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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 1,135 records · Page 63
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

A deep learning framework for layer-wise porosity prediction in metal powder bed fusion using thermal signatures

Abstract Part quality manufactured by the laser powder bed fusion process is significantly affected by porosity. Existing works of process–property relationships for porosity prediction require many experiments or computationally expensive simulations without considering environmental variations. While efforts that adopt real-time monitoring sensors can only detect porosity after its occurrence rather than predicting it ahead of time. In this study, a novel porosity detection-prediction framework is proposed based on deep learning that predicts porosity in the next layer based on thermal signatures of the previous layers. The proposed framework is validated in terms of its ability to accurately predict lack of fusion porosity using computerized tomography (CT) scans, which achieves a F1-score of 0.75. The framework presented in this work can be effectively applied to quality control in additive manufacturing. As a function of the predicted porosity positions, laser process parameters in the next layer can be adjusted to avoid more part porosity in the future or the existing porosity could be filled. If the predicted part porosity is not acceptable regardless of laser parameters, the building process can be stopped to minimize the loss.

42 ENGINEERING↗
DOE OSTI2026

Toward memory-efficient melt pool monitoring: a classification framework using event-based imaging and sparse sensing technique

Vision sensors like CMOS and CCD cameras are often used for in-process monitoring of melt pools in laser-based additive and welding processes, but they require transferring large amounts of data and computational processing resources. Event-based neuromorphic imagery, on the other hand, detects only the change in pixel intensity, thus potentially reducing the data amount and latency. With an event imager, this study develops a framework for melt pool condition classification, including image construction, time scale selection, optimal pixel selection, and sparse classification, to achieve a highly memory-efficient scheme. These are based on sparse sensing techniques with singular value decomposition (SVD) and QR pivoting, the two fundamental matrix transformations for linear dimensionality reduction. The framework is then validated by classifying a controlled experiment by exciting various mode shapes of liquid gallium pools of varying depths (3, 6, and 8 mm). At 200 pixels, the classifier can reach overall accuracy of 75%, while at 2000 pixels (0.013% of the total possible pixels), the accuracy is nearly 90% (89.86%). At the same number of pixels, random selection can only achieve 46% and 67%, respectively. The memory savings of the sparsely sampled event data compared to a conventional imager is about 500 times. In addition to performance, implementation and limitations of the framework are also discussed.

42 ENGINEERING↗
DOE OSTI2019

Non-stationary Geostatistical Modeling: A Case Study Comparing LVA Estimation Frameworks

Incorporating locally varying anisotropy (LVA) in geostatistical modeling improves estimates for structurally complex domains where a single set of anisotropic parameters modeled globally do not account for all geological features. In this work, the properties of two LVA-geostatistical modeling frameworks are explored through application to a complexly folded gold deposit in Ghana. The inference of necessary parameters is a significant requirement of geostatistical modeling with LVA; this work focuses on the case where LVA orientations, derived from expert geological interpretation, are used to improve the grade estimates. The different methodologies for inferring the required parameters in this context are explored. The results of considering different estimation frameworks and alternate methods of parameterization are evaluated with a cross-validation study, as well as visual inspection of grade continuity along select cross sections. Results show that stationary methodologies are outperformed by all LVA techniques, even when the LVA framework has minimal guidance on parameterization. Findings also show that additional improvements are gained by considering parameter inference where the LVA orientations and point data are used to infer the local range of anisotropy. Considering LVA for geostatistical modeling of the deposit considered in this work results in better reproduction of curvilinear geological features.

58 GEOSCIENCES↗
DOE OSTI2018

Optimizing adiabatic quantum program compilation using a graph-theoretic framework

Adiabatic quantum computing has evolved in recent years from a theoretical field into an immensely practical area, a change partially sparked by D-Wave System’s quantum annealing hardware. These multimillion-dollar quantum annealers offer the potential to solve optimization problems millions of times faster than classical heuristics, prompting researchers at Google, NASA and Lockheed Martin to study how these computers can be applied to complex real-world problems such as NASA rover missions. Unfortunately, compiling (embedding) an optimization problem into the annealing hardware is itself a difficult optimization problem and a major bottleneck currently preventing widespread adoption. Additionally, while finding a single embedding is difficult, no generalized method is known for tuning embeddings to use minimal hardware resources. To address these barriers, we introduce a graph-theoretic framework for developing structured embedding algorithms. Using this framework, we introduce a biclique virtual hardware layer to provide a simplified interface to the physical hardware. Additionally, we exploit bipartite structure in quantum programs using odd cycle transversal (OCT) decompositions. By coupling an OCT-based embedding algorithm with new, generalized reduction methods, we develop a new baseline for embedding a wide range of optimization problems into fault-free D-Wave annealing hardware. Furthermore, to encourage the reuse and extension of these techniques, we provide an implementation of the framework and embedding algorithms.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2021

Computational framework for behind-the-meter DER techno-economic modeling and optimization: REopt Lite

The energy system is undergoing a major transformation with the global emphasis on decarbonization. Distributed generation is projected to play a significant role in the new energy system, and energy models are informing how distributed generation can be integrated reliably and economically. In this work, we present an end-to-end computational framework for distributed energy resource (DER) modeling, REopt Lite™, which captures the interface of technology, economics, and policy in the energy modeling process. We describe the problem space, the building blocks of the model, the scaling capabilities of the design, the optimization formulation, and the extensibility of the model. We present a framework for accelerating the techno-economic analysis of behind-the-meter distributed energy resources to enable rapid planning and decision-making, thereby enabling greater renewable energy deployment. This computation framework is open-sourced to facilitate transparency, flexibility, and wider collaboration opportunities within the worldwide energy modeling community.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2025

A Parametric, Data-Driven, Non-Intrusive Reduced-Order Model Framework for Crystal Plasticity Simulations of Voids

The influence of the internal structure at micrometer length scales on the deformation of polycrystalline materials can be effectively captured using crystal plasticity finite element methods (CPFEM). However, the complexity and nonlinearity of the deformation equations CPFEM solves demand significant computational power and resources to achieve accurate predictions, limiting its broader application. To address this challenge, we have identified a reduced-order representation of the complex data in order to establish a computationally efficient reduced-order models (ROM) and drastically reduce the computational expense of CPFEM. Specifically, in this work, we developed a parametric, data-driven, and non-intrusive ROM framework for CPFEM using proper orthogonal decomposition (POD) and sparse variational Gaussian process (SVGP) regression for single-crystal microstructures under tensile loading conditions. The developed protocol enables one to compress field into a latent/low-dimensional space described by principal component analysis (PCA) via the singular value decomposition (SVD) algorithm. As a result, the high-dimensional data are reduced to a significantly smaller amount of dimensions with POD bases and POD coefficients. Furthermore, we deployed an ensemble of SVGPs—extended from the classical Gaussian process (GP) regression for scalability and handling big data—in a massively parallel manner to train and predict latent POD coefficients using known POD bases from a set of previously obtained simulations results. Lastly, using the predicted POD coefficients, we reconstructed the full-field results and showed reasonable agreement compared with the true values obtained from running CPFEM. The developed framework is validated with a set of CPFEM simulations of a single embedded void in single-crystal aluminum alloy. While the framework is broadly applicable, this work specifically focuses on single-crystal microstructures, a single load case (e.g., tensile), and a specific void geometry (spherical).

Anisotropy↗
DOE OSTI2022

Defining and applying an electricity demand flexibility benchmarking metrics framework for grid-interactive efficient commercial buildings

Building demand flexibility (DF) research has recently gained attention. To unlock building DF as a predictable grid resource, we must establish a quantitative understanding of the resource size, performance variability, and predictability based on large empirical datasets. Researchers have proposed various sets of theoretical metrics to measure this performance. Some metrics have been applied to simulation results, but most fall short of exploring the complexities in real building applications. There are practical metrics used in individual demand response field studies but they alone cannot fulfil the job of DF benchmarking across a diverse group of buildings. The electrical grid's geographically diverse and changing nature presents challenges to comparing building DF performance measured under different conditions (i.e., benchmarking DF). To address this challenge, a novel DF benchmarking framework focused on load shedding and shifting is presented; the foundation is a set of simple, proven single-event metrics with attributes describing event conditions. These enable benchmarking and visualization in different dimensions for identifying trends that represent how these attributes influence DF. To test its feasibility and scalability, the DF framework was applied to two case studies of 11 office buildings and 121 big-box retail buildings with demand response participation data. Furthermore, these examples provided a pathway for using both building level benchmarking and aggregation to extract insights into building DF about magnitude, consistency, and influential factors. Potential applications of the framework and real-world values have been identified for grid and building stakeholders.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2023

A framework for forming thermoset polymer networks during laser powder bed fusion additive manufacturing

It is commonly reported that the limited availability of material types is a major barrier to widespread adoption for polymer laser powder bed fusion (PBF/L) additive manufacturing (AM). A deeper understanding of the physico-chemical relationships between AM process stimuli and polymer responsive behavior is needed to make data-driven decisions for PBF/L specific material development and formulation. Many researchers have cumulatively built the current state of PBF/L “science-based manufacturing” framework where an initial guess for process parameter values can be determined from measured polymer properties and the first-principles of physics. However, published literature has focused on developing this framework for thermoplastic processing of polymers omitting many specific concerns unique to processing thermosetting materials. The authors consider in the present work the implications of many specific aspects unique to thermosetting polymers during PBF/L manufacturing. These aspects are contextually discussed according to the five sub-functions of PBF/L and are described mathematically where appropriate alongside example data from thermosetting materials commercially available in powder form. Further, this expansion of the prevailing material development framework to include thermosetting polymers paves the way for the unique performance properties offered by that class to be manifest through AM’s geometric freedom.

36 MATERIALS SCIENCE↗
DOE OSTI2026

A meshing framework for digital twins for extrusion based additive manufacturing

Additive manufacturing (AM) allows for manufacturing of complex three-dimensional geometries not typically realizable with standard manufacturing practices. The internal microstructure of AM components has a significant impact on mechanical, vibrational, and shock properties and permits richer design space when this is controllable. Due to complex interactions of internal geometry of an extrusion-based AM component, it is common practice to assume homogeneous behavior or to perform characterization testing on specific toolpath configurations. To avoid testing or material waste, it is necessary to develop a consistently accurate numerical simulation framework with relevant boundary value problems that can handle the complicated geometry of internal material microstructure present in AM components. Herein, a framework is proposed to directly create computational meshes suitable for finite element analysis (FEA) of the fine-scale features generated from extrusion-based AM tool paths to maintain a strong process–structure–property-performance linkage. This mesh can be manually or automatically analyzed using standard FEA simulations such as quasi-static preloading or modal analysis. The framework allows an in-silico assessment of a target AM geometry where fine-scale features greatly impact quantities of design interest such as in soft elastomeric lattices where toolpath infill can greatly influence the self-contact of a structure in compression, which we use as a motivating exemplar. This approach greatly reduces both time and resource waste present in traditional build and test design cycles for non-intuitive design spaces, and acts as a tool for use in the production of a key component of a digital twin, a mesh suitable for finite element analysis. In conclusion, it also further allows for the exploration of toolpath infill to optimize component properties beyond simple linear properties such as density and stiffness.

Additive manufacturing↗
DOE OSTI2016

Framework and algorithms for illustrative visualizations of time-varying flows on unstructured meshes

Photo- and physically realistic techniques are often insufficient for visualization of fluid flow simulations, especially for 3D and time-varying studies. Substantial research effort has been dedicated to the development of non-photorealistic and illustration-inspired visualization techniques for compact and intuitive presentation of such complex datasets. However, a great deal of work has been reproduced in this field, as many research groups have developed specialized visualization software. Additionally, interoperability between illustrative visualization software is limited due to diverse processing and rendering architectures employed in different studies. In this investigation, a framework for illustrative visualization is proposed, and implemented in MarmotViz, a ParaView plug-in, enabling its use on a variety of computing platforms with various data file formats and mesh geometries. Region-of-interest identification and feature-tracking algorithms incorporated into this tool are described. Implementations of multiple illustrative effect algorithms are also presented to demonstrate the use and flexibility of this framework. Here, by providing an integrated framework for illustrative visualization of CFD data, MarmotViz can serve as a valuable asset for the interpretation of simulations of ever-growing scale.

42 ENGINEERING↗
DOE OSTI2023

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

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

42 ENGINEERING↗
DOE OSTI2026

Spaced out: An economic framework to explore the impacts of PV panel spacing on large-scale farming in Colorado

CONTEXT Agrivoltaic systems co-locate solar technologies with agricultural operations on an integrated plot of land and potentially provide benefits to both energy and agricultural systems. To date, large-scale (>5-MW) agrivoltaic projects in the United States have been limited to grazing and ecovoltaic applications, raising questions about the impact and scalability of agrivoltaic crop systems. Many agrivoltaic designs raise the height of the solar panels to accommodate agricultural practices while keeping energy density high. However, raising the panels results in increased photovoltaic (PV) development costs, which often are higher than the economic returns of crop production underneath the panels. This leads to unfavorable project economics and the need for other agrivoltaic solutions than raising panels. OBJECTIVE To explore other solutions, we perform an initial feasibility analysis for an agrivoltaic solution that can integrate with large-scale farming practices by increasing the row spacing in between panels. Increased PV row spacing is a low-cost approach for scaling agrivoltaics to accommodate crop production and this spacing can be tailored to required crop equipment for different regions. Increasing row spacing will reduce the power density (PV installed per acre), but in areas that are not land limited, these agrivoltaic designs could be economically feasible. Our analysis establishes a framework for a feasibility analysis for where and with what crops spaced out panel agrivoltaic solutions might be economical. METHODS Using a case study for large-scale agriculture crops in Colorado, we establish a framework for wide-row agrivoltaic economic feasibility analysis. We utilized the System Advisor Model to calculate technoeconomic metrics to compare different row spacing solutions and capture tradeoffs of these system designs. RESULTS AND CONCLUSIONS We find that, in some circumstances, wider row agrivoltaic solutions that allow for continued mechanized crop production can provide economic benefits over a traditional utility-scale PV system. For most crops examined in this analysis, roughly $\$$200/acre in agricultural profit justified spacing out the panels to at least 31.7 ft. to accommodate agrivoltaic configurations versus PV only configurations. Additionally, opportunities for increased agricultural revenue with agrivoltaic systems allow PV project economics to tolerate a larger range of CAPEX variability while remaining economically viable relative to the PV only configurations. SIGNIFICANCE This framework can be adapted for a wide variety of crops and regions and allows for examination of economically favorable sites for future agrivoltaic systems that utilize different configuration and expand opportunities for agrivoltaics.

14 SOLAR ENERGY↗
DOE OSTI2022

Code Verification and Solution Verification framework in pin-resolved neutron transport code MPACT

Program verification in scientific computing encompasses the application of formal and mathematical techniques to a scientific computing code for its credibility, accuracy, and validity. Code Verification identifies bugs and performance issues in the software development stage. Solution Verification assesses the applicability of the code and the accuracy of the solution to problems of interest. Both activities utilize application cases and quantify the error against prescribed acceptance criteria. However, simply executing more application cases does not guarantee stronger or more comprehensive credibility. Here, we establish a verification framework that involves Code Verification and Solution Verification, both of which work together such that the overarching goal of “converge to the correct answer for the intended application” can be reasonably inferred. The application of such a verification framework is demonstrated using the pin-resolved neutron transport code MPACT, where standard unit tests and regression tests are covered, and where the Method of Exact Solutions and the Method of Manufactured Solutions are successfully used. Additionally, the applicability of Method of Manufactured Solutions is extended to the OECD/NEA C5G7 benchmark problems of practical material and geometric configurations. Solution Verification activities are demonstrated on a practical hierarchy of application models of increasing complexity ranging from 2D pin cell problems to 3D assembly problems. The convergence behavior and rate of convergence with respect to each individual variable are studied and provided. This framework can be adapted broadly to other fields involving scientific computing codes.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2014

Multichannel framework for singular quantum mechanics

A multichannel S-matrix framework for singular quantum mechanics (SQM) subsumes the renormalization and self-adjoint extension methods and resolves its boundary-condition ambiguities. In addition to the standard channel accessible to a distant (“asymptotic”) observer, one supplementary channel opens up at each coordinate singularity, where local outgoing and ingoing singularity waves coexist. The channels are linked by a fully unitary S-matrix, which governs all possible scenarios, including cases with an apparent nonunitary behavior as viewed from asymptotic distances. -- Highlights: •A multichannel framework is proposed for singular quantum mechanics and analogues. •The framework unifies several established approaches for singular potentials. •Singular points are treated as new scattering channels. •Nonunitary asymptotic behavior is subsumed in a unitary multichannel S-matrix. •Conformal quantum mechanics and the inverse quartic potential are highlighted.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

An MILP framework for optimizing demand response operation of air separation units

Renewable electricity generation and consumer demand are desynchronized in time, posing a challenge for grid operators. Industrial demand response (DR), has emerged as a strong candidate for mitigating demand variability. In this paper, we demonstrate the application of DR to an air separation unit (ASU), a chemical process that consumes significant amounts of electricity. We develop a novel optimal production scheduling framework that accounts for day-ahead electricity prices to modulate the grid load presented by the plant. Our framework accounts for the dynamics of the plant using a novel dynamic modeling framework. Further, we present a new decomposition scheme that allows us to solve the corresponding optimization problem in a matter of minutes. Extensive simulation results show significant reductions in operating costs (that benefit the plant) and reductions in peak power demand (which benefits the grid).

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2019

Holistic modeling framework of demand response considering multiti-mescale uncertainties for capacity value estimation

Demand response (DR) is regarded as an effective tool to mitigate the operational uncertainties and enhance the reliability of power supply in smart grids. However, with the time-varying attribute, to what extent DR could be committed is a major concern for utilities. This paper proposes a new approach to assess the capacity value (CV) of DR with a methodological framework developed for the uncertainty modeling of DR. The novelty of this framework is its inclusion of both physical and human-related analyses in DR programs, which allows the characterization of DR variability to be accurate for the CV estimation. To achieve this, the demand-side activities in DR are disaggregated into several modules as load usage, contract selection and actual performance. Based on their intrinsic properties, different parametric models are proposed to represent the impact of each technical/social factor on the availability of DR. The parameters of these models are determined using learning based algorithms to adapt to various behavior patterns of consumers. The outputs of the framework will serve as the quantifiers of DR capability and are integrated into reliability-based CV evaluation. The results of case studies verify the effectiveness of the proposed methodology.

Capacity value↗
DOE OSTI2021

A framework for estimating the energy-saving potential of occupant behaviour improvement

Energy-related occupant behaviour in buildings has demonstrated considerable energy-saving potential. However, the current modelling method of occupant behaviour does not give sufficient considerations on the implementation difficulty of behaviour and provide a holistic map from survey data to various behaviour models. This article proposes a holistic survey-and-simulation-based framework for estimating the energy-saving potential of occupant behaviour improvement. In the framework, seven typical categories of occupant behaviour models are identified based on the survey results. According to the implementation difficulty, the models are integrated into four behaviour styles (baseline, wasteful, moderate and austere) to represent different levels of energy-saving consciousness of occupants. Based on a case study with a nationwide survey in Singapore, there are remarkable energy savings potential if occupant behaviour is improved; the building energy consumption can be reduced by up to 9.5% with the moderate behaviour improvement, and up to 21.0% with the aggressive behaviour improvement. The simulation results accord well with the measured results within a reasonable range of deviation. The framework can be applied to estimate the energy-saving potential of occupant behaviour improvement in a building with affordable cost, and the findings can inform a behaviour improvement programme with effective and efficient measures.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2021

A meta-learning based distribution system load forecasting model selection framework

This paper presents a meta-learning based, automatic distribution system load forecasting model selection framework. Furthermore, the framework includes the following processes: feature extraction, candidate model preparation and labeling, offline training, and online model recommendation. Using load forecasting needs and data characteristics as input features, multiple metalearners are used to rank the candidate load forecast models based on their forecasting accuracy. Then, a scoring-voting mechanism is proposed to weights recommendations from each meta-leaner and make the final recommendations. Heterogeneous load forecasting tasks with different temporal and technical requirements at different load aggregation levels are set up to train, validate, and test the performance of the proposed framework. Simulation results demonstrate that the performance of the meta-learning based approach is satisfactory in both seen and unseen forecasting tasks.

24 POWER TRANSMISSION AND DISTRIBUTION↗