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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 1,441 records · Page 80

Flame aerosol synthesis of hollow alumina nanoshells for application in thermal insulation

Commercial implementation of hollow nanoshell materials is often limited by difficult scale-up and high cost. Here we present a scalable, continuous, and potentially low-cost route to hollow nanostructured materials using a High Temperature Reducing Jet flame aerosol reactor. The key advantage of this process over traditional flame aerosol synthesis methods is separation of flame chemistry and particle formation, which allows production of hollow nanoshells from an aqueous salt solution without any template or surfactant. We produced amorphous hollow alumina with an average diameter of 181 nm and shell thickness below 10 nm, and demonstrated the generality of the method by also producing hollow SiO 2 , ZrO 2 , Ga 2 O 3 , and Co 2 O 3 . We characterized the morphology, phase transition, thermal stability, and thermal conductivity of the flame-made hollow alumina by electron microscopy, x-ray diffraction, and thermal analysis methods. As a prototypical application, we incorporated hollow alumina into thermal insulation, combining it with common fiberglass insulation to reduce the thermal conductivity by 30% relative to pure fiberglass, to 0.028 W m -1 K -1 while maintaining robust fire-resistance and elasticity.

36 MATERIALS SCIENCE↗

Development of a web-based screening tool for ground source heat pump applications

Ground source heat pump (GSHP) technology has great potential to help the nation meet its energy and decarbonization goals, but several barriers hinder the wide application of GSHP. Important barriers include the lack of a coherent toolset for analyzing the technical feasibility and economic viability of the GSHP application. The current design and analysis methods are ineffective and require significant expertise to apply. Although building energy modeling is increasingly important in designing buildings, the tools for GSHP modeling and simulation are lacking. A web-based free-to-use tool is being developed for quick techno-economic analysis of GSHP applications in nearly any building in the United States. This tool is enabled by improvements in the calculation methodology to allow rapid sizing of borehole configurations that provide significant cost savings. The screening tool currently uses US Department of Energy (DOE) prototype building models and an extended g-function library to size ground heat exchangers and simulate the performance of GSHP systems. The team is integrating with DOE's Oak Ridge National Laboratory's AutoBEM program to automatically create a building model based on user inputs. This paper introduces the structure, components, features, and results of the web-based screening tool for GSHP applications. Future directions for further developing the tool are also discussed.

Liu, Xiaobing↗

Exploring Telematics Big Data for Truck Platooning Opportunities

NREL completed a temporal and geospatial analysis of telematics data to estimate the fraction of platoonable miles traveled by class 8 tractor trailers currently in operation. This paper discusses the value and limitations of very large but low time-resolution data sets, and the fuel consumption reduction opportunities from large scale adoption of platooning technology for class 8 highway vehicles in the US based on telematics data. The telematics data set consist of about 57,000 unique vehicles traveling over 210 million miles combined during a two-week period. 75% of the total fuel consumption result from vehicles operating in top gear, suggesting heavy highway utilization. The data is at a one-hour resolution, resulting in a significant fraction of data be uncategorizable, yet significant value can still be extracted from the remaining data. Multiple analysis methods to estimate platoonable miles are discussed. Results indicate that 63% of total miles driven at known hourly-average speeds happens at speeds amenable to platooning. When also considering availability of nearby partner vehicles, results indicate 55.7% of all classifiable miles driven were platoonable. Analysis also address the availability of numerous partners enabling platoons greater than 2 trucks and the percentage of trucks that would be required to be equipped with platooning equipment to realize more than 50% of the possible savings.

33 ADVANCED PROPULSION SYSTEMS↗

CORSS: Cylinder Optimization of Rings, Skin, and Stringers

Launch vehicle designs typically make extensive use of cylindrical skin stringer construction. Structural analysis methods are well developed for preliminary design of this type of construction. This report describes an automated, iterative method to obtain a minimum weight preliminary design. Structural optimization has been researched extensively, and various programs have been written for this purpose. Their complexity and ease of use depends on their generality, the failure modes considered, the methodology used, and the rigor of the analysis performed. This computer program employs closed-form solutions from a variety of well-known structural analysis references and joins them with a commercially available numerical optimizer called the 'Design Optimization Tool' (DOT). Any ring and stringer stiffened shell structure of isotropic materials that has beam type loading can be analyzed. Plasticity effects are not included. It performs a more limited analysis than programs such as PANDA, but it provides an easy and useful preliminary design tool for a large class of structures. This report briefly describes the optimization theory, outlines the development and use of the program, and describes the analysis techniques that are used. Examples of program input and output, as well as the listing of the analysis routines, are included.

Finckenor, J.↗

AMSS

SAND2022-12902 O The Automated Method Selection Software (AMSS) is a chromatographic prediction tool based on the previously published BioCompound Machine Learning (BCML) tool. AMSS uses PubChem ID as input for molecule information such as SMILES and physical and chemical properties. The model is used to predict the best chromatography analysis method for testing compounds. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology & Engineering Solutions of Sandia, LLC, a wholly owned subsidiary of Honeywell International Inc., for the U.S. Department of Energy’s National Nuclear Security Administration under contract DE-NA0003525.

Poorey, Kunal↗

SSME structural dynamic model development, phase 2

A set of test correlated mathematical models of the SSME High Pressure Oxygen Turbopump (HPOTP) housing and rotor assembly was produced. New analysis methods within the EISI/EAL and SPAR systems were investigated and runstreams for future use were developed. The LOX pump models have undergone extensive modification since the first phase of this effort was completed. The rotor assembly from the original model was abandoned and a new, more detailed model constructed. A description of the new rotor math model is presented. Also, the pump housing model was continually modified as additional test data have become available. This model is documented along with measured test results. Many of the more advanced features of the EAL/SPAR finite element analysis system were exercised. These included the cyclic symmetry option, the macro-element procedures, and the fluid analysis capability. In addition, a new tool was developed that allows an automated analysis of a disjoint structure in terms of its component modes. A complete description of the implementation of the Craig-Bampton method is given along with two worked examples.

Foley, M. J.↗

Multidimensional visualization of the dynamic evolution of Li metal via in situ/operando methods

The growing demands for high-energy density electrical energy storage devices stimulate the coupling of conversion-type cathodes and lithium (Li) metal anodes. While promising, the use of these “Li-free” cathodes brings new challenges to the Li anode interface, as Li needs to be dissolved first during cell operation. In this study, we have achieved a direct visualization and comprehensive analysis of the dynamic evolution of the Li interface. The critical metrics of the interfacial resistance, Li growth, and solid electrolyte interface (SEI) distribution during the initial dissolution/deposition processes were systematically investigated by employing multidimensional analysis methods. They include three-electrode impedance tests, in situ atomic force microscopy, scanning electrochemical microscopy, and cryogenic scanning transmission electron microscopy. The high-resolution imaging and real-time observations show that a loose, diffuse, and unevenly distributed SEI is formed during the initial dissolution process. This leads to the dramatically fast growth of Li during the subsequent deposition, deviating from Fick’s law, which exacerbates the interfacial impedance. The compactness of the interfacial structure and enrichment of electrolyte species at the surface during the initial deposition play critical roles in the long-term stability of Li anodes, as revealed by operando confocal Raman spectroscopic mapping. In conclusion, our observations relate to ion transfer, morphological and structural evolution, and Li (de)solvation at Li interfaces, revealing the underlying pathways influenced by the initial dissolution process, which promotes a reconsideration of anode investigations and effective protection strategies.

25 ENERGY STORAGE↗

X-ray computed tomography-based porosity analysis: Algorithms and application for porous woody biomass

The properties of lignocellulosic biomass, such as bulk physical, thermal, and mechanical properties, as well as the mobility of enzymes or catalysts, are largely affected by porosity, pore structures, and pore size distribution. While X-ray computed tomography (CT) has been introduced to effectively produce 3D volumetric images of material microstructure, a quantitative porosity analysis from the 3D images has never been done. This work introduces a first-of-its-kind X-ray CT-based quantitative porosity analysis method and applies the developed toolkit to characterize the internal porosity distribution of loblolly pine. A sample loblolly pine chip was scanned by a nano-resolution X-ray CT system and digitally reconstructed after a sequence of image processing operations. Here, a comprehensive porosity analysis was then performed to quantify the envelope porosity, the spatial distribution of local porosity, and the directional porosity. Solutions to the various challenges in image processing, porosity calculation, and large data handling are provided.

42 ENGINEERING↗

Quasiharmonic analysis of protein energy landscapes from pressure-temperature molecular dynamics simulations

Positional fluctuations of an atom in a protein can be described as motion in an effective local energy minimum created by the surrounding protein atoms. The dependence of atomic fluctuations on both temperature (T) and pressure (P) has been used to probe the nature of these minima, which are generally described as harmonic in experiments such as x-ray crystallography and neutron scattering. Here, a quasiharmonic analysis method is presented in which the P-T dependence of atomic fluctuations is in terms of an intrinsic isobaric thermal expansivity αP and an intrinsic isothermal compressibility κT. The method is tested on previously reported mean-square displacements from P-T molecular dynamics simulations of lysozyme, which were interpreted to have a pressure-independent dynamical transition Tg near 200 K and a change in the pressure dependence near 480 MPa. Our quasiharmonic analysis of the same data shows that the P-T dependence can be described in terms of αP and κT where below Tg, the temperature dependence is frozen at the Tg value. In addition, the purported transition at 480 MPa is reinterpreted as a consequence of the pressure dependence of Tg and the quasiharmonic frequencies. The former also indicates that barrier heights between substates are pressure dependent in these data. Furthermore, the insights gained from this quasiharmonic analysis, which was of the energy landscape near the native state of a protein, suggest that similar analyses of other simulations may be useful in understanding such phenomena as pressure-induced protein unfolding.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Clustering Analysis of Commercial Vehicles Using Automatically Extracted Features from Time Series Data

Standard of practice approaches to time series cluster analysis involve careful feature engineering, often utilizing expert input to tune and select features by hand. In many cases, expert input may not be readily available, or there may not yet exist a community consensus on the ideal features for a given application. This paper compares the results of several cluster analysis methods, using both hand selected features and those extracted automatically, when applied to large geospatial time series telematics data from commercial trucking fleets. The impacts of feature selection, dimensionality reduction, and choice of clustering algorithm on the quality of clustering results are explored. Results from this analysis confirm prior results that domain agnostic features are competitive with the hand engineered features with respect to clustering quality metrics. These results also provide new insight into the most successful strategies for identifying structure in large unstructured vehicle telematics data, and suggest that time series clustering using automatic feature extraction can be an effective approach to extract structure from large scale geospatial time series data in cases when hand selected features are not available.

33 ADVANCED PROPULSION SYSTEMS↗

Statistical Analysis in Support of Fuel Temperature Control in the Advanced Gas Reactor Experiments

There are four completed tests among a series of Advanced Gas Reactor (AGR) irradiation experiments that are being conducted within the Advanced Reactor Technologies (ART) Fuel Development and Qualification Program. The main objectives of the fuel experimental campaigns are to provide the necessary data on fuel performance to support fuel process development, qualify a fuel design and fabrication process for normal operation and hypothetical accident conditions, and support development and validation of fuel performance and fission product transport models and codes. Since this tri-structural isotropic fuel is qualified to be used in high temperature gas-cooled reactors (HTGRs), it is essential that the testing conditions of fuel irradiations are designed to mimic those in the conceptual gas reactors. As a result, temperatures of the AGR test fuel have to be maintained within a specified range that is typical of the HTGRs. In each AGR capsule, the test fuel temperature is controlled independently using a variable fraction neon and helium gas mixture that fills the gap volume for each capsule. The temperature as measured by a thermocouple (TC) terminated in the graphite holder (which houses fuel compacts) is used as a feedback for the gas flow controllers. Direct temperature measurement for fuel compacts is not possible because contact between a TC head and fuel particle could lead to undesirable failures. Therefore, an ABAQUS-based finite element thermal model was created to predict the daily average fuel temperatures during the entire irradiation period. It is well-known that extended exposure to neutron irradiation and high temperatures leads to changes in geometries of fuel compacts and graphite holder, which results in changes of the gas gap, leading to a change in the relationship between TC and fuel temperatures. In addition, TCs are expected to drift and sometimes fail under irradiation conditions. These facts make maintaining test fuel temperature within a specified range challenging. This paper describes how the regression analysis methods are used in conjunction with calculated fuel temperatures from early irradiation periods (when the irradiation effect is relatively small) to effectively control fuel temperature for the remaining irradiation (when the irradiation effect became profound). This is particularly important in the event when all TCs in a capsule fail.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Recent developments in quasi-Newton methods for structural analysis and synthesis

Unlike the Newton-Raphson method, quasi-Newton methods by virture of the updates and step length control procedures are globally convergent and hence better suited for the solution of nonlinear problems of structural analysis and synthesis. Extension of quasi-Newton algorithms to large scale problems has led to the development of sparse update algorithms and to economical strategies for evaluating sparse Hessians. Ill-conditioning problems have led to the development of self-scaled variable metric and conjugate gradient algorithms, as well as the use of the singular perturbation theory. This paper emphasizes the effectiveness of such quasi-Newton algorithms for nonlinear structural analysis and synthesis.

Kamat, M. P.↗

SpotSDC: Revealing the Silent Data Corruption Propagation in High-Performance Computing Systems

We report the trend of rapid technology scaling is expected to make the hardware of high-performance computing (HPC) systems more susceptible to computational errors due to random bit flips. Some bit flips may cause a program to crash or have a minimal effect on the output, but others may lead to silent data corruption (SDC), i.e., undetected yet significant output errors. Classical fault injection analysis methods employ uniform sampling of random bit flips during program execution to derive a statistical resiliency profile. However, summarizing such fault injection result with sufficient detail is difficult, and understanding the behavior of the fault-corrupted program is still a challenge. In this article, we introduce SpotSDC, a visualization system to facilitate the analysis of a program's resilience to SDC. SpotSDC provides multiple perspectives at various levels of detail of the impact on the output relative to where in the source code the flipped bit occurs, which bit is flipped, and when during the execution it happens. SpotSDC also enables users to study the code protection and provide new insights to understand the behavior of a fault-injected program. Based on lessons learned, we demonstrate how what we found can improve the fault injection campaign method.

97 MATHEMATICS AND COMPUTING↗

Monte Carlo toolkit for designing and validating step-range-filter spectrometer designs

Here, we present a Monte Carlo toolkit for validating step range filter (SRF) spectrometer designs. Geant4 is used to transport charged particles through the SRF filters to generate synthetic SRF data that include realistic CR-39 effects. Synthetic SRF spectra generated by this method inherently account for instrument response and allow for the quantification of SRF performance before shots. The usefulness of this toolkit is demonstrated through its application to a number of problems. A new broadband SRF for the ∼10 MeV wide 3He3He proton spectrum is validated, and an analysis method for analyzing 3He3He-p SRF data that accounts for instrument response is put forth. In addition, an SRF design for the compact recoil-proton spectrometer (CRS) on the Z-machine is validated. Finally, a new calibration technique for the DD-p SRF is proposed and validated.

Johnson, T. M. (ORCID:0000000193032949)↗

Response of nonlinear panels to random loads

Lightweight aircraft structures exposed to a high intensity noise environment can fatigue prematurely if adequate consideration is not given to the problem. Design methods and design criteria for sonic fatigue prevention were developed based on analytical and experimental techniques. Most of the analytical work was based upon small deflection or linear structural theory which did not agree with the experimental results. A large deflection geometrical nonlinearity was incorporated into the analysis methods for determining the structural response to high intensity noise. The Karman-Herrmann large deflection equations with a single mode Galerkin approximation, and the method of equivalent linearization were used to predict mean square amplitude, mean square stresses, and nonlinear frequency at various acoustic loadings for rectangular panels. Both simply supported and clamped support conditions with immovable or movable inplane edges are considered. Comparisons with experimental results are presented.

Mei, C.↗

Time Domain Identification of an Optimal Control Pilot Model with Emphasis on the Objective Function

A method for the identification of the pilot's control compensation using time domain techniques is proposed. From this information we hope to infer a quadratic cost function, supported by the data, that represents a reasonable expression for the pilot's control objective in the task being performed, or an inferred piloting strategy. The objectives for this method are: (1) obtain a better understanding of the fundamental piloting techniques in complex tasks, such as landing approach; (2) the development of a metric measurable in simulations and flight test that correlate with subjective pilot opinion; and (3) to further validate pilot models and pilot vehicle analysis methods.

Schmidt, D. K.↗

Automated coupling of NanoIndentation and Quantitative Energy-Dispersive Spectroscopy (NI-QEDS): A comprehensive method to disclose the micro-chemo-mechanical properties of cement pastes

Engineering cement-based composites requires a comprehensive understanding of the microstructure features governing macroscopic properties. This work aims to foster the latest chemo-mechanical technique to disclose the micro-mechanical properties of intimately intermixed phases. Considering a typical Portland cement paste as a study case, we compared the so-far developed nanoindentation analysis methods with a new automatic method coupling Nano-Indentation and Quantitative Energy-Dispersive Spectroscopy (NI-QEDS). Besides evincing advantages and disadvantages of previous methods, the NI-QEDS analyses enabled distinguishing chemical phases having strongly overlapping mechanical properties. Results suggested the presence at the sub-micrometre scale of extra calcium, aluminum and sulfur into (or in the vicinity of) outer C–S–H. The quantitative chemistry allowed identifying the rare occurrence of nanoindentation volumes located on ''pure'' phases (e.g., inner C–S–H). Finally, NI-QEDS provided new knowledge on cement pastes' micro-chemo-visco-mechanical properties and showed to be a powerful tool for investigating even more heterogeneous systems.

36 MATERIALS SCIENCE↗

Analysis of Monte Carlo accelerated iterative methods for sparse linear systems: Analysis of Monte Carlo accelerated iterative methods for sparse linear systems

Here, we consider hybrid deterministic-stochastic iterative algorithms for the solution of large, sparse linear systems. Starting from a convergent splitting of the coefficient matrix, we analyze various types of Monte Carlo acceleration schemes applied to the original preconditioned Richardson (stationary) iteration. We expect that these methods will have considerable potential for resiliency to faults when implemented on massively parallel machines. We also establish sufficient conditions for the convergence of the hybrid schemes, and we investigate different types of preconditioners including sparse approximate inverses. Numerical experiments on linear systems arising from the discretization of partial differential equations are presented.

97 MATHEMATICS AND COMPUTING↗