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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 631 records · Page 35

The Peridigm Meshfree Peridynamics Code

Abstract Peridigm is a meshfree peridynamics code written in C++ for use on large-scale parallel computers. It was originally developed at Sandia National Laboratories and is currently managed as an open-source, community driven software project. Its primary features include bond-based, state-based, and non-ordinary state-based constitutive models, bond failure laws, contact, and support for explicit and implicit time integration. To date, Peridigm has been used primarily by methods developers focused on solid mechanics and material failure. Peridigm utilizes foundational software components from Sandia’s Trilinos project and was designed for extensibility. This paper provides an overview of the solution methods implemented in Peridigm , a discussion of its software infrastructure, and demonstrates the use of Peridigm for the solution of several example problems.

97 MATHEMATICS AND COMPUTING↗

MOOSE-based Tritium Migration Analysis Program, Version 8 (TMAP8) for advanced open-source tritium transport and fuel cycle modeling

Tritium management is critical for the safety, sustainability, and economics of fusion energy systems, and advanced and reliable modeling tools help accelerate the development of tritium technologies. This paper presents the Tritium Migration Analysis Program, Version 8 (TMAP8), an open-source, MOOSE-based application developed to provide state-of-the-art tritium transport and fuel cycle modeling capabilities. TMAP8 aims to expand the capabilities of previous versions (i.e., TMAP4 and TMAP7) by leveraging modern computational techniques, ensuring high software quality assurance standards (key to building trust), and enabling multispecies, multiscale, and multiphysics simulations for integrated tritium transport modeling in complex geometries. This paper outlines TMAP8’s scope and rigorous development practices, emphasizing its transparency, accessibility, modularity, and reliability. We present the current suite of verification and validation cases based on those from TMAP4, demonstrating TMAP8’s accuracy and reliability against analytical solutions and experimental data. Additionally, the paper showcases TMAP8’s integrated fuel cycle modeling capabilities, highlighting its applicability at various scales and levels. The TMAP8 code and documentation are openly available, promoting collaborative development and widespread adoption within the fusion community. Future work will soon expand TMAP8’s verification and validation suite to include those from TMAP7 and other recent experimental studies for validation.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

A state-of-the-art review of experimental and computational studies of granular materials: Properties, advances, challenges, and future directions

Modeling of heterogeneous materials and media is a problem of fundamental importance to a wide class of phenomena and systems, ranging from condensed matter physics, soft materials, and composite media to porous media, biological systems, geosystems, ceramic engineering, pharmaceutical science and even in space discoveries. Among the most important materials are granular systems, which have received intense interest from the engineering, physics, and mathematics communities. In this review paper, the recent developments and new advances in experimental, and computational methods on a variety of scales and physics that extend understanding to a wide range of materials and phenomena are reviewed. Experimental advances include computed neutron and nanometer-scale tomography, magnetic resonance imaging, refractive index matching, digital image correlation, acoustic emission analysis, and the most recent 4D techniques. Furthermore, a tremendous shift has occurred from the continuum scale to micro-scale and developing multiscale approaches. As such, various computational methods, including, constitutive modeling, discrete modeling, and multiscale approaches, have been developed. In conclusion, aside from all these evolutions, more complicated modeling called coupled, or multiphysics, systems representing a simultaneous presence of heat, fluid, chemical variation, and mechanical effect are also explored.

36 MATERIALS SCIENCE↗

Seasonal Evolution of Canopy Stomatal Conductance for a Prairie and Maize Field in the Midwestern United States from Continuous Carbonyl Sulfide Fluxes

Abstract There are inherent challenges in scaling stomatal conductance (g ) from leaf to canopy particularly over seasonal time scales when species distribution and canopy structure evolve. We address this gap using carbonyl sulfide (OCS) and CO fluxes from a predominantly C3 prairie and C4 maize field in the midwestern United States. The g derived from OCS fluxes captured a transition in the stomatal limitation on gross primary productivity (GPP) through the growing season as well as seasonally persistent g dynamics such as temperature optimum and a positive response of nighttime g to vapor pressure deficit. Near the termination of the prairie growing season, we observed a decrease in the relative OCS to CO flux that we hypothesize emerged from a rising contribution of C4 plants to productivity. The results show how plot‐scale OCS and CO fluxes can be used as a trace gas diagnostic for transitions in the limiting factors for community GPP.

Berkelhammer, M.↗

Dynamic soil columns simulate Arctic redox biogeochemistry and carbon release during changes in water saturation

Thawing Arctic permafrost can induce hydrologic change and alter redox conditions, shifting the balance of soil organic matter (SOM) decomposition. There remains uncertainty about how soil saturation and redox transitions impact dissolved and gas phase carbon fluxes, and efforts to link hydrobiogeochemical processes to ecosystem-scale models are limited. This study evaluates SOM decomposition of Arctic tundra soils using column experiments, water chemistry measurements, microbial community analysis, and a PFLOTRAN reactive transport model. Soil columns from a thermokarst channel (TC) and an upland tundra (UC) were exposed to cycles of saturation and drainage, which controlled carbon emissions. During saturation, an outflow of dissolved organic carbon from the UC soil correlated with elevated reduced iron and decreased pH; during drainage, UC carbon dioxide fluxes were 70% higher than TC fluxes. Intermittent methane release was observed for TC, consistent with higher methanogen abundance. Slower drainage in the TC soil correlated with more subtle biogeochemical changes. PFLOTRAN simulations captured experimental trends in soil carbon fluxes, oxygen concentrations, and water contents. The model was then used to evaluate additional soil water drainage rates. This study emphasizes the importance of considering hydrologic change when evaluating and simulating SOM decomposition in dynamic Arctic tundra environments.

54 ENVIRONMENTAL SCIENCES↗

An updated LLVM-based quantum research compiler with further OpenQASM support

Abstract Quantum computing is a rapidly growing field with the potential to change how we solve previously intractable problems. Emerging hardware is approaching a complexity that requires increasingly sophisticated programming and control. Scaffold is an older quantum programming language that was originally designed for resource estimation for far-future, large quantum machines, and ScaffCC is the corresponding LLVM-based compiler. For the first time, we provide a full and complete overview of the language itself, the compiler as well as its pass structure. While previous works Abhari et al (2015 Parallel Comput. 45 2–17), Abhari et al (2012 Scaffold: quantum programming language https://cs.princeton.edu/research/techreps/TR-934-12 ), have piecemeal descriptions of different portions of this toolchain, we provide a more full and complete description in this paper. We also introduce updates to ScaffCC including conditional measurement and multidimensional qubit arrays designed to keep in step with modern quantum assembly languages, as well as an alternate toolchain targeted at maintaining correctness and low resource count for noisy-intermediate scale quantum (NISQ) machines, and compatibility with current versions of LLVM and Clang. Our goal is to provide the research community with a functional LLVM framework for quantum program analysis, optimization, and generation of executable code.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Terrestrial Very-Long-Baseline Atom Interferometry: summary of the second workshop

This summary of the second Terrestrial Very-Long-Baseline Atom Interferometry (TVLBAI) Workshop provides a comprehensive overview of our meeting held in London in April 2024 (Second Terrestrial Very-Long-Baseline Atom Interferometry Workshop, Imperial College, April 2024), building on the initial discussions during the inaugural workshop held at CERN in March 2023 (First Terrestrial Very-Long-Baseline Atom Interferometry Workshop, CERN, March 2023). Like the summary of the first workshop (Abend et al. in AVS Quantum Sci. 6:024701, 2024), this document records a critical milestone for the international atom interferometry community. It documents our concerted efforts to evaluate progress, address emerging challenges, and refine strategic directions for future large-scale atom interferometry projects. Our commitment to collaboration is manifested by the integration of diverse expertise and the coordination of international resources, all aimed at advancing the frontiers of atom interferometry physics and technology, as set out in a Memorandum of Understanding signed by over 50 institutions (Memorandum of Understanding for the Terrestrial Very Long Baseline Atom Interferometer Study).

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

ParaEMT (NLR's (formerly known as NREL's) EMT Simulator: An Open Source, and HPC-Compatible Large-Scale Power System Electro-Magnetic Transient (EMT) Simulator) [SWR-22-16]

This open-source tool aims to provide a powerful and flexible platform for simulating electromagnetic transients (EMT) of large-scale inverter-based resource (IBR)-dominated power systems. The purpose of making it open source is to foster a community of EMT simulation and assist in exploring new EMT algorithms and applying advanced computational techniques to EMT simulation.

Tan, Jin↗

The Polar System Analysis Package (Ver. 1 Specifications)

The Polar System Analysis Package (POLeSTAr) is a modern data fusion tool being designed to benchmark,evaluate and compare the polar physics and biogeochemistry of Earth System Models (ESMs). It is being written in Python to make use of libraries including Xarray, Matplotlib, SciPy, NumPy and PyTorch within algorithms developed specifically for polar system modeling. Initial POLeSTAr algorithms will be adapted from the MATLAB Ridgepack package that was designed to analyze the Model for Prediction Across Scales (MPAS) sea ice component of the Energy Exascale Earth System Model (E3SM) and sea ice model CICE within the Community Earth System Model (CESM).

97 MATHEMATICS AND COMPUTING↗

Connected Communities: A Multi-Building Energy Management Approach

Connected Communities (CCs) are collections of buildings and distributed energy resources (DERs) that incorporate integrated energy management strategies at the multi-building scale. Based on the research conducted for this report, RMI and NREL have identified examples of CCs that are enabling increasingly integrated solutions, sharing resources among buildings, and providing services back to the grid. As demonstrated by these examples, CCs can provide real and scalable solutions to mitigate energy costs, enable more flexibility in grid operations, and offer choices in meeting greenhouse gas (GHG) emissions goals. Nationwide examples of these solutions are included in the appendix of this report. In order to understand the most promising practices for the design, operation, and business models associated with CCs, a search was performed to create a nationwide inventory of CCs and multiple stakeholder interviews were conducted. Based on that research, this paper explores the many factors that influence the development and operation of CCs and evaluates their potential value.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Quantifying agricultural productive use of energy load in Sub-Saharan Africa and its impact on microgrid configurations and costs

The use of advanced energy technologies for agricultural purposes—such as irrigation, refrigeration, crop processing, and egg incubation—has the potential to increase crop yield, reduce vulnerability to changing precipitation patterns, increase shelf life, strengthen income and employment opportunities in rural areas, and reduce emissions by displacing fossil fuel-based technologies. These productive uses of energy (PUE) in remote areas could potentially be powered by microgrids that additionally serve otherwise unelectrified communities, most of which are located in rural Sub-Saharan Africa. Here, in this paper, we use high-resolution geospatial data to estimate the end-use electricity demand for a range of agricultural PUE across Sub-Saharan Africa, and we share these data in an open-access mapping tool. Next, we use REopt®, a techno-economic optimization model of energy systems, to determine the cost and system sizing implications of incorporating agricultural PUE into microgrid designs in Kenya and Zambia. We estimate the upper bound of agricultural PUE demand for irrigation, milling, shelling, refrigeration, and egg incubation across Sub-Saharan to be 16.8 TWh/yr. We find that incorporating local agricultural PUE into microgrid system designs increases the required system sizing while having minimal impact on the levelized cost of energy of these systems. Our analysis is the first to demonstrate the PUE potential in the agricultural sector at a 10x10-kilometer resolution across Sub-Saharan Africa and to show, at scale, how site-specific PUE can impact the cost and sizing of microgrids that are otherwise deployed to serve local household and community load.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Few-Shot Learning Enables Population-Scale Analysis of Leaf Traits in Populus trichocarpa

Plant phenotyping is typically a time-consuming and expensive endeavor, requiring large groups of researchers to meticulously measure biologically relevant plant traits, and is the main bottleneck in understanding plant adaptation and the genetic architecture underlying complex traits at population scale. In this work, we address these challenges by leveraging few-shot learning with convolutional neural networks to segment the leaf body and visible venation of 2,906 Populus trichocarpa leaf images obtained in the field. In contrast to previous methods, our approach (a) does not require experimental or image preprocessing, (b) uses the raw RGB images at full resolution, and (c) requires very few samples for training (e.g., just 8 images for vein segmentation). Traits relating to leaf morphology and vein topology are extracted from the resulting segmentations using traditional open-source image-processing tools, validated using real-world physical measurements, and used to conduct a genome-wide association study to identify genes controlling the traits. In this way, the current work is designed to provide the plant phenotyping community with (a) methods for fast and accurate image-based feature extraction that require minimal training data and (b) a new population-scale dataset, including 68 different leaf phenotypes, for domain scientists and machine learning researchers. All of the few-shot learning code, data, and results are made publicly available.

59 BASIC BIOLOGICAL SCIENCES↗

Geothermal Energy and Resilience in Arctic Countries

The eight Arctic countries - Iceland, Canada, Denmark (Greenland and the Faroe Islands) Norway, Sweden, Finland, Russia, and the United States (Alaska) - have diverse energy systems, but can be split into two distinct groups based on energy characteristics. The first group includes systems in Europe (Finland, Norway, Sweden, and Iceland), which are heavily grid-connected. The second group includes the United States (Alaska), Canada, Russia, and Greenland, which have grid-connected energy systems in their more densely populated southern regions, but are also defined by the prevalence of remote microgrids. Energy sources for heat and power vary across grid-connected communities in the Arctic nations. The primary energy source for remote communities, on the other hand, is almost exclusively diesel. This is true for both heat and power. Despite these and other key distinctions, Arctic countries share many commonalities with regard to their energy systems. One is a fundamental need for heat. Heat and electric energy are linked in most communities - remote, rural, and urban - and those linked systems are increasingly vulnerable to disruptions. Several of the Arctic countries use baseload renewable energy resources for heat and power. Iceland uses geothermal and hydroelectric; Canada, the United States, Sweden, Norway, and Finland use hydroelectric. Utilization of baseload renewable energy resources on-site for combined heat and power appears to enhance the resilience of communities in Arctic countries with high penetration of those resources. On the other hand, reliance on diesel by remote communities in other Arctic countries may be amplifying vulnerabilities. Although geothermal energy is currently used in all eight Arctic countries, resources are poorly mapped, and details can be difficult to come by. Despite this, geothermal energy provides heat and sometimes electricity at both utility scales and at the microgrid scale. Geothermal electricity is produced in Iceland, Russia, and the United States (Alaska). Direct use of geothermal heat is used in Iceland, Russia, United States, Canada, and Norway. Geo-exchange is used in Sweden, Finland, Norway, Canada, and the United States. In this paper, we reframe geothermal heat and power systems as integrated energy systems, asking the question: are integrated geothermal energy systems - where available and economic - resilient solutions for communities in Arctic countries? We identify resilience attributes of integrated geothermal energy systems, with a focus on microgrids and small-scale applications. Based on the high-level, qualitative analysis presented in this paper, the answer appears to be yes. Further work should prioritize refining our understanding of geothermal resources in Arctic countries, because development of the most economic geothermal resources in Arctic countries has the potential to enhance the energy resilience of its residents, whether in a grid-connected or remote off-grid context.

15 GEOTHERMAL ENERGY↗

Climate adaptation and sustainability in switchgrass: exploring plant-microbe-soil interactions across continental scale environmental gradients

Less carbon-intensive energy sources are needed to reduce greenhouse gas emissions and their predicted role in climate change. There is growing interest in the potential of biofuels for meeting this need. A critical question is whether large-scale biofuel production can be sustainable over the time scales needed to mitigate our carbon debt from fossil fuel consumption. The carbon balance and ultimately the sustainability of biofuel feedstock production is the result of complex climate-coupled interactions between carbon fixation, sequestration, and release through combustion. Similarly, the long-term productivity of biofuels depends on the environmental factors limiting plant growth. These factors are often related to soil resources which involve complex interactions at the plant-microbe-soil interface impacting their availability and cycling. Our collaborative project addressed sustainable switchgrass (Panicum virgatum) production by exploring Plant Systems, Plant-Microbiome Interactions, and Ecosystem Processes through the integrating lens of Multi-Scale Modeling. Our research was based on detailed characterization of genetically diverse switchgrass genotypes planted in common gardens across a continental latitudinal gradient. The underlying theme of our Plant Systems research was the use of locally adapted plant material to explore plant function, to understand the mechanistic basis of environmental interactions, and to discover the plant genes important for adaptation and sustainability in the face of climate change. Our Plant-Microbiome Interaction project characterized the microbial communities associated with switchgrass using genomic tools. Our Ecosystem Processes research focused on carbon cycle responses at the ecosystem level using stand level plantings. Finally, our Multi-Scale Modeling helped to define conditions of a sustainable biofuel system and identify key tradeoffs between genetic diversity, productivity, and ecosystem services. Genome-wide association analyses were used to identify alleles that contribute to successful establishment and biomass production across North America. Together, our work provided a baseline analyses of the potential of switchgrass as a biofuel feedstock. Our project resulted in a number of successful outcomes. First, we were successful in collecting switchgrass germplasm across the species range, propagating the material, and establishing common garden experiments across the species range. In collaboration with DOE JGI, we successfully assembled the first tetraploid switchgrass genome and published this resource with an analyses of the genetic basis local adaptation from our gardens (Lowry et al. 2019, Lovell et al. 2021). The gardens were used to characterize the genetic architecture for a number of important plant phenotypes. Our project also conducted extensive sampling and sequencing to characterize the bacterial and fungal associates of switchgrass roots and leaves. We showed that host genotype, location, and harvesting practices can play a role in microbiome assembly (Singer et al. 2019 & 2022, Van Wallendael et al. 2020 & 2022, Edwards et al. 2023). Our ecosystem processes work created baseline dataset of carbon and nutrient cycling in realistic stand plantings of switchgrass. Data from this experiment provided new insight into the role of plant traits, phenology, and local environments in ecosystem processes like soil respiration, net-ecosystem exchange, and dynamics of soil and plant nutrients (Ricketts et al. 2023). Finally, our crop modelling experiments help to characterize the sensitivity of common modeling frameworks to parameters, identify key limiters of productivity across large geographic scales, and leverage patterns of local adaptation in prediction. Ultimately, these studies help to identify critical plant-microbe-soil traits that may be manipulated, through breeding or agronomic management, to improve the sustainability of biofuel feedstocks.

09 BIOMASS FUELS↗

Past and present disturbances generate spatial variation in seed predation

Seed survival is a key process for plant populations; variation in the activity and abundance of animals that consume seeds can lead to dramatic shifts in seed fate. Because granivores may respond to contemporary disturbance as well as to enduring changes in habitats caused by past disturbances, understanding seed fate requires studies capable of evaluating how past and present disturbances modify granivore communities, foraging activity, and ultimately, seed predation. Historic agricultural land use and contemporary canopy harvesting are widespread disturbances that could generate large-scale patterns of seed fate by modifying environmental characteristics that determine granivore identity and behavior. Here, to evaluate whether land-use history and canopy harvesting affect seed–animal interactions, we conducted an experiment distributed across 80,000 ha of longleaf pine woodlands that coupled large-scale canopy harvesting at seven 4-ha sites containing both post-agricultural land use and nonagricultural land use in South Carolina, United States. We deployed a total of 28,000 nail-tagged seeds and recovered the tags to quantify seed fate. Past agricultural land use and contemporary canopy harvesting interacted to affect the rate of seed predation. Seed predation rates in harvested sites depended on land-use history: Seed predation was 30% lower in post-agricultural plots than in nonagricultural plots. This interaction was driven by the differential effect of land-use history and canopy harvesting on rodent activity. Camera traps revealed that Sigmodon hispidus only foraged in harvested plots and was most active in nonagricultural plots. In harvested plots, seed removal increased with S. hispidus activity. In unharvested plots, seed removal increased with Sciurus niger activity, but S. niger was not affected by land-use history. In finding that land-use history and canopy harvesting determine the outcomes of seed–animal interactions, we show that understanding patterns of seed predation is contingent upon the interplay of disturbances in both the distant past and recent past. These results suggest that patterns of past land use and present land use may help reconcile the considerable variation in seed fate observed in ecological communities.

60 APPLIED LIFE SCIENCES↗

Remote Sensing of Tundra Ecosystems Using High Spectral Resolution Reflectance: Opportunities and Challenges

Abstract Observing the environment in the vast regions of Earth through remote sensing platforms provides the tools to measure ecological dynamics. The Arctic tundra biome, one of the largest inaccessible terrestrial biomes on Earth, requires remote sensing across multiple spatial and temporal scales, from towers to satellites, particularly those equipped for imaging spectroscopy (IS). We describe a rationale for using IS derived from advances in our understanding of Arctic tundra vegetation communities and their interaction with the environment. To best leverage ongoing and forthcoming IS resources, including National Aeronautics and Space Administration’s Surface Biology and Geology mission, we identify a series of opportunities and challenges based on intrinsic spectral dimensionality analysis and a review of current data and literature that illustrates the unique attributes of the Arctic tundra biome. These opportunities and challenges include thematic vegetation mapping, complicated by low‐stature plants and very fine‐scale surface composition heterogeneity; development of scalable algorithms for retrieval of canopy and leaf traits; nuanced variation in vegetation growth and composition that complicates detection of long‐term trends; and rapid phenological changes across brief growing seasons that may go undetected due to low revisit frequency or be obscured by snow cover and clouds. We recommend improvements to future field campaigns and satellite missions, advocating for research that combines multi‐scale spectroscopy, from lab studies to satellites that enable frequent and continuous long‐term monitoring, to inform statistical and biophysical approaches to model vegetation dynamics.

54 ENVIRONMENTAL SCIENCES↗

Multifacets of lossy compression for scientific data in the Joint-Laboratory of Extreme Scale Computing

The Joint Laboratory on Extreme-Scale Computing (JLESC) was initiated at the same time lossy compression for scientific data became an important topic for the scientific communities. The teams involved in the JLESC played and are still playing an important role in developing the research, techniques, methods, and technologies making lossy compression for scientific data a key tool for scientists and engineers. Here, in this paper, we present the evolution of lossy compression for scientific data from 2015, describing the situation before the JLESC started, the evolution of this discipline in the past 8 years (until 2023) through the prism of the JLESC collaborations on this topic and some of the remaining open research questions.

Compression for AI↗

Quantum gravity phenomenology at the dawn of the multi-messenger era—A review

The exploration of the universe has recently entered a new era thanks to the multi-messenger paradigm, characterized by a continuous increase in the quantity and quality of experimental data that is obtained by the detection of the various cosmic messengers (photons, neutrinos, cosmic rays and gravitational waves) from numerous origins. They give us information about their sources in the universe and the properties of the intergalactic medium. Moreover, multi-messenger astronomy opens up the possibility to search for phenomenological signatures of quantum gravity. On the one hand, the most energetic events allow us to test our physical theories at energy regimes which are not directly accessible in accelerators; on the other hand, tiny effects in the propagation of very high energy particles could be amplified by cosmological distances. After decades of merely theoretical investigations, the possibility of obtaining phenomenological indications of Planck-scale effects is a revolutionary step in the quest for a quantum theory of gravity, but it requires cooperation between different communities of physicists (both theoretical and experimental). This review, prepared within the COST Action CA18108 “Quantum gravity phenomenology in the multi-messenger approach”, is aimed at promoting this cooperation by giving a state-of-the art account of the interdisciplinary expertise that is needed in the effective search of quantum gravity footprints in the production, propagation and detection of cosmic messengers.

79 ASTRONOMY AND ASTROPHYSICS↗