth asteroid Bennu. The re-entry consists of several flight phases, including hypersonic and supersonic, providing a unique opportunity to observe these by infrasound and seismic sensors. We will discuss observational campaign efforts aimed to capture geophysical signals generated by the OSIRIS-REx SRC re-entry. This campaign utilizes an unparalleled number of instruments, both ground and airborne, strategically positioned in the immediate and extended region around the projected re-entry trajectory to maximize the scientific output.

47 - OTHER INSTRUMENTATION

Energy Transport and Conversion Above a Bright Discrete Auroral Arc

Magnetically connected observations of particle distributions and luminosity from the Reimei spacecraft are used to examine energy transport and conversion occurring above a discrete auroral arc. By combining imaging and in situ measurements it is shown how transverse electromagnetic and kinetic energy fluxes measured along the spacecraft trajectory converge across geomagnetic field-lines into the acceleration region. It is shown how cross-field energy transport is facilitated by the formation of vortices along the length of the arc. From an integration over the vertical extent of the acceleration region it is shown that the transverse and field-aligned flow of energy into the arc locally supports the dissipation needed to power the electron acceleration observed. Estimates of gradients in electromagnetic and kinetic energy flows show how field-aligned electron energization in the acceleration region is supported by the divergence of Poynting flux along and across the background magnetic field.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY

Systematic analysis of melt pool dynamics in laser processing of mixed powder feedstocks

Functionally graded materials (FGMs) fabricated via additive manufacturing of blended powders offer the potential to spatially tailor properties for new technologies, such as fusion first-wall systems, turbine blades, and spacecraft. However, processing these materials is difficult due to the multiplicity of processing parameters to optimize, all of which must be changed as substrate material, powder feedstock compositions, and melt pool dynamics evolve. Here, this work systematically evaluates the qualitative and quantitative effects of these variables on the melt pool size, shape, composition, and particle distribution in an exemplar Ti-Ta system, and connects the experimental results to Marangoni flow behavior and phenomena observed in other systems. Increasing laser power linearly increases melt pool size and layer thickness, driving engineering considerations such as part/geometrical tolerances. Decreasing laser velocity changes the melt pool shape from lenticular to convex and reduces chemical homogeneity due to extreme thermal and compositional gradients between the melt pool center and boundaries. Thermophysical property differences between the powder feedstock and substrate material, as well as the directionality of the gradient, affect dilution and melt pool dynamics, which in turn affect the melt pool boundary characteristics, shape, and uniformity. Mixed powder feedstocks of intermediate compositions do not behave according to linear interpolations between single-material endpoints, instead building taller and wider melt pools. As such, it is recommended to quantify process maps for at least one intermediate composition in the FGM or multi-material system of interest to ensure optimized processing parameters, predictable melt pool sizes and shapes, and compositional and spatial precision.

Dissimilar

Turbulence, Waves, and Taylor’s Hypothesis for Heliosheath Observations

Magnetic field fluctuations measured in the heliosheath by the Voyager spacecraft are often characterized as compressible, as indicated by a strong fluctuating component parallel to the mean magnetic field. However, the interpretation of the turbulence data faces the caveat that the standard Taylor’s hypothesis is invalid because the solar wind flow velocity in the heliosheath becomes subsonic and slower than the fast magnetosonic speed, given the contributions from hot pickup ions (PUIs) in the heliosheath. We attempt to overcome this caveat by introducing a 4D frequency-wavenumber spectral modeling of turbulence, which is essentially a decomposition of different wave modes following their respective dispersion relations. Isotropic Alfvén and fast mode turbulence are considered to represent the heliosheath fluctuations. We also include two dispersive fast wave modes derived from a three-fluid theory. We find that (1) magnetic fluctuations in the inner heliosheath are less compressible than previously thought, an isotropic turbulence spectral model with about 25% in compressible fluctuation power is consistent with the observed magnetic compressibility in the heliosheath; (2) the hot PUI component and the relatively cold solar wind ions induce two dispersive fast magnetosonic wave branches in the perpendicular propagation limit, PUI fast wave may account for the spectral bump near the proton gyrofrequency in the observable spectrum; (3) it is possible that the turbulence wavenumber spectrum is not Kolmogorov-like although the observed frequency spectrum has a −5/3 power-law index, depending on the partitioning of power among the various wave modes, and this partitioning may change with wavenumber.

79 ASTRONOMY AND ASTROPHYSICS

Acoustic waves from the 2023 April 20 SpaceX Starship rocket explosion travelling in the elevated ‘AtmoSOFAR’ channel

SUMMARY The ability to detect low-frequency sounds from distant energetic events depends on the temperature and wind structure of the atmosphere. Thus, from time to time surface-based acoustic detectors may not be able to capture sounds arriving from certain directions. However, the temperature minimum at the tropopause may create an acoustic duct called the ‘AtmoSOFAR’ channel that could transmit acoustic waves laterally—but perhaps not to the ground. If true, then elevated sensors such as those borne aloft by balloons would record the signatures even in regions where ground-based sensors cannot. This has been difficult to prove because high altitude acoustic sources are rare and balloon deployments are sporadic. This work describes the detection and characterization of powerful acoustic waves generated during the launch and terminal explosion of the SpaceX Starship rocket on 2023 April 20 using a pair of microbarometers on a stratospheric balloon. The signals travelled through the AtmoSOFAR channel, carrying information about the size and nature of their source. This channel also appears to leak some acoustic energy to the ground, in agreement with previous studies. The acoustic yield of the Starship terminal explosion was on the order of $10^3$ tons trinitrotoluene equivalent, which agrees with the estimated fuel load of the vehicle to about a factor of 2, but is two orders of magnitude larger than optical estimates. These results support an earlier study that claimed lateral transmission of sound from a smaller rocket through the AtmoSOFAR channel. The transmission of source information through the AtmoSOFAR channel motivates its use for monitoring other natural and anthropogenic events using balloon-borne sensors. This may become increasingly important as more and more private and government entities conduct spacecraft launches and reentries. It may also provide a means of monitoring clear air turbulence and other sound-generating atmospheric phenomena at a distance.

58 GEOSCIENCES

Extreme Heating of Minor Ions in Imbalanced Solar-wind Turbulence

Minor ions in the solar corona are heated to extreme temperatures, far in excess of those of the electrons and protons that comprise the bulk of the plasma. These highly nonthermal distributions make minor ions sensitive probes of the collisionless processes that heat the corona and power the solar wind. The recent discovery of the "helicity barrier" offers a mechanism in which imbalanced Alfvénic turbulence in low-β plasmas preferentially heats protons over electrons, generating high-frequency, proton-cyclotron-resonant fluctuations. We use the hybrid-kinetic particle-in-cell code Pegasus++ to drive imbalanced Alfvénic turbulence in a 3D low-β plasma with additional passive ion species, He 2+ and O 5+ . A helicity barrier naturally develops, followed by clear phase-space signatures of oblique proton-cyclotron-wave heating and Landau-resonant heating from the imbalanced Alfvénic fluctuations. The former results in characteristically arced ion velocity distribution functions, whose non-bi-Maxwellian features are shown by linear ALPS calculations to be critical to the heating process. Additional features include a steep transition-range electromagnetic spectrum, proton-cyclotron waves propagating in the direction of the imbalance, significantly enhanced proton-to-electron heating ratios, ion temperatures that are considerably more perpendicular with respect to magnetic field, and extreme heating of heavier species in a manner consistent with mass scalings inferred from spacecraft measurements. None of these features are realized in an otherwise equivalent simulation of balanced turbulence. If seen simultaneously in the fast solar wind, these signatures of the helicity barrier would testify to the necessity of incorporating turbulence imbalance in a complete theory for the evolution of the solar wind.

79 ASTRONOMY AND ASTROPHYSICS

Space environment considerations for perovskite solar cell operations: A review

Designing new technology for extraterrestrial applications certainly presents unique challenges. The environmental stressors perovskite-based photovoltaics must overcome will vary with the environment in which they are deployed. One must consider mission requirements when designing photovoltaic devices and packaging. Different space "theaters" can have dramatically different stressors needing consideration for designing panels for solar power generation. Here, in this article, we review the relevant space environmental conditions that must be considered when designing perovskite-based photovoltaic devices for implementation in space. We specifically consider thermal, radiation, gaseous, weather, and other phenomena most relevant to photovoltaic operation for specific theaters such as Low Earth Orbit, Geosynchronous Orbit, Lunar surface, Mars (orbit and surface), and interplanetary exploration pathways.

14 SOLAR ENERGY