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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 649 records · Page 36
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Sizing Small-Scale Renewable Energy Systems for the Navajo Nation and Rural Communities

The Navajo Nation consists of about 55,000 residential homes spread across 27,000 square miles of trust land in the Southwest region of the United States. The Navajo Tribal Utility Authority (NTUA) reports that approximately 15,000 homes on the reservation do not have electricity due to the high costs of connecting rural homes located miles from utility distribution lines. In order to get these rural homeowners access electricity, NTUA and other Native owned companies are examining small-scale renewable energy systems to provide power for necessary usage such as lighting and refrigeration. The goal of this study is to evaluate the current renewable deployment efforts and provide additional considerations for photovoltaic (PV) systems that will optimize performance and improve efficiency to reduce costs. There are three case studies presented in different locations on the Navajo Nation with varying solar resource and energy load requirements. For each location, an assessment is completed that includes environmental parameters of the site- specific landscape and a system performance analysis of an off-grid residential PV system. The technical process, repeated for each location, demonstrates how the variance and uniqueness of each household can impact the system requirements after optimizations are applied. Therefore, the household variabilities and difference in locations must be considered. The differing results of each case study suggests additional analysis is needed for designing small-scale PV systems that takes a home-land-family specific approach to allow for better efficiency and more flexibility for future solar innovations to be considered for overall cost reductions.

14 SOLAR ENERGY↗
DOE OSTI2023

A deep learning upscaling framework: Reactive transport and mineral precipitation in fracture-matrix systems

Pore-scale modeling has limited applicability at large scales due to its high computational cost. One common approach to upscale pore-scale models is the use of effective medium theories, which homogenize small-scale features in a porous structure and characterize the medium by macroscale properties (e.g., permeability) and equations (e.g., Darcy’s law). However, there are classes of physical processes for which effective medium approximations may become inaccurate, e.g., mineral precipitation and clogging during reactive transport. We have developed a deep learning upscaling framework, in which pore-scale modeling is directly employed in macroscale systems, without relying on effective medium approximations. The upscaling framework is first developed for general multiscale systems and then applied to modeling reactive transport with mineral precipitation in the altered layer in fracture-matrix structures. Solute transport from the fractures to the matrix is modeled as a wall boundary condition for the fractures, which, in turn, is predicted by recurrent neural networks using the concentration histories at the fracture-matrix boundary. Specifically, we consider a meter-scale fracture network embedded in sandstones, where the smallest feature is at the micron scale. Here the proposed framework allows us to span five orders of magnitude in length scales by capturing mineral precipitation in the altered layer of the rock matrix at the pore scale across the entire meter-scale fracture network.

42 ENGINEERING↗
DOE OSTI2022

Evaluation of simulations of near-surface variables using the regional climate model CCLM for the MOSAiC winter period

The ship-based experiment MOSAiC 2019/2020 was carried out during a full year in the Arctic and yielded an excellent data set to test the parameterizations of ocean/sea-ice/atmosphere interaction processes in regional climate models (RCMs). In the present paper, near-surface data during MOSAiC are used for the verification of the RCM COnsortium for Small-scale MOdel–Climate Limited area Mode (COSMO-CLM or CCLM). CCLM is used in a forecast mode (nested in ERA5) for the whole Arctic with 15 km resolution and is run with different configurations of sea ice data. These include the standard sea ice concentration taken from passive microwave data with around 6 km resolution, sea ice concentration from Moderate Resolution Imaging Spectroradiometer (MODIS) thermal infrared data and MODIS sea ice lead fraction data for the winter period. CCLM simulations show a good agreement with the measurements. Relatively large negative biases for temperature occur for November and December, which are likely associated with a too large ice thickness used by CCLM. The consideration of sea ice leads in the sub-grid parameterization in CCLM yields improved results for the near-surface temperature. ERA5 data show a large warm bias of about 2.5°C and an underestimation of the temperature variability.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2020

Electrodeposition for Low-Cost, Water-Based Electrode Manufacturing. Research Performance Progress Report, Jan. 1, 2016 - Dec. 31, 2019

The viability of electrocoat to fabricate battery electrodes at commercially relevant formulations has been demonstrated using both bench-scale equipment and a small pilot-scale roll-to-roll system (mini-coater). Through this, we show that an electrodeposited lithium-ion battery electrode coating system and manufacturing process is capable of reducing cell costs. Specifically, >60% decrease in capital costs is expected when transitioning from slot-die to electrocoat-based coating systems due to the removal of a solvent recovery system. In addition, a 50% reduction in operating costs in also expected as we enable 2-coat/2-cure processing of cathode electrodes.

25 ENERGY STORAGE↗
DOE OSTI2023

Adaptive estimation of quantum observables

The accurate estimation of quantum observables is a critical task in science. With progress on the hardware, measuring a quantum system will become increasingly demanding, particularly for variational protocols that require extensive sampling. Here, we introduce a measurement scheme that adaptively modifies the estimator based on previously obtained data. Our algorithm, which we call AEQuO, continuously monitors both the estimated average and the associated error of the considered observable, and determines the next measurement step based on this information. We allow both for overlap and non-bitwise commutation relations in the subsets of Pauli operators that are simultaneously probed, thereby maximizing the amount of gathered information. AEQuO comes in two variants: a greedy bucket-filling algorithm with good performance for small problem instances, and a machine learning-based algorithm with more favorable scaling for larger instances. The measurement configuration determined by these subroutines is further post-processed in order to lower the error on the estimator. We test our protocol on chemistry Hamiltonians, for which AEQuO provides error estimates that improve on all state-of-the-art methods based on various grouping techniques or randomized measurements, thus greatly lowering the toll of measurements in current and future quantum applications.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Close-Space Sublimation-Deposited Ultra-Thin CdSeTe/CdTe Solar Cells for Enhanced Short-Circuit Current Density and Photoluminescence

This work describes the complete fabrication process of thin-absorber cadmium selenium telluride/cadmium telluride photovoltaic devices for enhanced efficiency. Here, the process utilizes an automated in-line vacuum system for close-space sublimation deposition which is scalable from fabrication of small area research devices to large-scale modules.

14 SOLAR ENERGY↗
DOE OSTI2022

Theory Techniques for Precision Physics -- Snowmass 2021 TF06 Topical Group Report

The wealth of experimental data collected at laboratory experiments suggests that there is some scale separation between the Standard Model (SM) and phenomena beyond the SM (BSM). New phenomena can manifest itself as small corrections to SM predictions, or as signals in processes where the SM predictions vanish or are exceedingly small. This makes precise calculations of the SM expectations essential, in order to maximize the sensitivity of current and forthcoming experiments to BSM physics. Here, this topical group report highlights some past and forthcoming theory developments critical for maximizing the sensitivity of the experimental program to understanding Nature at the shortest distances.

Boughezal, Radja↗
NASA NTRS1978

A three-dimensional model of corotating streams in the solar wind. 1: Theoretical foundations

The theoretical and mathematical background pertinent to the study of steady, corotating solar wind structure in all three spatial dimensions (3-D) is discussed. The dynamical evolution of the plasma in interplanetary space (defined as the region beyond roughly 35 solar radii where the flow is supersonic) is approximately described by the nonlinear, single fluid, polytropic (magneto-) hydrodynamic equations. Efficient numerical techniques for solving this complex system of coupled, hyperbolic partial differential equations are outlined. The formulation is inviscid and nonmagnetic, but methods allow for the potential inclusion of both features with only modest modifications. One simple, highly idealized, hydrodynamic model stream is examined to illustrate the fundamental processes involved in the 3-D dynamics of stream evolution. Spatial variations in the rotational stream interaction mechanism were found to produce small nonradial flows on a global scale that lead to the transport of mass, energy, and momentum away from regions of relative compression and into regions of relative rarefaction.

Pizzo, V. J.↗
NASA NTRS1992

System design from mission definition to flight validation

Considerations related to the engineering systems design process and an approach taken to introduce undergraduate students to that process are presented. The paper includes details on a particular capstone design course. This course is a team oriented aircraft design project which requires the students to participate in many phases of the system design process, from mission definition to validation of their design through flight testing. To accomplish this in a single course requires special types of flight vehicles. Relatively small-scale, remotely piloted vehicles have provided the class of aircraft considered in this course.

Batill, S. M.↗
NASA NTRS1992

Utilization of Geographic Information System in Lunar Mapping

Substantial digital remote sensing, lunar orbital photography, Earth-based remote sensing, and mapping of a variety of surficial lunar phenomena have occurred since the advent of the Space Age. This has led to a bewildering and quite disparate collection of archival sources insofar as this digital data and its cartographic representation can be found within many countries of the world. The importance of this mapping program in support of human expansion onto our nearest planetary neighbor has been recognized. A series of small scale maps of the Moon at 1 km to 1 cm, done with the support of Geographic Information System (GIS), would serve decision makers well in the process of accessing the development of manned occupance of the Moon. Maps and the data that they are derived from are the primary way in which people explore new environments and use previously discovered data to increase the bounties of any exploration. The inherent advantage of GIS is that it would allow immediate online access on the Moon of topographically represented data with analysis either on site or from Earth.

Mardon, A. A.↗
NASA NTRS2002

A Conceptual Design for a Reliable Optical Bus (ROBUS)

The Scalable Processor-Independent Design for Electromagnetic Resilience (SPIDER) is a new family of fault-tolerant architectures under development at NASA Langley Research Center (LaRC). The SPIDER is a general-purpose computational platform suitable for use in ultra-reliable embedded control applications. The design scales from a small configuration supporting a single aircraft function to a large distributed configuration capable of supporting several functions simultaneously. SPIDER consists of a collection of simplex processing elements communicating via a Reliable Optical Bus (ROBUS). The ROBUS is an ultra-reliable, time-division multiple access broadcast bus with strictly enforced write access (no babbling idiots) providing basic fault-tolerant services using formally verified fault-tolerance protocols including Interactive Consistency (Byzantine Agreement), Internal Clock Synchronization, and Distributed Diagnosis. The conceptual design of the ROBUS is presented in this paper including requirements, topology, protocols, and the block-level design. Verification activities, including the use of formal methods, are also discussed.

Miner, Paul S.↗
NASA NTRS2003

An Impact Ejecta Behavior Model for Small, Irregular Bodies

In recent years, spacecraft observations of asteroids 951 Gaspra, 243 Ida, 253 Mathilde, and 433 Eros have shown the overriding dominance of impact processes with regard to the structure and surface morphology of these small, irregular bodies. In particular, impact ejecta play an important role in regolith formation, ranging from small particles to large blocks, as well as surface feature modification and obscuration. To investigate these processes, a numerical model has been developed based upon the impact ejecta scaling laws provided by Housen, Schmidt, and Holsapple, and modified to more properly simulate the late-stage ejection velocities and ejecta plume shape changes (ejection angle variations) shown in impact cratering experiments. A target strength parameter has also been added to allow the simulation of strength-dominated cratering events in addition to the more familiar gravity-dominated cratering events. The result is a dynamical simulation which models -- via tracer particles -- the ejecta plume behavior, ejecta blanket placement, and impact crater area resulting from a specified impact on an irregularly shaped target body, which is modeled in 3-dimensional polygon fashion. This target body can be placed in a simple rotation state about one of its principal axes, with the impact site and projectile/target parameters selected by the user. The gravitational force from the irregular target body (on each tracer particle) is determined using the polygonized surface (polyhedron) gravity technique developed by Werner.

Richardson, J. E.↗
DOE OSTI2024

Acceleration of Graph Neural Network-Based Prediction Models in Chemistry via Co-Design Optimization on Intelligence Processing Units

Atomic structure prediction and associated property calculations are the bedrock of chemical physics. Since high-fidelity ab initio modeling techniques for computing the structure and properties can be prohibitively expensive, this motivates the development of machine-learning (ML) models that make these predictions more efficiently. Training graph neural networks over large atomistic databases introduces unique computational challenges such as the need to process millions of small graphs with variable size and support communication patterns that are distinct from learning over large graphs such as social networks. We demonstrate a novel hardware-software co-design approach to scale up the training of atomistic graph neural networks (GNN) for structure and property prediction. First, to eliminate redundant computation and memory associated with alternative padding techniques and to improve throughput via minimizing communication, we formulate the effective coalescing of the batches of variable-size atomistic graphs as the bin packing problem and introduce a hardware-agnostic algorithm to pack these batches. In addition, we propose hardware-specific optimizations including a planner and vectorization for the gather-scatter operations targeted for Graphcore’s Intelligence Processing Unit (IPU), as well as model-specific optimizations such as merged communication collectives and optimized softplus. Putting these all together, we demonstrate the effectiveness of the proposed co-design approach by providing an implementation of a well-established atomistic GNN on the Graphcore IPUs. We evaluate the training performance on multiple atomistic graph databases with varying degrees of graph counts, sizes and sparsity. Here, we demonstrate that such a co-design approach can reduce the training time of atomistic GNNs and can improve the performance by up to 1.5× compared to the baseline implementation of the model on the IPUs. Additionally, we compare our IPU implementation with a Nvidia GPU-based implementation and show that our atomistic GNN implementation on the IPUs can run 1.8× faster on average compared to the execution time on the GPUs.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1992

CI chondrite-like clasts in the Nilpena polymict ureilite - Implications for aqueous alteration processes in CI chondrites

Petrographic studies of Nilpena polymict ureilite have revealed the presence of small quantities of carbonaceous chondrite matrix clasts. Detailed electron microprobe and TEM studies show that the chemistry and fine-scale mineralogy of one of these clasts is consistent with CI carbonaceous chondrite matrix. Compared to Orgeuil, the phyllosilicate, sulfide, and oxide mineralogy suggests that the Nilpena clasts may represent a less altered type of CI matrix. It is suggested that increased oxidation and aqueous alteration of Nilpena-type materials could result in the formation of the type of mineral assemblage observed in Orgueil. Increased alteration produces progressive more Mg-rich phyllosilicates and more Fe(3+)-rich iron oxides, such as ferrihydrite. As a function of increased alteration, Ca is also progressively leached from the matrix material to form carbonate veins. The depletion of Ca in CI chondrite matrices suggests the Ivuna and Alais may be intermediate in their degree of alteration to Nilpena and Orgueil.

Brearley, Adrian J.↗
NASA NTRS1991

Static and dynamical Meissner force fields

The coupling between copper-based high temperature superconductors (HTS) and magnets is represented by a force field. Zero-field cooled experiments were performed with several forms of superconductors: 1) cold-pressed sintered cylindrical disks; 2) small particles fixed in epoxy polymers; and 3) small particles suspended in hydrocarbon waxes. Using magnets with axial field symmetries, direct spatial force measurements in the range of 0.1 to 10(exp 4) dynes were performed with an analytical balance and force constants were obtained from mechanical vibrational resonances. Force constants increase dramatically with decreasing spatial displacement. The force field displays a strong temperature dependence between 20 and 90 K and decreases exponentially with increasing distance of separation. Distinct slope changes suggest the presence of B-field and temperature-activated processes that define the forces. Hysteresis measurements indicated that the magnitude of force scales roughly with the volume fraction of HTS in composite structures. Thus, the net force resulting from the field interaction appears to arise from regions as small or smaller than the grain size and does not depend on contiguous electron transport over large areas. Results of these experiments are discussed.

Weinberger, B. R.↗
DOE OSTI2021

Exploring QCD Factorization at Moderate Energy Scales

Asymptotic freedom in QCD facilitates the use of partonic degrees of freedom over short distances, but physical processes are sensitive to a wide range of scales. Thus, it is necessary in QCD calculations to utilize a factorization scheme to separate a process into perturbative and non-perturbative factors. This separation relies on an assumption that one energy scale is infinitely larger than the other scales involved in the process. However, much experimental research in areas such as nucleon structure and quark-hadron duality occur at more moderate energy scales where that basic assumption may not be true but perturbative calculations should still be useful. Thus, an exploration of the limits of factorization at more moderate energy scales is needed. This dissertation examines various aspects of factorization at these energy scales first by applying the necessary approximations to a simple model where exact calculations are possible and so the effects of these approximations can be quantified. This is followed by examining areas where corrections are known to be needed. First is an exploration of target mass corrections (TMCs) in the case of deep inelastic scattering (DIS), including a discussion of what large corrections imply about the target structure. Second, is a general examination of PDFs and FFs at moderate scales. Third, I will discuss how this fits into the long-term effort to study the transition between small transverse momentum (generated non-perturbatively) and large transverse momentum (generated in the hard process)

Moffat, Eric↗
DOE OSTI2025

Impact of melt viscosity on filler dispersion in elastomeric nanocomposites

Compounding of commercial nanocomposites usually involves the addition of viscosity enhancers such as binder resins in ink jet inks, and paints. Contrary to this, plasticizers such as process oils are added to reduce the melt viscosity and ease processability of reinforced elastomers. Nanofillers such as silica and carbon black are typically added to reinforce rubber and enhance performance of automotive tire treads. Filler dispersion has traditionally been qualitatively (indirectly) assessed by measuring the properties of reinforced elastomers. While dispersion can be quantified by examining filler agglomeration through surface roughness measurements and microscopy, the size-scale dependence for these hierarchical fillers has usually been ignored. Here, we have recently devised a method to quantify nano-scale dispersion of fillers using Ultra small-angle X-ray scattering (USAXS) techniques. This method is advantageous since it directly links the controllable processing/compounding parameters such as the mixing speed, mixer geometry, residence time (or mixing duration), melt density, flow gap distance, and melt viscosity to nano-scale dispersion. While our previous studies have explored the impact of different processing parameters, this study specifically investigates the impact of melt viscosity on nano-scale filler dispersion in elastomer compounds. Commercially available polybutadienes with different Mooney viscosities were used in conjunction with different grades and amounts of process oils to modify the melt viscosity.

Carbon black↗
DOE OSTI2020

Probing the Local Site Disorder and Distortion in Pyrochlore High-Entropy Oxides

High-entropy oxides (HEOs) have attracted great interest in diverse fields because of their inherent opportunities to tailor and combine materials functionalities. The control of local order/disorder in the class is by extension a grand challenge toward realizing their vast potential. In this paper, we report the first examples of pyrochlore HEOs with five M-site cations, for Nd 2 M 2 O 7 , in which the local structure has been investigated by neutron diffraction and pair distribution function (PDF) analysis. The average structure of the pyrochlores is found to be orthorhombic Imma, in agreement with radius-ratio rules governing the structural archetype. The computed PDFs from density functional theory relaxed special quasirandom structure models are compared with real space PDFs in this work to evaluate M-site order/disorder. Reverse Monte Carlo combined with ab initio molecular dynamics and Metropolis Monte Carlo simulations demonstrates that Nd 2 (Ta 0.2 Sc 0.2 Sn 0.2 Hf 0.2 Zr 0.2 ) 2 O 7 is synthesized with its M-site local to nanoscale order highly randomized/disordered, while Nd 2 (Ti 0.2 Nb 0.2 Sn 0.2 Hf 0.2 Zr 0.2 ) 2 O 7+x exhibits a strong distortion of the TiO 6 octahedron and small degree of Ti chemical short-range order (SRO) on the subnanometer scale. Calculations suggest that this may be intrinsic, energetically favored SRO rather than due to sample processing. These results offer an important demonstration that the engineered variation of participating ions in HEOs, even among those with very similar radii, provides richly diverse opportunities to control local order/disorder motifs—and therefore materials properties for future designs. This work also hints at the exquisite level of detail that may be needed in computational and experimental data analysis to guide structure–property tuning in the emerging HEO materials class.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗