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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 109 records · Page 6
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Learning Optimal Aerodynamic Designs

This project created a framework for efficient, accurate, and scalable deep neural network representations of design optimization problem solutions. The inputs to these DNN representations are the vector of design requirement parameters, the outputs are the optimal design variables, and the goal is to learn the map from inputs to outputs (i.e., inverse design). The team addressed the problem of the optimal shape design of aerodynamic lifting surfaces—in particular aircraft wings—using a Reynolds-Average Navier Stokes model to govern the CFD-based aerodynamic shape optimization. The inverse design map for such problems is very complex and high-dimensional, involving inputs and outputs on the order of 1000s. To approximate this inverse design map, the team developed algorithms to construct parsimonious DNN architectures, which automatically identify low-dimensional manifolds in which design requirements affect optimal shape parameters, and trained these architectures with multifidelity optimization methods. The resulting methodology accurately and automatically designs optimal aerodynamic lifting surfaces with very high accuracy (99%) at interactive speeds, of the order of milliseconds, resulting in factors of one million or more speedup relative to CFD-based design optimization.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2024

AI-Driven Detector Design for the EIC (Final Technical Report)

We developed an optimization workflow based on DNN-based fast-simulation and reconstruction algorithms. We used these methods to advance the design of calorimeter systems for the Electron-Ion Collider (EIC). This DNN-driven optimization provides a blueprint for integrating gradient-based methods into detector-design workflows. All software pipelines and methods have been released publicly and incorporated into the EIC collaboration’s physics studies, broadening their impact. Three journal articles detailing the methods developed here serve as a reference for the design and optimal use of next generation high-granularity calorimeter systems in nuclear and particle physics.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2022

A New Perspective of Post-Weld Baking Effect on Al-Steel Resistance Spot Weld Properties through Machine Learning and Finite Element Modeling

The root cause of post-weld baking on the mechanical performance of Al-steel dissimilar resistance spot welds (RSWs) has been determined by machine learning (ML) and finite element modeling (FEM) in this study. A deep neural network (DNN) model was constructed to associate the spot weld performance with the joint attributes, stacking materials, and other conditions, using a comprehensive experimental dataset. The DNN model positively identified that the post-weld baking reduces the joint performance, and the extent of degradation depends on the thickness of stacking materials. A three-dimensional finite element (FE) model was then used to investigate the root cause and the mechanism of the baking effect. It revealed that the formation of high thermal stresses during baking, from the mismatch of thermal expansion between steel and Al alloy, causes damage and cracking of the brittle intermetallic compound (IMC) formed at the interface of the weld nugget during welding. This in turn reduces the joint performance by promoting undesirable interfacial fracture when the welds were subjected to externally applied loads. The FEM model further revealed that increase in structural stiffness, because of increase in steel sheet thickness, reduces the thermal stresses at the interface caused by the thermal expansion mismatch and consequently lessens the detrimental effect of post-weld baking on the joint performance.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Densely Connected G-invariant Deep Neural Networks with Signed Permutation Representations

We introduce and investigate, for finite groups G, G-invariant deep neural network (GDNN) architectures with ReLU activation that are densely connected- i.e., include all possible skip connections. In contrast to other G-invariant architectures in the literature, the preactivations of theG-DNNs presented here are able to transform by signed permutation representations (signed perm-reps) of G. Moreover, the individual layers of the G-DNNs are not required to be G-equivariant; instead, the preactivations are constrained to be G-equivariant functions of the network input in a way that couples weights across all layers. The result is a richer family of G-invariant architectures never seen previously. We derive an efficient implementation of G-DNNs after a reparameterization of weights, as well as necessary and sufficient conditions for an architecture to be "admissible"- i.e., nondegenerate and inequivalent to smaller architectures. We include code that allows a user to build a G-DNN interactively layer-by-layer, with the final architecture guaranteed to be admissible. We show that there are far more admissible G-DNN architectures than those accessible with the "concatenated ReLU" activation function from the literature. Finally, we apply G-DNNs to two example problems--(1) multiplication in --1, 1} (with theoretical guarantees) and (2) 3D object classification--finding that the inclusion of signed perm-reps significantly boosts predictive performance compared to baselines with only ordinary (i.e., unsigned) perm-reps.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2024

Factorized visual representations in the primate visual system and deep neural networks

Object classification has been proposed as a principal objective of the primate ventral visual stream and has been used as an optimization target for deep neural network models (DNNs) of the visual system. However, visual brain areas represent many different types of information, and optimizing for classification of object identity alone does not constrain how other information may be encoded in visual representations. Information about different scene parameters may be discarded altogether (‘invariance’), represented in non-interfering subspaces of population activity (‘factorization’) or encoded in an entangled fashion. In this work, we provide evidence that factorization is a normative principle of biological visual representations. In the monkey ventral visual hierarchy, we found that factorization of object pose and background information from object identity increased in higher-level regions and strongly contributed to improving object identity decoding performance. We then conducted a large-scale analysis of factorization of individual scene parameters – lighting, background, camera viewpoint, and object pose – in a diverse library of DNN models of the visual system. Models which best matched neural, fMRI, and behavioral data from both monkeys and humans across 12 datasets tended to be those which factorized scene parameters most strongly. Notably, invariance to these parameters was not as consistently associated with matches to neural and behavioral data, suggesting that maintaining non-class information in factorized activity subspaces is often preferred to dropping it altogether. Thus, we propose that factorization of visual scene information is a widely used strategy in brains and DNN models thereof.

59 BASIC BIOLOGICAL SCIENCES↗
NASA NTRSDate not supplied

A Framework for the Analysis of Deep Neural Networks in Autonomous Aerospace Applications using Bayesian Statistics

Deep Neural Networks (DNNs) are considered to be key components in many autonomous systems. Applications range from vision-based obstacle avoidance to intelligent/learning control and planning. Safety-critical applications as found in the aerospace domain require that the behavior of the DNN is validated and tested rigorously for safety of the autonomous system (AUS). In this paper, we present a framework to support testing of DNNs and the analysis of the network structure. Our framework employs techniques from statistical modeling and active learning to effectively generate test cases for DNN safety testing and performance analysis. We will present results of a case study on a physics-based Deep recurrent residual neural network (DR-RNN), which has been trained to emulate the aerodynamics behavior of a fixed-wing aircraft.

Deep Neural networks↗
NASA NTRSDate not supplied

SafeDNN: Understanding and Verifying Neural Networks

The SafeDNN project at NASA Ames explores analysis techniques and tools to ensure that systems that use Deep Neural Networks (DNN) are safe, robust and interpretable. Research directions we are pursuing include: symbolic execution for DNN analysis, label-guided clustering to automatically identify input regions that are robust, parallel and compositional approaches to improve formal SMT-based verification, property inference and automated program repair for DNNs, adversarial training and detection, probabilistic reasoning for DNNs. In this talk I will highlight some of the research advances from SafeDNN, that were already published.

Corina Pasareanu↗
NASA NTRSDate not supplied

Variance Decomposition of MEDLI2 Reconstructed Heating Using Neural Networks

The Mars Entry, Descent, and Landing Instrumentation (MEDLI2) sensor suite collected data during entry of the Mars 2020 Perseverance rover into Mars’ atmosphere. This suite included a network of MEDLI2 Instrumented Sensor Plugs (MISPs). Each MISP was comprised of a cylinder made of Thermal Protection System (TPS) material with 1-3 embedded thermocouples (TCs), and it was flush mounted into the heatshield or backshell. Data from these in-depth TCs were used to reconstruct the aeroheating environment of the vehicle throughout entry. Surface heating was posed as an inverse problem, with the goal of estimating the surface heating by minimizing an objective function of the difference between MISP temperature measurements during flight and the temperature predictions derived from the Fully Implicit Ablation and Thermal response (FIAT) program. Given an aerothermal environment, FIAT calculates the material response and provides in-depth temperatures throughout the TPS material. To achieve the reverse, an internal tool called FIAT_Opt runs through multiple different environments until the output temperature at the TC depth closely matches the flight data. 95% confidence intervals on the reconstructed surface heating were obtained using Monte Carlo analysis, in which uncertainties in the thermocouple depth and the TPS material properties (e.g., density, thermal conductivity, heat capacity, emissivity) based on flight-lot material testing were included. A variance decomposition method using Sobol indices was employed to assess the sensitivity of the reconstructed peak heating to the TC placement and material property uncertainties. Variance decomposition was found to require tens of thousands of FIAT_Opt runs in order for the Sobol indices to converge. With a single FIAT_Opt run taking on the order of 40 minutes, the required number of computations would take months to complete, even if using multiple CPUs. To mitigate this problem, three machine learning models (ridge regression with cross-validation, random forest regression, and a deep neural network) were trained and tested using the 2000 Monte Carlo runs that were already completed. A subset of 1600 runs were used to train the model (i.e., training set), while the remaining 400 runs were used as the test set. The predictions from the deep neural network (DNN) on the test set showed nearly perfect agreement to the actual values computed with FIAT_Opt (R2 > 0.99). Using the DNN as a surrogate model, the variance decomposition using 50,000 runs was completed within minutes. The resulting Sobol indices showed that the reconstructed peak surface heating was most sensitive to the uncertainties in the thermal conductivity (ST = 0.37) and heat capacity (ST = 0.26). This method can be leveraged to provide requirements for material property measurements needed to improve the accuracy of surface heating prediction and ultimately lead to the reduction of design margins in the future. This presentation will include background on the MEDLI2 suite; the method used for inverse heating estimation; the way that material property uncertainties were accounted for using Monte Carlo analysis; a brief background on variance decomposition; the motivation for using machine learning in this context; how a neural network was trained on the data to enable variance decomposition in a fraction of the time; and the variance decomposition results for one of the MISPs.

Hannah Alpert↗
NASA NTRSDate not supplied

System and Safety Analysis with SysAI A Statistical Learning Framework

This is a tutorial on how to use the SYSAI (System Analysis using Statistical AI), a flexible statistical learning framework for the V&V and analysis of complex and high-dimensional Aerospace systems with DNN and AI components. SYSAI provides functionality for a variety of analyses and V&V tasks, including statistical data analysis, high dimensional safety-envelope and time-series analysis, property checking, as well as intelligent test-case generation. The tutorial will demonstrate SYSAI with our industrial partner’s Autonomous Centerline Tracking system, which uses a DNN to enable autonomous aircraft taxiing as an example. Video & Tutorial

Statistical V&V for Complex safety-critical system↗
NASA NTRSDate not supplied

Deep Neural Network Based Convergence Classification for Computational Fluid Dynamics

A supervised deep learning approach is coupled with heuristic convergence criteria to construct a classification model for detecting the completion (convergence) of computational fluid dynamics (CFD) simulations. Heuristic convergence criteria alone are not always sufficient and more complex decisions are often left to a human analyst. The proposed approach leverages heuristic convergence criteria as well as two deep neural network (DNN) models, one binary and one multi-class, to improve the efficiency and consistency of convergence classification across a wide range of flight regimes. The DNN models presented are each trained on a subset of ascent aerodynamic CFD simulations for NASA’s Space Launch System and were produced using NASA’s unstructured Navier-Stokes solver FUN3D. Individual solutions are analyzed intermittently and are classified as sufficiently converged, further iterations required, or switch from steady Reynolds Averaged Navier-Stokes (RANS) to unsteady RANS CFD based on the iterative histories of four aerodynamic coefficients. The implemented classification model is shown to produce solutions that closely correlate to solutions produced by a human analyst. This work lays groundwork for expanding the capabilities of DNNs for automating and improving more of the CFD process.

SLS↗
NASA NTRSDate not supplied

A Deep Neural Network for Achieving Spectrally Consistent and Seamless Infrared Radiance Measurements Across Geostationary Satellite Domains

The NASA Clouds and the Earth's Radiant Energy System (CERES) project provides the scientific community with observed top-of-atmosphere (TOA) shortwave and longwave fluxes for climate monitoring and climate model validation. To achieve this goal, CERES relies on TOA broadband fluxes derived from geostationary satellite (GEO) imagery to account for the diurnal flux variations between the CERES observation intervals. Consistent global flux derivation depends on accurate and consistent cloud retrievals. Scene-dependent spectral measurement inconsistency of the instruments that make up the contiguous ring of GEO observations (GEO-Ring), as well as limb darkening effects, can cause discontinuities in derived cloud properties and radiative fluxes at the boundaries of adjacent imager domains. Although the algorithms utilize radiative transfer models to account for instrument-band-dependent atmospheric correction and viewing zenith angle (VZA) dependency, small discontinuities may persist due to uncertainties inherent to the multiple imager-specific algorithms. Furthermore, while hyperspectral-instrument-based spectral band adjustment factors may effectively account for spectrally induced bias, they are less effective at reducing variance owed to the specific composition of the viewed scene, which is challenging to robustly characterize. As such, this article highlights the use of a deep neural network (DNN) to resolve spectral-and VZA-induced biases between GEO-Ring imagers. The DNN uses available infrared (IR) channels from the GEO instruments, along with viewing and solar illumination geometry, to estimate homogenized, VIIRS-like IR radiances for use in the GEO cloud algorithm. This approach is effective at mitigating scene-dependent spectral variance and VZA dependency, resulting in consistent radiance measurements across the GEO-Ring, thereby leading toward a more seamless global cloud assessment.

deep learning↗
NASA NTRSDate not supplied

Understanding Relationships Between Satellite, Model, and Ground-Based Surface Temperature Characterizations From Overcast to Clear Conditions in Support of Satellite Remote Sensing of Clouds and Radiation

Accurate and consistent global estimates of cloud coverage and their properties are fundamental to long-term Earth radiation budget (ERB) monitoring efforts like the Clouds and the Earth’s Radiant Energy System (CERES) project. Cloud detection algorithms often apply thresholding approaches to identify where clouds occur by comparing satellite-measured radiances with those that are expected under cloud-free conditions. In addition, once a cloud is detected, the derivation of cloud optical and microphysical properties also requires knowledge of the background radiances below the cloud. In the infrared, knowledge of the surface emissivity and the expected skin temperature under both cloudy and cloud-free conditions is needed. These traits are generally well known over the oceans. Over land, however, comparisons between satellite-derived land surface temperature (LST) with that characterized in numerical weather analyses reveal large differences in many parts of the world, often exceeding 5 K, which can lead to significant satellite cloud detection and cloud property retrieval errors. Furthermore, clouds have a dramatic influence on the LST, and therefore characterization of that model parameter also depends on the capability of the model to accurately resolve clouds. Thus, the LST characterized in models is, at times, a poor approximation for what would otherwise be observed, thereby impeding accurate satellite cloud retrievals. As a result, we seek to develop a more robust method for estimating the LST required for satellite cloud characterizations. This effort is accomplished through a combination of surface emission/air temperature relationship studies in all-sky conditions using ground measurement stations, along with deep neural network (DNN) estimates of expected LST under overcast and cloud-free conditions. We demonstrate that substituting DNN-predicted LST for that generated by numerical models can mitigate model-inherent diurnal dependencies and reduce overall bias and uncertainty relative to satellite/ground observations by 0.5–4 K and 0.5–2 K, respectively. It is expected that this work will lead to improved satellite cloud retrievals that enhance ERB monitoring efforts.

B Scarino↗
DOE OSTI2022

A Classification of G -invariant Shallow Neural Networks

When trying to fit a deep neural network (DNN) to a G-invariant target function with G a group, it only makes sense to constrain the DNN to be G-invariant as well. However, there can be many different ways to do this, thus raising the problem of “G-invariant neural architecture design”: What is the optimal Ginvariant architecture for a given problem? Before we can consider the optimization problem itself, we must understand the search space, the architectures in it, and how they relate to one another. In this paper, we take a first step towards this goal; we prove a theorem that gives a classification of all G-invariant single-hidden-layer or “shallow” neural network (G-SNN) architectures with ReLU activation for any finite orthogonal group G, and we prove a second theorem that characterizes the inclusion maps or “network morphisms” between the architectures that can be leveraged during neural architecture search (NAS). The proof is based on a correspondence of every G-SNN to a signed permutation representation of G acting on the hidden neurons; the classification is equivalently given in terms of the first cohomology classes of G, thus admitting a topological interpretation. The G-SNN architectures corresponding to nontrivial cohomology classes have, to our knowledge, never been explicitly identified in the literature previously. Using a code implementation, we enumerate the G-SNN architectures for some example groups G and visualize their structure. Lastly, we prove that architectures corresponding to inequivalent cohomology classes coincide in function space only when their weight matrices are zero, and we discuss the implications of this for NAS.

Agrawal, Devanshu↗
DOE OSTI2023

Deep learning uncertainty quantification for clinical text classification

Machine learning algorithms are expected to work side-by-side with humans in decision-making pipelines. Thus, the ability of classifiers to make reliable decisions is of paramount importance. Deep neural networks (DNNs) represent the state-of-the-art models to address real-world classification. Although the strength of activation in DNNs is often correlated with the network’s confidence, in-depth analyses are needed to establish whether they are well calibrated. In this paper, we demonstrate the use of DNN-based classification tools to benefit cancer registries by automating information extraction of disease at diagnosis and at surgery from electronic text pathology reports from the US National Cancer Institute (NCI) Surveillance, Epidemiology, and End Results (SEER) population-based cancer registries. In particular, we introduce multiple methods for selective classification to achieve a target level of accuracy on multiple classification tasks while minimizing the rejection amount—that is, the number of electronic pathology reports for which the model’s predictions are unreliable. We evaluate the proposed methods by comparing our approach with the current in-house deep learning-based abstaining classifier. Overall, all the proposed selective classification methods effectively allow for achieving the targeted level of accuracy or higher in a trade-off analysis aimed to minimize the rejection rate. On in-distribution validation and holdout test data, with all the proposed methods, we achieve on all tasks the required target level of accuracy with a lower rejection rate than the deep abstaining classifier (DAC). Interpreting the results for the out-of-distribution test data is more complex; nevertheless, in this case as well, the rejection rate from the best among the proposed methods achieving 97% accuracy or higher is lower than the rejection rate based on the DAC. We show that although both approaches can flag those samples that should be manually reviewed and labeled by human annotators, the newly proposed methods retain a larger fraction and do so without retraining—thus offering a reduced computational cost compared with the in-house deep learning-based abstaining classifier.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2021

Estimating Watershed Subsurface Permeability From Stream Discharge Data Using Deep Neural Networks

Subsurface permeability is a key parameter in watershed models that controls the contribution from the subsurface flow to stream flows. Since the permeability is difficult and expensive to measure directly at the spatial extent and resolution required by fully distributed watershed models, estimation through inverse modeling has had a long history in subsurface hydrology. The wide availability of stream surface flow data, compared to groundwater monitoring data, provides a new data source to infer soil and geologic properties using integrated surface and subsurface hydrologic models. As most of the existing methods have shown difficulty in dealing with highly nonlinear inverse problems, we explore the use of deep neural networks for inversion owing to their successes in mapping complex, highly nonlinear relationships. We train various deep neural network (DNN) models with different architectures to predict subsurface permeability from stream discharge hydrograph at the watershed outlet. The training data are obtained from ensemble simulations of hydrographs corresponding to an permeability ensemble using a fully-distributed, integrated surface-subsurface hydrologic model. The trained model is then applied to estimate the permeability of the real watershed using its observed hydrograph at the outlet. Our study demonstrates that the permeabilities of the soil and geologic facies that make significant contributions to the outlet discharge can be more accurately estimated from the discharge data. Their estimations are also more robust with observation errors. Compared to the traditional ensemble smoother method, DNNs show stronger performance in capturing the nonlinear relationship between permeability and stream hydrograph to accurately estimate permeability. Our study sheds new light on the value of the emerging deep learning methods in assisting integrated watershed modeling by improving parameter estimation, which will eventually reduce the uncertainty in predictive watershed models.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Deep Learning the Electromagnetic Properties of Metamaterials—A Comprehensive Review

Deep neural networks (DNNs) are empirically derived systems that have transformed traditional research methods, and are driving scientific discovery. Here, artificial electromagnetic materials (AEMs)—including electromagnetic metamaterials, photonic crystals, and plasmonics—are research fields where DNN results valorize the data driven approach; especially in cases where conventional methods have failed. In view of the great potential of deep learning for the future of artificial electromagnetic materials research, the status of the field with a focus on recent advances, key limitations, and future directions is reviewed. Strategies, guidance, evaluation, and limits of using deep networks for both forward and inverse AEM problems are presented.

14 SOLAR ENERGY↗
DOE OSTI2023

Iterative sampling of expensive simulations for faster deep surrogate training

Deep neural network (DNN) surrogates of expensive physics simulations are enabling a rapid change in the way that common experimental design and analysis tasks are approached. Surrogate models allow simulations to be performed in parallel and separately from downstream tasks, thereby enabling analyses that would be impossible with the simulation in-the-loop; surrogates based on DNNs can effectively emulate diverse non-scalar data of the types collected in fusion and laboratory-astrophysics experiments. The challenge is in training the surrogate model, for which large ensembles of physics simulations must be run, preferably without wasting computational effort on uninteresting simulations. Here, in this paper, we present an iterative sampling scheme that can preferentially propose simulations in interesting regions of parameter space without neglecting unexplored regions, allowing high-quality and wide-ranging surrogate models to be trained using 2–3 times fewer simulations compare to space-filling designs. Our approach uses an explicit importance function defined on the simulation output space, balanced against a measure of simulation density which serves as a proxy for surrogate accuracy. It is easy to implement and can be tuned to find interesting simulations early in the study, allowing surrogates to be trained quickly and refined as new simulations become available; this represents an important step towards the routine generation of deep surrogate models quickly enough to be truly relevant to experimental work.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2023

Probabilistic partition of unity networks for high–dimensional regression problems

We explore the probabilistic partition of unity network (PPOU-Net) model in the context of high-dimensional regression problems and propose a general framework focusing on adaptive dimensionality reduction. With the proposed framework, the target function is approximated by a mixture of experts model on a low-dimensional manifold, where each cluster is associated with a fixed-degree polynomial. We present a training strategy that leverages the expectation maximization (EM) algorithm. During the training, we alternate between (i) applying gradient descent to update the DNN coefficients; and (ii) using closed-form formulae derived from the EM algorithm to update the mixture of experts model parameters. Under the probabilistic formulation, step (ii) admits the form of embarrassingly paralleliazable weighted least-squares solves. The PPOU-Nets consistently outperform the baseline fully-connected neural networks of comparable sizes in numerical experiments of various data dimensions. Here, we also explore the proposed model in applications of quantum computing, where the PPOU-Nets act as surrogate models for cost landscapes associated with variational quantum circuits.

97 MATHEMATICS AND COMPUTING↗