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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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NASA NTRS1973

Evaluation of usefulness of SKYLAB EREP S-190 and S-192 imagery in multistage forest surveys

The author has identified the following significant results. To transfer points from topographic maps to space platform imagery a generalized resection program has been developed in which any resection parameter can be enforced in the solution to any desired extent. This allows for the use of orbital parameters in the resection solution. In addition to the resection program, a technique has been developed applicable to space platform photography with which elevations can be assigned to digitzed map points through the use of digital terrain models. Using this technique tedious manual elevation assignment for thousands of digitized points can be avoided. The software to project the map points to the space platform image has also been developed and tested. Programs are being tested to relate the projected image coordinates to digital image tape locations so that any desired sample unit can be retrieved from the digital tapes with considerable accuracy.

Langley, P. G.↗

DOE OSTI2021

MACHINE LEARNING BASED CHEMICAL EXPLOSIVE MODE ANALYSIS (ML-CEMA)

The software consists of a Machine Learning based Chemical Explosive Mode Analysis (ML-CEMA) tool for advanced computational flame diagnostics. CEMA, originally based on eigen-analysis of the local thermochemical system, is capable of identifying reaction fronts and limit phenomena such as auto-ignition and extinction in practical combustion systems, such as internal combustion engines and gas turbine combustors. However, the original CEMA is computationally expensive for large reaction mechanisms that are typically needed to describe fuel chemistry of practical large-hydrocarbon fuels. This novel ML-CEMA tool employs a ML technique to accelerate the eigen-analysis of the basic CEMA approach by orders of magnitude, thus making it suitable for practical fuels. In ML-CEMA,zero-dimensional (0D) reactors and one-dimensional (1D) premixed flames are first used to generate a large number of data points for neural network based ML training. The trained ML model is then used to perform CEMA prediction. This ML-CEMA tool has been demonstrated in canonical 0D and 1D configurations as well as highly-transient three-dimensional spray flames exhibiting multi-mode turbulent combustion, showing promising results. ML-CEMA, as a standalone tool, can be used for computationally-efficient diagnostics of massive datasets generated from both experiments and simulations. For example, based on spatially resolved measurements of a small set of reactive scalars(such as temperature, hydroxyl radical and formaldehyde), ML-CEMA can effectively identify flame fronts and rare events. ML-CEMA also provides a robust online or offline flame feature detection tool. When used for on-the-fly simulations, ML-CEMA further enables zone-adaptive combustion modeling, in which the predicted eigenvalue is used as a robust mode indicator for judicious assignment of locally-valid combustion models. This ML-CEMA based zone-adaptive model can lead to substantial computational cost savings when used for large-scale simulations of multi-mode combustion systems. Third Party Code Web Page to Download Code Web Page Location of Third Party License

Xu, Chao↗

DOE OSTI2022

Uncertainty in Thermal Modeling of Spent Nuclear Fuel Casks

Uncertainty is a key metric in computational modeling that must be evaluated for results to have wide ranging applicability. A well characterized uncertainty range is ideal with clear error bars on results that can be presented to stakeholders. In the field of spent fuel cask modeling, this ideal has been historically difficult to achieve in practice because of the computationally intensive nature of the models used and the difficulty assigning reasonable uncertainties to quantities in as-built systems. The work in this report has been conducted to evaluate the overall state of uncertainty and sensitivity in spent fuel cask models and develop methodologies for evaluating these uncertainties. These methodologies must be practical for engineering applications. They should not require excessive computational resources or calendar time to achieve results. In engineering, the model must be on a scale such that it can be changed and adapted throughout a project as new information is discovered and project goals evolve. This report covers three major modeling task areas that provide an overview of the types of sensitivity and uncertainty present in a spent fuel storage and transportation system. Section 3 discusses sensitivity and uncertainty analysis in the effective thermal conductivity model for the fuel region and applies these results to a single assembly model. Section 4 shows sensitivity analysis of a full cask model in the TN-32B and Section 5 demonstrates the overall uncertainty workflow using Coolant Boiling in Rod Arrays – Spent Fuel Storage and STAR-CCM+ developed from the sensitivity work in the preceding sections.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

NASA NTRS2023

A Common Trajectory Language for New Airspace Domains

Revolutionary new aviation services are currently in development, including small package delivery and short-range urban passenger transportation. These new services need a language to represent and deconflict trajectories, and a common language will simplify coordination between the new airspace domains as well as traditional airspace. A Trajectory Specification Language (TSL) was previously proposed for traditional air traffic, and it can also serve as a common language for the new aviation domains and services. The TSL specifies a reference trajectory in 4D space along with spatial tolerances that determine a bounding volume at any given time in flight. The tolerances are defined in terms of the route-oriented cross-track, along-track, and vertical axes, and they are allowed to vary with distance along the route. This bounding model can guarantee safe separation between flights as long as they are in conformance with their assigned trajectories. The advantages of this model over the previously proposed Operational Intent Volumes (OIVs) in terms of airspace usage efficiency are explained.

air traffic control, aircraft trajectory, language↗

NASA NTRS1999

The Aviation System Analysis Capability Air Carrier Cost-Benefit Model

To meet its objective of assisting the U.S. aviation industry with the technological challenges of the future, NASA must identify research areas that have the greatest potential for improving the operation of the air transportation system. Therefore, NASA is developing the ability to evaluate the potential impact of various advanced technologies. By thoroughly understanding the economic impact of advanced aviation technologies and by evaluating how the new technologies will be used in the integrated aviation system, NASA aims to balance its aeronautical research program and help speed the introduction of high-leverage technologies. To meet these objectives, NASA is building the Aviation System Analysis Capability (ASAC). NASA envisions ASAC primarily as a process for understanding and evaluating the impact of advanced aviation technologies on the U.S. economy. ASAC consists of a diverse collection of models and databases used by analysts and other individuals from the public and private sectors brought together to work on issues of common interest to organizations in the aviation community. ASAC also will be a resource available to the aviation community to analyze; inform; and assist scientists, engineers, analysts, and program managers in their daily work. The ASAC differs from previous NASA modeling efforts in that the economic behavior of buyers and sellers in the air transportation and aviation industries is central to its conception. Commercial air carriers, in particular, are an important stakeholder in this community. Therefore, to fully evaluate the implications of advanced aviation technologies, ASAC requires a flexible financial analysis tool that credibly links the technology of flight with the financial performance of commercial air carriers. By linking technical and financial information, NASA ensures that its technology programs will continue to benefit the user community. In addition, the analysis tool must be capable of being incorporated into the wide-ranging suite of economic and technical models that comprise ASAC. This report describes an Air Carrier Cost-Benefit Model (CBM) that meets these requirements. The ASAC CBM is distinguished from many of the aviation cost-benefit models by its exclusive focus on commercial air carriers. The model considers such benefit categories as time and fuel savings, utilization opportunities, reliability and capacity enhancements, and safety and security improvements. The model distinguishes between benefits that are predictable and those that occur randomly. By making such a distinction, the model captures the ability of air carriers to reoptimize scheduling and crew assignments for predictable benefits. In addition, the model incorporates a life-cycle cost module for new technology, which applies the costs of nonrecurring acquisitions, recurring maintenance and operation, and training to each aircraft equipment type independently.

Gaier, Eric M.↗

NASA NTRS1973

NASTRAN data generation of helicopter fuselages using interactive graphics

The development and implementation of a preprocessor system for the finite element analysis of helicopter fuselages is described. The system utilizes interactive graphics for the generation, display, and editing of NASTRAN data for fuselage models. It is operated from an IBM 2250 cathode ray tube (CRT) console driven by an IBM 370/145 computer. Real time interaction plus automatic data generation reduces the nominal 6 to 10 week time for manual generation and checking of data to a few days. The interactive graphics system consists of a series of satellite programs operated from a central NASTRAN Systems Monitor. Fuselage structural models including the outer shell and internal structure may be rapidly generated. All numbering systems are automatically assigned. Hard copy plots of the model labeled with GRID or elements ID's are also available. General purpose programs for displaying and editing NASTRAN data are included in the system. Utilization of the NASTRAN interactive graphics system has made possible the multiple finite element analysis of complex helicopter fuselage structures within design schedules.

Sainsbury-Carter, J. B.↗

NASA NTRS2016

Ames S-32 O-16 O-18 Line List for High-Resolution Experimental IR Analysis

By comparing to the most recent experimental data and spectra of the SO2 628 ν1/ν3 bands (see Ulenikov et al., JQSRT 168 (2016) 29-39), this study illustrates the reliability and accuracy of the Ames-296K SO2 line list, which is accurate enough to facilitate such high-resolution spectroscopic analysis. The SO2 628 IR line list is computed on a recently improved potential energy surface (PES) refinement, denoted Ames-Pre2, and the published purely ab initio CCSD(T)/aug-cc-pVQZ dipole moment surface. Progress has been made in both energy level convergence and rovibrational quantum number assignments agreeing with laboratory analysis models. The accuracy of the computed 628 energy levels and line list is similar to what has been achieved and reported for SO2 626 and 646, i.e. 0.01-0.03 cm(exp −1) for bands up to 5500 cm(exp −1). During the comparison, we found some discrepancies in addition to overall good agreements. The three-IR-list based feature-by-feature analysis in a 0.25 cm(exp −1) spectral window clearly demonstrates the power of the current Ames line lists with new assignments, correction of some errors, and intensity contributions from varied sources including other isotopologues. We are inclined to attribute part of detected discrepancies to an incomplete experimental analysis and missing intensity in the model. With complete line position, intensity, and rovibrational quantum numbers determined at 296 K, spectroscopic analysis is significantly facilitated especially for a spectral range exhibiting such an unusually high density of lines. The computed 628 rovibrational levels and line list are accurate enough to provide alternatives for the missing bands or suspicious assignments, as well as helpful to identify these isotopologues in various celestial environments. The next step will be to revisit the SO2 828 and 646 spectral analyses.

Sulfur dioxide↗

NASA NTRSDate not supplied

Creating Regional and Seasonal Climatologies of Marine and Dusty Marine Aerosol Lidar Ratios using MODIS AOD Constrained Retrievals and GOCART Model Simulations

The CALIPSO aerosol algorithms currently assign one lidar ratio (LR) value globally for each of the seven tropospheric aerosol types. In this study, MODIS total column aerosol optical depths (AODs) are used to constrain collocated CALIOP backscatter profiles in a Fernald inversion that infers aerosol LRs for CALIOP-classified marine and dusty marine aerosols. The GOCART aerosol model is leveraged to estimate the sea salt volume fractions (SSVFs) that are collocated with the CALIOP+MODIS LR retrievals. An inverse empirical relationship is found between the SSVFs and LRs (i.e., smaller SSVFs and larger LRs near coastlines, but the opposite in the remote oceans). This SSVF/LR relationship is applied to create regional and seasonal hybrid (i.e., retrieval & model-assisted) climatological LR maps so as to develop more robust LR selections for marine and dusty marine aerosols in the CALIPSO algorithms. These analyses also provide critical LR information for the next generation of spaceborne elastic backscatter lidars.

Travis D. Toth↗

NASA NTRSDate not supplied

Creating Regional and Seasonal Climatologies of Marine and Dusty Marine Aerosol Lidar Ratios using MODIS AOD Constrained Retrievals and GOCART Model Simulations

Travis D. Toth↗

DOE OSTI2025

Interpretable machine learning models classify minerals via spectroscopy

Developing methods to identify mineral species confidently and rapidly from Raman spectral analysis is critical to numerous fields. Traditionally, analysis relies on pattern matching the Raman spectrum of an unknown dataset with a supporting library of well-characterized spectral data, which may prove difficult for environmental samples that are poorly crystalline or phase mixtures. Here, we developed interpretable machine learning models that can classify uranium minerals by secondary oxyanion chemistry and other physicochemical properties based solely on Raman spectra. This new ML method produces a mineral profile of physical and chemical properties for an unknown sample and can rapidly classify or identify unknown minerals from Raman data, without the need for an exact pattern match in a spectral library. Training models are validated by 1. Strong correlation of high confidence model regions with published spectroscopic assignments and 2. Correct classification of a mineral not present in training data. Training data are from the Compendium of Uranium Raman and Infrared Experimental Spectra and available crystallographic information files within the open-source Smart Spectral Matching scientific framework. Physically meaningful classifier models can rapidly identify key structural and chemical information about unknown uranium minerals and the overall methodology is broadly applicable for mineral phases.

Machine learning↗

DOE OSTI2020

A data-driven perspective on the colours of metal–organic frameworks

Colour is at the core of chemistry and has been fascinating humans since ancient times. It is also a key descriptor of optoelectronic properties of materials and is often used to assess the success of a synthesis. However, predicting the colour of a material based on its structure is challenging. In this work, we leverage subjective and categorical human assignments of colours to build a model that can predict the colour of compounds on a continuous scale. In the process of developing the model, we also uncover inadequacies in current reporting mechanisms. For example, we show that the majority of colour assignments are subject to perceptive spread that would not comply with common printing standards. To remedy this, we suggest and implement an alternative way of reporting colour—and chemical data in general. All data is captured in an objective, and standardised, form in an electronic lab notebook and subsequently automatically exported to a repository in open formats, from where it can be interactively explored by other researchers. We envision this to be key for a data-driven approach to chemical research.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1993

A comparison of multiprocessor scheduling methods for iterative data flow architectures

A comparative study is made between the Algorithm to Architecture Mapping Model (ATAMM) and three other related multiprocessing models from the published literature. The primary focus of all four models is the non-preemptive scheduling of large-grain iterative data flow graphs as required in real-time systems, control applications, signal processing, and pipelined computations. Important characteristics of the models such as injection control, dynamic assignment, multiple node instantiations, static optimum unfolding, range-chart guided scheduling, and mathematical optimization are identified. The models from the literature are compared with the ATAMM for performance, scheduling methods, memory requirements, and complexity of scheduling and design procedures.

Storch, Matthew↗

NASA NTRS1991

Software reliability report

There are many software reliability models which try to predict future performance of software based on data generated by the debugging process. Unfortunately, the models appear to be unable to account for the random nature of the data. If the same code is debugged multiple times and one of the models is used to make predictions, intolerable variance is observed in the resulting reliability predictions. It is believed that data replication can remove this variance in lab type situations and that it is less than scientific to talk about validating a software reliability model without considering replication. It is also believed that data replication may prove to be cost effective in the real world, thus the research centered on verification of the need for replication and on methodologies for generating replicated data in a cost effective manner. The context of the debugging graph was pursued by simulation and experimentation. Simulation was done for the Basic model and the Log-Poisson model. Reasonable values of the parameters were assigned and used to generate simulated data which is then processed by the models in order to determine limitations on their accuracy. These experiments exploit the existing software and program specimens which are in AIR-LAB to measure the performance of reliability models.

Wilson, Larry↗

NASA NTRS2012

Satellite-based Estimates of Ambient Air Pollution and Global Variations in Childhood Asthma Prevalence

Background: The effect of ambient air pollution on global variations and trends in asthma prevalence is unclear. Objectives: Our goal was to investigate community-level associations between asthma prevalence data from the International Study of Asthma and Allergies in Childhood (ISAAC) and satellite-based estimates of particulate matter with aerodynamic diameter < 2.5 microm (PM2.5) and nitrogen dioxide (NO2), and modelled estimates of ozone. Methods: We assigned satellite-based estimates of PM2.5 and NO2 at a spatial resolution of 0.1deg × 0.1deg and modeled estimates of ozone at a resolution of 1deg × 1deg to 183 ISAAC centers. We used center-level prevalence of severe asthma as the outcome and multilevel models to adjust for gross national income (GNI) and center- and country-level sex, climate, and population density. We examined associations (adjusting for GNI) between air pollution and asthma prevalence over time in centers with data from ISAAC Phase One (mid-1900s) and Phase Three (2001-2003). Results: For the 13- to 14-year age group (128 centers in 28 countries), the estimated average within-country change in center-level asthma prevalence per 100 children per 10% increase in center-level PM2.5 and NO2 was -0.043 [95% confidence interval (CI): -0.139, 0.053] and 0.017 (95% CI: -0.030, 0.064) respectively. For ozone the estimated change in prevalence per parts per billion by volume was -0.116 (95% CI: -0.234, 0.001). Equivalent results for the 6- to 7-year age group (83 centers in 20 countries), though slightly different, were not significantly positive. For the 13- to 14-year age group, change in center-level asthma prevalence over time per 100 children per 10% increase in PM2.5 from Phase One to Phase Three was -0.139 (95% CI: -0.347, 0.068). The corresponding association with ozone (per ppbV) was -0.171 (95% CI: -0.275, -0.067). Conclusion: In contrast to reports from within-community studies of individuals exposed to traffic pollution, we did not find evidence of a positive association between ambient air pollution and asthma prevalence as measured at the community level.

Air pollution↗

NASA NTRS2019

The Updated GEO Population for ORDEM 3.1

The limited availability of data for satellite fragmentations and debris in the geosynchronous orbit (GEO) region creates challenges to building accurate models for the orbital debris environment at such altitudes. Updated methods to properly incorporate and extrapolate measurement data have become a cornerstone of the GEO component in the newest version of the NASA Orbital Debris Engineering Model (ORDEM), ORDEM 3.1. For the GEO region, the Space Surveillance Network (SSN) catalog provides coverage down to a limit of approximately 1 m. A more statistically complete representation of the GEO population for smaller objects, which can pose a high risk to operational spacecraft, is thus dependent on dedicated observations by instruments optimized to observe debris smaller than the SSN cataloging threshold. For ORDEM 3.1, optical data from the Michigan Orbital DEbris Survey Telescope (MODEST) provided the input for building the GEO population down to approximately 30 cm (converting absolute magnitude to size). For smaller sizes, the size distribution of debris in the MODEST dataset was extrapolated down to 10 cm, and orbital parameters were estimated based on the orbits of the larger objects. When compared to previous versions of the model, significant improvements were made to the process of building the GEO population in ORDEM 3.1, both in the assessment of fragmentation debris in the data and assignment of orbital elements within the model. A so-called “debris ring filter,” based on a range of angles between an orbit’s angular momentum vector and that of the stable Laplace plane, was applied to the data to reduce biases from non- GEO objects, such as objects in a GEO-transfer orbit. In addition, a new approach was implemented to assign noncircular mean motions and eccentricities to the fragmentation debris observed by MODEST because the short observation window (5 min) in GEO limits orbit resolution to a circular orbit assumption for assigning orbital parameters. For ORDEM 3.1, non-circular orbital elements were assigned using relationships that were identified between mean motion and the angle between the orbit plane and the stable Laplace plane, as well as between mean motion and eccentricity, based on breakup clouds modeled by the NASA Standard Breakup Model. This approach has yielded a high-fidelity GEO model that has been validated with data from more recent MODEST observation campaigns.

Manis, A.↗

NASA NTRS2017

Recent Corrections to Meteoroid Environment Models

The dynamical and physical characteristics of a meteoroid affects its behavior in the atmosphere and the damage it does to spacecraft surfaces. Accurate environment models must therefore correctly describe the speed, size, density, and direction of meteoroids. However, the measurement of dynamical characteristics such as speed is subject to observational biases, and physical properties such as size and density cannot be directly measured. De-biasing techniques and proxies are needed to overcome these challenges. In this presentation, we discuss several recent improvements to the derivation of the meteoroid velocity, directionality, and bulk density distributions. We derive our speed distribution from observations made by the Canadian Meteor Orbit Radar. These observations are de-biased using modern descriptions of the ionization efficiency and sharpened to remove the effects of measurement uncertainty, and the result is a meteoroid speed distribution that is skewed slower than in previous analyses. We also adopt a higher fidelity density distribution than that used by many older models. In our distribution, meteoroids with T(sub J) less than 2 are assigned to a low-density population, while those with T(sub J) greater than 2 have higher densities. This division and the distributions themselves are derived from the densities reported by Kikwaya et al. (2009, 2011). These changes have implications for the environment. For instance, helion and antihelion meteors have lower speeds and higher densities than apex and toroidal meteors. A slower speed distribution therefore corresponds to a sporadic environment that is more completely dominated by the helion and antihelion sources than in previous models. Finally, assigning these meteors high densities further increases their significance from a spacecraft damage perspective.

Moorhead, A. V.↗

DOE OSTI2026

Towards AI-assisted neutrino flavor theory design

Particle physics theories, such as those which explain neutrino flavor mixing, arise from a vast landscape of model-building possibilities. A model’s construction typically relies on the intuition of theorists. It also requires considerable effort to identify appropriate symmetry groups, assign field representations, and extract predictions for comparison with experimental data. We develop Autonomous Model Builder (AMBer), a framework in which a reinforcement learning agent interacts with a streamlined physics software pipeline to search these spaces efficiently. AMBer selects symmetry groups, particle content, and group representation assignments to construct models while minimizing the number of free parameters introduced. We validate our approach in well-studied regions of theory space and extend the exploration to a previously unexamined symmetry group. While demonstrated in the context of neutrino flavor theories, this approach of reinforcement learning with physics software feedback may be extended to other theoretical model-building problems in the future.

Baretz, Jason Benjamin↗

DOE OSTI2022

Insights into Cation Ordering of Double Perovskite Oxides from Machine Learning and Causal Relations

This work investigates origins of cation ordering in double perovskites using first-principles theory computations combined with machine learning (ML) and causal relations. We have considered various oxidation states of A, A', B, and B' from the family of transition metal ions to construct a diverse compositional space. A conventional framework employing traditional ML classification algorithms such as Random Forest (RF) coupled with appropriate features including geometry-driven and key structural modes leads to accurate prediction (~98%) of A-site cation ordering. We have evaluated the accuracy of ML models by employing analyses of decision paths, assignments of probabilistic confidence bound, and finally a direct non-Gaussian acyclic structural equation model to investigate causality. Our study suggests that structural modes are crucial for classifying layered, columnar, and rock-salt ordering. The charge difference between A and A' is the most important feature for predicting clear layered ordering, which in turn depends on the B and B' charge separation. We have also designed mathematical relationships with these features to derive energy differences to form clear layered ordering. Here, the trilinear coupling between tilt, in-phase rotation, and A-site antiferroelectric displacement in the Landau free-energy expansion becomes the necessary condition behind formation of A-site cation ordering.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗