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At least 523 records · Page 29

Validation of Model Forecasts of the Ambient Solar Wind

Independent and automated validation is a vital step in the progression of models from the research community into operational forecasting use. In this paper we describe a program in development at the CCMC to provide just such a comprehensive validation for models of the ambient solar wind in the inner heliosphere. We have built upon previous efforts published in the community, sharpened their definitions, and completed a baseline study. We also provide first results from this program of the comparative performance of the MHD models available at the CCMC against that of the Wang-Sheeley-Arge (WSA) model. An important goal of this effort is to provide a consistent validation to all available models. Clearly exposing the relative strengths and weaknesses of the different models will enable forecasters to craft more reliable ensemble forecasting strategies. Models of the ambient solar wind are developing rapidly as a result of improvements in data supply, numerical techniques, and computing resources. It is anticipated that in the next five to ten years, the MHD based models will supplant semi-empirical potential based models such as the WSA model, as the best available forecast models. We anticipate that this validation effort will track this evolution and so assist policy makers in gauging the value of past and future investment in modeling support.

Macneice, P. J.↗

Structural Sizing of a Tow-Steered Truss-Braced Wing Box Test Article

Tailoring of composite laminates is traditionally performed by changing the orientation of straight fibers in one or more plies. Modern automated fiber placement machines facilitate placement of bundles of curved fibers (tows) in a process called tow-steering, but additional variables must be used to define the shapes of tow-steered fiber paths. In this paper, the design of a tow-steered truss-braced wing test article called the Structural Wing Experiment Evaluating Truss-bracing 15-ft concept (SWEET-15) is discussed. The SWEET-15 test article is scaled to 18.6% of the span length and chord width of a full-scale vehicle. The test article is designed to withstand +2.5-g (positive limit) and -1.0-g (negative limit) maneuvering loads with a factor of safety of 1.5 under strength and buckling constraints. Design studies were performed using commercial finite element analysis and optimization software in conjunction with a tow-steering modeling tool called ATSCOOL (Automated Tool for Steered COmposite Optimizable Laminates) developed at NASA Langley Research center. A 6.4% weight reduction in the upper cover panels was achieved using a tow-steered layup configuration.

Structural Optimization↗

Structural Sizing of a Tow-Steered Truss-Braced Wing Box Test Article

Tailoring of composite laminates is traditionally performed by changing the orientation of straight fibers in one or more plies. Modern automated fiber placement machines facilitate placement of bundles of curved fibers (tows) in a process called tow-steering, but additional variables must be used to define the shapes of tow-steered fiber paths. In this paper, the design of a tow-steered truss-braced wing test article called the Structural Wing Experiment Evaluating Truss-bracing 15-ft concept (SWEET-15) is discussed. The SWEET-15 test article is scaled to 18.6% of the span length and chord width of a full-scale vehicle. The test article is designed to withstand +2.5-g (positive limit) and -1.0-g (negative limit) maneuvering loads with a factor of safety of 1.5 under strength and buckling constraints. Design studies were performed using commercial finite element analysis and optimization software in conjunction with a tow-steering modeling tool called ATSCOOL (Automated Tool for Steered COmposite Optimizable Laminates) developed at NASA Langley Research center. A 6.4% weight reduction in the upper cover panels was achieved using a tow-steered layup configuration.

Composites↗

Expanding SPoRT RGBs and Machine Learning Techniques to Enhance Air Quality Monitoring in Southern Asia

Air pollution poses significant environmental, public health, and societal concerns in the Hindu Kush Himalaya (HKH) region of south-central Asia, notably during the dry monsoon months (~November to May). Key contributors to poor air quality include dust from the Middle East and western India, persistent nocturnal fog/smog, and biomass burning. To address this issue, we established a robust air quality and chemistry observation and modeling product suite utilizing multi-spectral red-green-blue (RGB) composite satellite products from Korea’s GEO-KOMPSAT-2A satellite, the Hybrid Single-Particle Lagrangian Integrated Trajectory (HYSPLIT) model for dust transport forecasts, and the Weather Research and Forecasting coupled with Chemistry (WRF-Chem) model to predict aerosols and chemical species concentrations. Our team employed similar RGB recipes transitioned by the NASA Short-term Prediction Research and Transition (SPoRT) Center for the GOES-R era products over the Western Hemisphere, with significant success in depicting dust and nocturnal fog / low clouds, and to a lesser extent smoke and fire hot spots. We will extend these capabilities for the HKH region by applying an artificial intelligence (AI) model that objectively identifies dust from multi-spectral satellite data over the Southwestern United States. The AI model will be calibrated for automated dust detection over HKH from GEO-KOMPSAT-2A satellite data, with a goal of developing a similar AI model for objectively identifying smoke as well. The ultimate goal of this effort is to enhance dust and smoke predictions in the region by establishing improved emission initializations in HYSPLIT and/or WRF-Chem through the automated AI detection of dust and smoke.

Jonathan L. Case↗

Modeling Controller Tasks for Safety Analysis

As control systems become more complex, the use of automated control has increased. At the same time, the role of the human operator has changed from primary system controller to supervisor or monitor. Safe design of the human computer interaction becomes more difficult. In this paper, we present a visual task modeling language that can be used by system designers to model human-computer interactions. The visual models can be translated into SpecTRM-RL, a blackbox specification language for modeling the automated portion of the control system. The SpecTRM-RL suite of analysis tools allow the designer to perform formal and informal safety analyses on the task model in isolation or integrated with the rest of the modeled system.

Brown, Molly↗

Fast Algorithms for Model-Based Diagnosis

Two improved new methods for automated diagnosis of complex engineering systems involve the use of novel algorithms that are more efficient than prior algorithms used for the same purpose. Both the recently developed algorithms and the prior algorithms in question are instances of model-based diagnosis, which is based on exploring the logical inconsistency between an observation and a description of a system to be diagnosed. As engineering systems grow more complex and increasingly autonomous in their functions, the need for automated diagnosis increases concomitantly. In model-based diagnosis, the function of each component and the interconnections among all the components of the system to be diagnosed (for example, see figure) are represented as a logical system, called the system description (SD). Hence, the expected behavior of the system is the set of logical consequences of the SD. Faulty components lead to inconsistency between the observed behaviors of the system and the SD. The task of finding the faulty components (diagnosis) reduces to finding the components, the abnormalities of which could explain all the inconsistencies. Of course, the meaningful solution should be a minimal set of faulty components (called a minimal diagnosis), because the trivial solution, in which all components are assumed to be faulty, always explains all inconsistencies. Although the prior algorithms in question implement powerful methods of diagnosis, they are not practical because they essentially require exhaustive searches among all possible combinations of faulty components and therefore entail the amounts of computation that grow exponentially with the number of components of the system.

Fijany, Amir↗

ParaStell: parametric modeling and neutronics support for stellarator fusion power plants

The three-dimensional variation inherent to stellarator geometries and fusion sources motivates three-dimensional modeling to obtain accurate results from computational modeling in support of design and analysis of first wall, blanket, and shield (FWBS) systems. Manually constructing stellarator fusion power plant geometries in computer-aided design (CAD) and defining the corresponding fusion source can be cumbersome and challenging. The open-source parametric modeling toolset ParaStell has been developed to automate construction of such geometries in low-fidelity. Low-fidelity modeling is useful during the conceptual phase of engineering design as a means of rapidly exploring the design space of a given device. The modeling capability of ParaStell includes in-vessel components and magnets, for any given stellarator configuration, using a parametric definition and plasma equilibrium data. Furthermore, the toolset automates the generation of detailed, tetrahedral neutron source definitions and DAGMC geometries for use in neutronics modeling. ParaStell assists rapid design iteration, parametric study, and design optimization of stellarator fusion cores. As a demonstration of the design iteration capability, the effect of the three-dimensional parameter space on tritium breeding and magnet shielding is investigated, using the WISTELL-D configuration as a design basis. Blanket and shield thicknesses are varied in three dimensions, using the space available between the plasma edge and magnet coils as a constraint. The corresponding effects on tritium breeding ratio and magnet heating are tallied using the open-source Monte Carlo particle transport code OpenMC. The inclusion of additional and higher-fidelity modeling capabilities is planned for ParaStell’s future, as well as its implementation in machine-driven optimization.

Moreno, Connor↗

When can we detect lianas from space? Toward a mechanistic understanding of liana‐infested forest optics

Abstract Lianas, woody vines acting as structural parasites of trees, have profound effects on the composition and structure of tropical forests, impacting tree growth, mortality, and forest succession. Remote sensing could offer a powerful tool for quantifying the scale of liana infestation, provided the availability of robust detection methods. We analyze the consistency and global geographic specificity of spectral signals—reflectance across wavelengths—from liana‐infested tree crowns and forest stands, examining the underlying mechanisms of these signals. We compiled a uniquely comprehensive database, including leaf reflectance spectra from 5424 leaves, fine‐scale airborne reflectance data from 999 liana‐infested canopies, and coarse‐scale satellite reflectance data covering 775 ha of liana‐infested forest stands. To unravel the mechanisms of the liana spectral signal, we applied mechanistic radiative transfer models across scales, establishing a synthesis of the relative importance of different mechanisms, which we corroborate with field data on liana leaf chemistry and canopy structure. We find a consistent liana spectral signal at canopy and stand scales across globally distributed sites. This signature mainly arises at the canopy level due to direct effects of more horizontal leaf angles, resulting in a larger projected leaf area, and indirect effects from increased light scattering in the near and short‐wave infrared regions, linked to lianas' less costly leaf construction compared with trees on average. The existence of a consistent global spectral signal for lianas suggests that large‐scale quantification of liana infestation is feasible. However, because the traits responsible for the liana canopy‐reflectance signal are not exclusive to lianas, accurate large‐scale detection requires rigorously validated remote sensing methods. Our models highlight challenges in automated detection, such as potential misidentification due to leaf phenology, tree life history, topography, and climate, especially where the scale of liana infestation is less than a single remote sensing pixel. The observed cross‐site patterns also prompt ecological questions about lianas' adaptive similarities in optical traits across environments, indicating possible convergent evolution due to shared constraints on leaf biochemical and structural traits.

Environmental Sciences & Ecology↗

LandScan HD: a high-resolution gridded ambient population methodology for the world

Unwarned population distributions accounting for routine human activities are needed to address many global human security challenges, including disasters, conflict, and infrastructure demand. LandScan High Definition (LSHD) supports this need through gridded ambient population estimates that measure average human presence between daytime and nighttime at a high spatial resolution of 3 arcseconds (approximately 90 m). Although LSHD has traditionally been produced on a country-specific basis, advances in global foundational data and computational resources now enable scaling its methodology to the world. Combining aspects of top-down and bottom-up gridded population methods, LSHD allocates subnational population totals from authoritative statistics to built-up areas based on occupancy estimates for multiple facility types (e.g., residential, commercial) and then reaggregates these estimates to a global population grid. We scale this approach by organizing the LSHD data stack into a 1° resolution tileset of vector analytic features, enabling an efficient and repeatable workflow for all countries worldwide. Examining the Philippines as an output of the global LSHD baseline dataset, we contrast unwarned and residential (WorldPop) population distributions by (1) exploring a practical application of flood risk assessment and (2) evaluating their congruence with outcomes of collective human activities (subnational CO 2 emissions). Finally, we discuss plans to address current LSHD limitations through data/modeling and uncertainty quantification improvements and provide outlook for workflow automation and extending the model to social, demographic and economic population characteristics.

Building morphology↗

Enhancing transfer learning in angle-resolved photoemission spectroscopy (ARPES) with spatially-aware representations via graph convolution

A recent application of machine learning has been to spatially-resolved angle-resolved photoemission spectroscopy (ARPES). Here we advance the state-of-the-art by applying representational learning to transform ARPES data into an embedding space of a pre-trained self-supervised learning model, thus enhancing the pipeline that improves the bandstructure classification and domain assignment/segmentation performance compared to a k-means clustering method. In the current iteration, the real-space information is entered into the domain assignment through the graph convolution method, which improves the transfer learning performance of the original self-supervised model. Lastly, an unsupervised automated tool is developed that incorporates these techniques to enable automatic domain assignment.

ARPES↗

Creating Continuous Integration Infrastructure for Software Development on U.S. Department of Energy High-Performance Computing Systems

The Exascale Computing Project (ECP) software deployment effort developed and advanced DevOps capabilities. One goal was to enable robust continuous integration (CI) workflows that span the protected high performance computing (HPC) environments found within many of the Department of Energy’s (DOE) national laboratories. This article highlights several challenges encountered with enabling automation, such as charging models for CI jobs, and meeting individualized security requirements that revolve around strongly associating running code with a human identity. Here, it also describes how the Jacamar CI tool evolved to meet latter requirements and became a key aspect of the solutions currently offered. Derived from this experience, we offer a conceptual framework for understanding current and future CI challenges at DOE facilities and offer suggestions for long-term solutions.

97 MATHEMATICS AND COMPUTING↗

Automating Genetic Algorithm Mutations for Molecules Using a Masked Language Model

Inspired by the evolution of biological systems, genetic algorithms have been applied to generate solutions for optimization problems in a variety of scientific and engineering disciplines. For a given problem, a suitable genome representation must be defined along with a mutation operator to generate subsequent generations. Unlike natural systems which display a variety of complex rearrangements (e.g. mobile genetic elements), mutation for genetic algorithms commonly utilizes only random point-wise changes. Furthermore, generalizing beyond point-wise mutations poses a key difficulty as useful genome rearrangements depend on the representation and problem domain. To move beyond the limitations of manually defined point-wise changes, here we propose the use of techniques from masked language models to automatically generate mutations. As a first step, common subsequences within a given population are used to generate a vocabulary. The vocabulary is then used to tokenize each genome. A masked language model is trained on the tokenized data in order to generate possible rearrangements (i.e. mutations). In order to illustrate the proposed strategy, we use string representations of molecules and use a genetic algorithm to optimize for drug-likeness and synthesizability. Finally, our results show that moving beyond random point-wise mutations accelerates genetic algorithm optimization.

59 BASIC BIOLOGICAL SCIENCES↗

pnnl/openstudio-building-energy-standard-measures-gem

The OpenStudio Building Energy Standards Measure Repository is a comprehensive collection of innovative OpenStudio measures designed to facilitate energy code analysis. OpenStudio is a cutting-edge platform brings together physics-based building energy modeling (BEM), BEM process automation, and large-scale computing capabilities. Contains OpenStudio Standards Performance Rating Method Measure (IPID 32936) and OpenStudio Measure to Generate IPLV-specific Chiller Performance Curves for Chillers (IPID 32940)

Xu, Weili [PNNL]↗

Catalyst Design in Nitrate Removal

Based on the volcano plot developed by Dr. Goldsmith group (Report linked in submission), we utilized DFT (density functional theory) calculations to search for bimetallic materials in the application of catalysts in aqueous nitrate removal. The calculations are conducted via the high-throughput automated workflow package developed by our group (Github linked in submission) using VASP commercial first-principles calculation software.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

A methodology for producing reliable software, volume 1

An investigation into the areas having an impact on producing reliable software including automated verification tools, software modeling, testing techniques, structured programming, and management techniques is presented. This final report contains the results of this investigation, analysis of each technique, and the definition of a methodology for producing reliable software.

Stucki, L. G.↗

The NASA MERIT program - Developing new concepts for accurate flight planning

It is noted that the rising cost of aviation fuel has necessitated the development of a new approach to upper air forecasting for flight planning. It is shown that the spatial resolution of the present weather forecast models used in fully automated computer flight planning is an important accuracy-limiting factor, and it is proposed that man be put back into the system, although not in the way he has been used in the past. A new approach is proposed which uses the application of man-computer interactive display techniques to upper air forecasting to retain the fine scale features of the atmosphere inherent in the present data base in order to provide a more accurate and cost effective flight plan. It is pointed out that, as a result of NASA research, the hardware required for this approach already exists.

Steinberg, R.↗

NASA rotorcraft technology for the 21st century

Current and planned rotorcraft technology-related research at NASA's Ames, Lewis, and Langley research centers is discussed with a view to the fruits of these efforts beyond the year 2000. Examples of promising technologies are higher-harmonic and dynamic rotor controls, advanced structural composites, aerodynamics and acoustics simulation models for design predictions, automated flight controls, and high-reliability rotor drivetrains. The overall payoff from an integration of these technologies will allow safe automated flying in all weather conditions, as well as precision-hover and exceptionally low noise and vibration levels.

Albers, James A.↗

The Baldwin-Lomax model for separated and wake flows using the entropy envelope concept

Implementation of the Baldwin-Lomax algebraic turbulence model is difficult and ambiguous within flows characterized by strong viscous-inviscid interactions and flow separations. A new method of implementation is proposed which uses an entropy envelope concept and is demonstrated to ensure the proper evaluation of modeling parameters. The method is simple, computationally fast, and applicable to both wake and boundary layer flows. The method is general, making it applicable to any turbulence model which requires the automated determination of the proper maxima of a vorticity-based function. The new method is evalulated within two test cases involving strong viscous-inviscid interaction.

Brock, J. S.↗