Machine Learning Augmented Predictive and Generative Models for Rupture Life in High Temperature Alloys
TMS 2021 Annual Meeting & Exhibition, Virtual, March 15-18, 2021
Wenzlick, Madison↗
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Results for “Generative models”
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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Generating Models of the Flattop Critical Assembly for Benchmark Experiments with Python
Los Alamos National Laboratory has been performing nuclear criticality experiments since 1946 at the Pajarito site, starting the Los Alamos Critical Experiments Facility in 1948. A transition period occurred between 2004 and 2011 as operations moved to the National Criticality Experiments Research Center (NCERC), where criticality experiments are now performed. Criticality experiments are essential for determination and verification of nuclear data used in calculations and modeling—such as radiation transport codes—throughout the industry, enhancing nuclear criticality safety. In addition to nuclear data validation and benchmarking, the remotely operated critical assemblies at NCERC are used for a variety of experiments and training classes supporting criticality safety.
46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
Making Next Generation Modeling and SimulationSecurity Analysis Tools Accessible
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Zahnle, Paul William↗
Cross-GAN Auditing: Unsupervised Identification of Attribute Level Similarities and Differences between Pretrained Generative Models
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Olson, M [Lawrence Livermore National Laboratory (↗
Flow matching beyond kinematics: Generating jets with particle identification and trajectory displacement information
We introduce the first generative model trained on the etlass dataset. Our model generates jets at the constituent level, and it is a permutation-equivariant continuous normalizing flow (CNF) trained with the flow matching technique. It is conditioned on the jet type, so that a single model can be used to generate the ten different jet types of etlass. For the first time, we also introduce a generative model that goes beyond the kinematic features of jet constituents. The etlass dataset includes more features, such as particle-ID and track impact parameter, and we demonstrate that our CNF can accurately model all of these additional features as well. Our generative model for etlass expands on the versatility of existing jet generation techniques, enhancing their potential utility in high-energy physics research, and offering a more comprehensive understanding of the generated jets. Published by the American Physical Society 2025
Birk, Joschka (ORCID:0000000219310127)↗
The Characterization of a DIRSIG Simulation Environment to Support the Inter-Calibration of Spaceborne Sensors
Climate change studies require long-term, continuous records that extend beyond the lifetime, and the temporal resolution, of a single remote sensing satellite sensor. The inter-calibration of spaceborne sensors is therefore desired to provide spatially, spectrally, and temporally homogeneous datasets. The Digital Imaging and Remote Sensing Image Generation (DIRSIG) tool is a first principle-based synthetic image generation model that has the potential to characterize the parameters that impact the accuracy of the inter-calibration of spaceborne sensors. To demonstrate the potential utility of the model, we compare the radiance observed in real image data to the radiance observed in simulated image from DIRSIG. In the present work, a synthetic landscape of the Algodones Sand Dunes System is created. The terrain is facetized using a 2-meter digital elevation model generated from NASA Goddard's LiDAR, Hyperspectral, and Thermal (G-LiHT) imager. The material spectra are assigned using hyperspectral measurements of sand collected from the Algodones Sand Dunes System. Lastly, the bidirectional reflectance distribution function (BRDF) properties are assigned to the modeled terrain using the Moderate Resolution Imaging Spectroradiometer (MODIS) BRDF product in conjunction with DIRSIG's Ross-Li capability. The results of this work indicate that DIRSIG is in good agreement with real image data. The potential sources of residual error are identified and the possibilities for future work are discussed..
Ambeau, Brittany L.↗
Advanced earth observation spacecraft computer-aided design software: Technical, user and programmer guide
The IDEAS computer of NASA is a tool for interactive preliminary design and analysis of LSS (Large Space System). Nine analysis modules were either modified or created. These modules include the capabilities of automatic model generation, model mass properties calculation, model area calculation, nonkinematic deployment modeling, rigid-body controls analysis, RF performance prediction, subsystem properties definition, and EOS science sensor selection. For each module, a section is provided that contains technical information, user instructions, and programmer documentation.
Farrell, C. E.↗
Quantum-assisted associative adversarial network: applying quantum annealing in deep learning
Abstract Generative models have the capacity to model and generate new examples from a dataset and have an increasingly diverse set of applications driven by commercial and academic interest. In this work, we present an algorithm for learning a latent variable generative model via generative adversarial learning where the canonical uniform noise input is replaced by samples from a graphical model. This graphical model is learned by a Boltzmann machine which learns low-dimensional feature representation of data extracted by the discriminator. A quantum processor can be used to sample from the model to train the Boltzmann machine. This novel hybrid quantum-classical algorithm joins a growing family of algorithms that use a quantum processor sampling subroutine in deep learning, and provides a scalable framework to test the advantages of quantum-assisted learning. For the latent space model, fully connected, symmetric bipartite and Chimera graph topologies are compared on a reduced stochastically binarized MNIST dataset, for both classical and quantum sampling methods. The quantum-assisted associative adversarial network successfully learns a generative model of the MNIST dataset for all topologies. Evaluated using the Fréchet inception distance and inception score, the quantum and classical versions of the algorithm are found to have equivalent performance for learning an implicit generative model of the MNIST dataset. Classical sampling is used to demonstrate the algorithm on the LSUN bedrooms dataset, indicating scalability to larger and color datasets. Though the quantum processor used here is a quantum annealer, the algorithm is general enough such that any quantum processor, such as gate model quantum computers, may be substituted as a sampler.
Wilson, Max (ORCID:0000000207983391)↗
Improving generative model-based unfolding with Schrödinger bridges
Machine learning-based unfolding has enabled unbinned and high-dimensional differential cross section measurements. Two main approaches have emerged in this research area; one based on discriminative models and one based on generative models. The main advantage of discriminative models is that they learn a small correction to a starting simulation while generative models scale better to regions of phase space with little data. We propose to use Schrödinger bridges and diffusion models to create , an unfolding approach that combines the strengths of both discriminative and generative models. The key feature of is that its generative model maps one set of events into another without having to go through a known probability density as is the case for normalizing flows and standard diffusion models. We show that achieves excellent performance compared to state of the art methods on a synthetic Z + jets dataset. Published by the American Physical Society 2024
72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
COMGEN: A computer program for generating finite element models of composite materials at the micro level
COMGEN (Composite Model Generator) is an interactive FORTRAN program which can be used to create a wide variety of finite element models of continuous fiber composite materials at the micro level. It quickly generates batch or session files to be submitted to the finite element pre- and postprocessor PATRAN based on a few simple user inputs such as fiber diameter and percent fiber volume fraction of the composite to be analyzed. In addition, various mesh densities, boundary conditions, and loads can be assigned easily to the models within COMGEN. PATRAN uses a session file to generate finite element models and their associated loads which can then be translated to virtually any finite element analysis code such as NASTRAN or MARC.
Melis, Matthew E.↗
Generating Solid Models from Topographical Data
A method of generating solid models of terrain involves the conversion of topographical data into a form useable by a rapid-prototyping (RP) machine. The method was developed to enable the use of the RP machine to make solid models of Martian terrain from Mars Orbiter laser-altimeter topographical data. The method is equally applicable to the generation of models of the terrains of other astronomical bodies, including other planets, asteroids, and Earth. Topographical data describe a terrain in terms of a set of three-dimensional coordinates [e.g., Cartesian (x,y,z) or polar (latitude, longitude, radius) coordinates] of points or nodes on the terrain surface. The input data for the RP machines are required to provide a three-dimensional description, not of a single surface, but of a volume in this case, a ground volume that underlies the terrain surface. The description is required to be in the form of triangular elements that connect the nodes of all the surfaces and that completely bound the volume, with no open areas, no overlap of triangles, and no extraneous geometric elements. The software used in the present model-generation method was written in IDL - an advanced programming language that affords a number of tools, including subroutines that triangularize surfaces. The software creates a volume from the topographical surface data by adding sides to the edges of the terrain surface and joining the sides with a bottom surface. Each of the sides is triangularized by use of IDL subroutines, and then the software searches for extraneous elements and removes them. Topographical data are usually presented in a grid corresponding to polar coordinates, so that a model generated from such data is equivalent to a topographical map in Mercator projection. However an RP machine is fully capable of including the curvature of a planetary body in a model that it makes. Therefore, the software also offers a capability to transform the topographical data to a projection onto a surface having a curvature corresponding to that of the surface of the modeled planet.
Keller, John W.↗
CaloScore v2: single-shot calorimeter shower simulation with diffusion models
Diffusion generative models are promising alternatives for fast surrogate models, producing high-fidelity physics simulations. However, the generation time often requires an expensive denoising process with hundreds of function evaluations, restricting the current applicability of these models in a realistic setting. In this work, we report updates on the CaloScorearchitecture, detailing the changes in the diffusion process, which produces higher quality samples, and the use of progressive distillation, resulting in a diffusion model capable of generating new samples with a single function evaluation. Here we demonstrate these improvements using the Calorimeter Simulation Challenge 2022 dataset.
47 OTHER INSTRUMENTATION↗
The Solid Model Geometry Generator (SMGG)
The Solid Model Geometry Generator (SMGG) system provides the capacity to model complex solid objects through the composition of primitive parts. The parts are specified through input of dimension and orientation parameters. The parts may later be edited, the model may be displayed (through a variety of display options), and the resulting geometry formatted for subsequent analysis. The SMGG system was originally constructed for use in the preliminary stages of space station and other spacecraft design. Because the system models a design through the use of basic shapes common to many solid objects and provides limited capabilities for producing irregularly shaped parts, it can be used for a variety of applications. Currently, seven primitive parts may be specified and produced through SMGG. These include boxes, spheres, cones, paraboloids, tori, and translationally or rotationally swept parts. Each part may be specified by the user through input of basic part dimensions and a local orientation. For example, a box is specified by its length, width, height and orientation in space (rotation, translation, and scaling).
Jones, K. H.↗
Integrated performance and reliability specification for digital avionics systems
This paper describes an automated tool for performance and reliability assessment of digital avionics systems, called the Automated Design Tool Set (ADTS). ADTS is based on an integrated approach to design assessment that unifies traditional performance and reliability views of system designs, and that addresses interdependencies between performance and reliability behavior via exchange of parameters and result between mathematical models of each type. A multi-layer tool set architecture has been developed for ADTS that separates the concerns of system specification, model generation, and model solution. Performance and reliability models are generated automatically as a function of candidate system designs, and model results are expressed within the system specification. The layered approach helps deal with the inherent complexity of the design assessment process, and preserves long-term flexibility to accommodate a wide range of models and solution techniques within the tool set structure. ADTS research and development to date has focused on development of a language for specification of system designs as a basis for performance and reliability evaluation. A model generation and solution framework has also been developed for ADTS, that will ultimately encompass an integrated set of analytic and simulated based techniques for performance, reliability, and combined design assessment.
Brehm, Eric W.↗
RockFlow: Fast Generation of Synthetic Source Rock Images Using Generative Flow Models
Image-based evaluation methods are a valuable tool for source rock characterization. The time and resources needed to obtain images has spurred development of machine-learning generative models to create synthetic images of pore structure and rock fabric from limited image data. While generative models have shown success, existing methods for generating 3D volumes from 2D training images are restricted to binary images and grayscale volume generation requires 3D training data. Shale characterization relies on 2D imaging techniques such as scanning electron microscopy (SEM), and grayscale values carry important information about porosity, kerogen content, and mineral composition of the shale. Here, we introduce RockFlow, a method based on generative flow models that creates grayscale volumes from 2D training data. We apply RockFlow to baseline binary micro-CT image volumes and compare performance to a previously proposed model. We also show the extension of our model to 2D grayscale data by generating grayscale image volumes from 2D SEM and dual modality nanoscale shale images. The results show that our method underestimates the porosity and surface area on the binary baseline datasets but is able to generate realistic grayscale image volumes for shales. With improved binary data preprocessing, we believe that our model is capable of generating synthetic porous media volumes for a very broad class of rocks from shale to carbonates to sandstone.
58 GEOSCIENCES↗
Generative AI models for learning flow maps of stochastic dynamical systems in bounded domains
Simulating stochastic differential equations (SDEs) in bounded domains, presents significant computational challenges due to particle exit phenomena, which requires accurate modeling of interior stochastic dynamics and boundary interactions. Despite the success of machine learning-based methods in learning SDEs, existing learning methods are not applicable to SDEs in bounded domains because they cannot accurately capture the particle exit dynamics. We present a unified hybrid data-driven approach that combines a conditional diffusion model with an exit prediction neural network to capture both interior stochastic dynamics and boundary exit phenomena. Our ML model consists of two major components: a neural network that learns exit probabilities using binary cross-entropy loss with rigorous convergence guarantees, and a training-free diffusion model that generates state transitions for non-exiting particles using closed-form score functions. The two components are integrated through a probabilistic sampling algorithm that determines particle exit at each time step and generates appropriate state transitions. Here, the performance of the proposed approach is demonstrated via three test cases: a one-dimensional simplified problem for theoretical verification, a two-dimensional advection-diffusion problem in a bounded domain, and a three-dimensional problem of interest to magnetically confined fusion plasmas.
Bounded domains↗
The evaluation of a planar radioisotope thermoelectric generator thermal model
Performance of planar radioisotope thermoelectric generator model
Fry, J. F.↗
Generative diffusion model surrogates for mechanistic agent-based biological models
Mechanistic, multicellular, agent-based models are commonly used to investigate tissue, organ, and organism-scale biology at single-cell resolution. The Cellular-Potts Model (CPM) is a powerful and popular framework for developing and interrogating these models. CPMs become computationally expensive at large space- and time- scales making application and investigation of developed models difficult. Surrogate models may allow for the accelerated evaluation of CPMs of complex biological systems. However, the stochastic nature of these models means each set of parameters may give rise to different model configurations, complicating surrogate model development. In this work, we leverage denoising diffusion probabilistic models (DDPMs) to train a generative AI surrogate of a CPM used to investigate in vitro vasculogenesis. We describe the use of an image classifier to learn the characteristics that define unique areas of a 2-dimensional parameter space. We then apply this classifier to aid in surrogate model selection and verification. Our CPM model surrogate generates model configurations 20,000 timesteps ahead of a reference configuration and demonstrates approximately a 22x reduction in computational time as compared to native code execution. Our work represents a step towards the implementation of DDPMs to develop digital twins of stochastic biological systems.
97 MATHEMATICS AND COMPUTING↗