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At least 1,135 records · Page 63

gLaSDI: Parametric physics-informed greedy latent space dynamics identification

A parametric adaptive physics-informed greedy Latent Space Dynamics Identification (gLaSDI) method is proposed for accurate, efficient, and robust data-driven reduced-order modeling of high-dimensional nonlinear dynamical systems. In the proposed gLaSDI framework, an autoencoder discovers intrinsic nonlinear latent representations of high-dimensional data, while dynamics identification (DI) models capture local latent-space dynamics. Here, an interactive training algorithm is adopted for the autoencoder and local DI models, which enables identification of simple latent-space dynamics and enhances accuracy and efficiency of data-driven reduced-order modeling. To maximize and accelerate the exploration of the parameter space for the optimal model performance, an adaptive greedy sampling algorithm integrated with a physics-informed residual-based error indicator and random-subset evaluation is introduced to search for the optimal training samples on the fly. Further, to exploit local latent-space dynamics captured by the local DI models for an improved modeling accuracy with a minimum number of local DI models in the parameter space, a -nearest neighbor convex interpolation scheme is employed. The effectiveness of the proposed framework is demonstrated by modeling various nonlinear dynamical problems, including Burgers equations, nonlinear heat conduction, and radial advection. The proposed adaptive greedy sampling outperforms the conventional predefined uniform sampling in terms of accuracy. Compared with the high-fidelity models, gLaSDI achieves 17 to 2,658× speed-up with 1 to 5% relative errors.

97 MATHEMATICS AND COMPUTING↗

Database and deep-learning scalability of anharmonic phonon properties by automated brute-force first-principles calculations

Understanding the anharmonic phonon properties of crystal compounds—such as phonon lifetimes and thermal conductivities—is essential for investigating and optimizing their thermal transport behaviors. These properties also impact optical, electronic, and magnetic characteristics through interactions between phonons and other quasiparticles and fields. In this study, we develop an automated first-principles workflow to calculate anharmonic phonon properties and build a comprehensive database encompassing more than 6500 inorganic compounds. Utilizing this dataset, we train a graph neural network model to predict thermal conductivity values and spectra from structural parameters, demonstrating a scaling law in which prediction accuracy improves with increasing training data size. High-throughput screening with the model enables the identification of materials exhibiting extreme thermal conductivities—both high and low. The resulting database offers valuable insights into the anharmonic behavior of phonons, thereby accelerating the design and development of advanced functional materials.

Ohnishi, Masato [University of Tokyo (Japan); Inst↗

Extracting the excitonic Hamiltonian of a chlorophyll dimer from broadband two-dimensional electronic spectroscopy

We apply Frenkel exciton theory to model the entire Q-band of a tightly bound chlorophyll dimer inspired by the photosynthetic reaction center of photosystem II. The potential of broadband two-dimensional electronic spectroscopy experiment spanning the Qx and Qy regions to extract the parameters of the model dimer Hamiltonian is examined through theoretical simulations of the experiment. We find that the local nature of Qx excitation enables identification of molecular properties of the delocalized Qy excitons. Specifically, we demonstrate that the cross-peak region, where excitation energy is resonant with Qy while detection is at Qx, contains specific spectral signatures that can reveal the full real-space molecular Hamiltonian, a task that is impossible by considering the Qy transitions alone. System–bath coupling and site energy disorder in realistic systems may limit the resolution of these spectral signatures due to spectral congestion.

Chemistry↗

Characterization of structural connections using free and forced response test data

The accurate prediction of system dynamic response often has been limited by deficiencies in existing capabilities to characterize connections adequately. Connections between structural components often are complex mechanically, and difficult to accurately model analytically. Improved analytical models for connections are needed to improve system dynamic preditions. A procedure for identifying physical connection properties from free and forced response test data is developed, then verified utilizing a system having both a linear and nonlinear connection. Connection properties are computed in terms of physical parameters so that the physical characteristics of the connections can better be understood, in addition to providing improved input for the system model. The identification procedure is applicable to multi-degree of freedom systems, and does not require that the test data be measured directly at the connection locations.

Lawrence, Charles↗

Pressure vessel burst test program - Initial program paper

The current status of a pressure vessel burst test program, aimed at the study of the blast waves and fragmentation characteristics of ruptured gas-filled pressure vessels, is reported. The program includes a series of test plans, each involving multiple bursts with burst pressures ranging to 7500 psig. The discussion covers the identification of concerns and hazards, application of the data generated, and a brief review of the current methods for assessing vessel safety and burst parameters. Attention is also given to pretest activities, including completed vessel and facility/instrumentation preparation and results of completed preliminary burst tests.

Cain, Maurice R.↗

Characterization of structural connections using free and forced response test data

The accurate prediction of system dynamic response often has been limited by deficiencies in existing capabilities to characterize connections adequately. Connections between structural components often are complex mechanically, and difficult to accurately model analytically. Improved analytical models for connections are needed to improve system dynamic predictions. A procedure for identifying physical connection properties from free and forced response test data is developed, then verified utilizing a system having both a linear and nonlinear connection. Connection properties are computed in terms of physical parameters so that the physical characteristics of the connections can better be understood, in addition to providing improved input for the system model. The identification procedure is applicable to multi-degree of freedom systems, and does not require that the test data be measured directly at the connection locations.

Lawrence, C.↗

Use of system identification techniques for improving airframe finite element models using test data

A method for using system identification techniques to improve airframe finite element models was developed and demonstrated. The method uses linear sensitivity matrices to relate changes in selected physical parameters to changes in total system matrices. The values for these physical parameters were determined using constrained optimization with singular value decomposition. The method was confirmed using both simple and complex finite element models for which pseudo-experimental data was synthesized directly from the finite element model. The method was then applied to a real airframe model which incorporated all the complexities and details of a large finite element model and for which extensive test data was available. The method was shown to work, and the differences between the identified model and the measured results were considered satisfactory.

Hanagud, Sathya V.↗

Time domain identification of element matrices

Accurate mathematical models are clearly an important part of the design, modification, control, and damage assessment of large space structures. A critical part of model determination of any type of structure is the use of system identification (SI), a process for using measured excitation and response data to improve the form of a mathematical model or the values of the parameters in it. The reasons for using SI are manifold, but most of them involve uncertainties in either the form of or the parameters in the mathematical model. Some of the more common uncertainties are the following: the nature of the damping, the characteristics of sloppy or sticky joints, inelastic material properties, and parameters in a reduced Degree-of-Freedom (DOF) model. This paper contains a description of the SI algorithm followed by two illustrations: one in which all parameters in a shear building model are determined using pull back and quick release data, and another in which an equivalent reduced DOF model is obtained for a two story frame.

Matzen, Vernon C.↗

Quantifying Rates of Erosion Using Historical Aerial Photos - 19478

Erosion can play an important role in the fate and transport of waste at sites where disposal of long-lived waste is anticipated. The statistical characterization of key processes related to erosion is essential to the understanding of site stability through time. In this work multi-temporal historical aerial images are analyzed in conjunction with orthophotography and Lidar data to develop probability distributions for variables representing important erosion processes. Scans of photographic negatives were obtained for multiple photographs and several negatives were scanned with a calibrated photogrammetric scanner by Geomni (formerly Blue Skies Consulting) in Belen, New Mexico. Other negatives were provided by USDA or scanned on a high-resolution, large format media scanner in the United States National Archives Cartographic Research Room, College Park, Maryland (1939). An additional set of aerial photographs was obtained from the USGS EROS Data Center web site. For other years, photographic prints were available for aerial photography. Several prints were scanned with a large-format media scanner at 1200 dpi. Ground control points for selected digital images used in the stereoscopic analyses were identified in ArcMap. Ground control points were collected by matching features which could be identified in the aerial photography as well as the orthophotography or shaded relief imagery from the Lidar dataset. Such features included fence line intersections, road intersections, railroad bridges, and structures, depending on the age of the photography. Many old fence lines and abandoned roads remained visible in the shaded relief imagery while they were completely obscured by tree canopy in modern photography. Ground control elevations were sampled from the Lidar-based DEM or directly from point clouds. The image coordinates and matching three-dimensional projected coordinates of the ground control points were exported to IDL where parameters for a three-dimensional direct linear transformation (DLT) were obtained. Built-in singular value decomposition routines were used to solve an overdetermined set of equations for the eleven parameters of the DLT for a particular historical photograph. A solution to the DLT parameters was obtained for each historical aerial photograph in which features of interest were identified using the stereoscope. Ultimately, this process resulted in the identification of locations for features like gully heads using both the Lidar dataset and projection of the estimated location from the historical aerial photo under consideration back to the Lidar dataset. The distance between the estimate of the location from the historical image and that of the Lidar dataset was the estimated distance the feature has moved. This distance was then divided by the number of years between the Lidar dataset and the year of the historical aerial image of interest to get a rate of movement through time. This was done for several dozen points on each historical aerial image. There was inevitable uncertainty associated with the estimation of points from the historical aerial imagery. This includes estimation of changes in locations of features like gully heads through time. In this work a method to estimate the uncertainty associated with measurements of locations of features using the stereoscopic analysis is developed and applied. For features with locations in space that do not change (e.g., road intersections, etc.) the difference in measurements of locations from the Lidar dataset and that of the estimate from the historical aerial image provides an observation of the measurement error. These points used to estimate the measurement error are referred to as control points. For each of the historical aerial images, a different measurement error distribution is estimated using control points. These measurement errors are combined with the estimated distances from the stereoscopic analyses to produce distributions of gully retreat rates and hillslope erosion rates used along with output from Erosion Working Group (EWG) Landscape Evolution Models (LEMs) to provide statistical probability distributions for input into the PPA Model. Specifically, gully head retreat rate and gully widening rate were characterized using statistical probability distributions. The central limit theorem was then applied to develop rates that represent long-term averages that are used to inform a PPA Model built in GoldSim. The importance of these rates with respect to characterization of future risk can then assessed using sensitivity analyses. This provides an approach to determine if subsequent reduction of the uncertainty associated with the probability distributions of erosion rates will correspond to meaningful reduction in the estimation of future risk from the site. Ultimately this is a general method that utilizes historical aerial imagery to estimate rates of erosion with uncertainty. This information can be used to inform PPA models to project future risks from a given site. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Tau approximation techniques for identification of coefficients in parabolic PDE

A variant of the Tau method, called the weak Tau method, is developed on the basis of the weak form of the PDE for use in least-squares parameter estimation; also presented is a suitable abstract convergence framework. The emphasis is on the theoretical framework that allows treatment of the weak Tau method when it is applied to a wide class of inverse problems, including those for diffusion-advection equations, the Fokker-Planck model for population dynamics, and damped beam equations. Extensive numerical testing of the weak Tau method has demonstrated that it compares quite favorably with existing methods.

Banks, H. T.↗

Identification and analysis of quasielastic neutrino interactions at MicroBooNE

The study of neutrino oscillations and the extraction of high-accuracy neutrino mixing angles, CP phases, and mass differences, are at the forefront of the worldwide current experimental physics research. Neutrino experiments aim towards a high-precision extraction of these parameters, which requires a good knowledge of the interaction with the detector and target materials. In the energy range most relevant for oscillation studies ($E_\nu \sim$ 0.3 to 3 GeV), the dominant neutrino nucleus interaction is quasi-elastic (QE) scattering. Charged-current quasielastic (CCQE) scattering is the process by which the neutrino produces a charged lepton and removes a single intact nucleon from the nucleus, without producing any additional particles. It is one of the simplest lepton--nucleus interactions in the energy regime relevant for neutrino oscillation experiments. This thesis describes the identification and analysis of CCQE events in a data sample collected in the MicroBooNE detector at Fermilab during 2016; It discusses the isolation of the signal and the background rejection, as well as the extraction of the exclusive flux--integrated cross--sections for neutrino CCQE scattering off argon, $\nu_{\mu} + ^{40}$Ar$\to \mu^{-} + p$, as a function of the kinematics of the outgoing particles emerging from the interaction. We extracted $ \frac{d\sigma}{dp_{\mu}}, \frac{d\sigma}{d\cos\theta_{\mu}}, \frac{d\sigma}{d\phi_{\mu}}$, and $ \frac{d\sigma}{dp_{p}}, \frac{d\sigma}{d\cos\theta_{p}}, \frac{d\sigma}{d\phi_{p}}$. Here $p_p$,$\theta_{p}$,$\phi_p$ ($p_\mu$,$\theta_{\mu}$,$\phi_\mu$) are the momentum and scattering angles of the outgoing proton (muon). The data are in good agreement with predictions of GENIE, the standard event generator used for neutrino oscillation studies. The data confirms and constrains calcu lations essential for the extraction of oscillation parameters.

Cohen, Erez O.↗

Quasars with large proper motions: A selection from the LQAC-5 catalogue combined with Gaia EDR3: Focusing on astrometric and photometric properties

Thanks to the cross-identification between the Gaia EDR3 (E-Data Release 3) catalogue and the quasars’ compiled catalogue LQAC-5 (Large Quasar Astrometric Catalogue-5), accurate astrometric parameters as well as photometric measurements were available for a set of 416 113 quasars. After analysing the astrometric and photometric properties of these quasars, we concentrate our study on objects characterized by significant proper motion, which contradicts the postulate that they are fixed in the celestial sphere. We derived statistical properties of the positions, parallaxes, and proper motions of the quasars cross-matched with Gaia EDR3. We carried out a specific investigation of quasars with a proper motion larger than 10 mas yr -1 , and used colour-colour diagrams in mid-infrared to discriminate these quasars from stellar contamination. We discuss, in detail, a few cases where the abnormal proper motion could be caused by misidentifications. We note that 43% of LQAC-5 quasars were not detected by Gaia EDR3, mainly because of the cut-off magnitude at G = 21. The comparison between r(G) (Gaia) and r (SDSS) shows a normal distribution. The normalized distributions of parallaxes and proper motions are identical to that of the Gaia CRF2, as well as the distribution of the G BP -G RP colour index. We have identified 937 LQAC-5 objects (0.27% of the sample) with Gaia EDR3 proper motion which is significant at the 5σ level. We have clearly shown that below z = 0.35, the integrated magnitude G(r) obtained from SDSS spectra is smaller than G (Gaia), leading to the statement that the quasars are generally resolved under this threshold, which should lead to a bad determination of proper motion. Moreover, to discriminate quasars from stellar contamination, we have plotted them in a mid-infrared colour–colour diagram. Finally, we have made a final selection of 41 objects with μ > 10 mas yr -1 , satisfying drastic constraints, which makes them potential candidates for considering their proper motion as real. In this paper we carried out a complete analysis of the quasars of the LQAC-5 which were cross-identified with Gaia EDR3 ; this serves as an alternative and complementary study with respect to Gaia CRF2, involving a different population of quasars. We selected a set of 41 quasars with a proper motion exceeding 10 mas yr -1 , which can be considered as very high for objects which are a priori fixed in the celestial sphere.

79 ASTRONOMY AND ASTROPHYSICS↗

A Perspective on Traditional and Data Driven Electrochemical Modeling and Analysis

To understand the behavior of electrochemical systems, we need to reduce the dimensionality of the measured current-voltage-time (I-V-t) data by fitting models, thus enabling us to analyze and compare the governing physics. Traditionally, the process for this is an 'expert first' approach: defining the model and its explicit assumptions based on inductive reasoning or empirical observation, fitting small portions of the I-V-t data where assumptions are most valid or carefully designing experiments to enforce key assumptions, and then interpreting the model parameters. However, modern data-driven methods enable a new paradigm: a 'data first' approach, where the latent behaviors governing the system's measured response are identified directly using machine-learning models that optimize both model structure and parameters from the I-V-t data, guaranteeing that the learned model explains as much of the observed system response as possible. After model identification, the model can then be interrogated by an expert to connect observed behaviors with underlying physics. This talk will review several different types of electrochemical analysis (electrochemical impedance, differential voltage-capacity, electrochemical kinetics) and compare the traditional and data-driven methods for analyzing the data.

42 ENGINEERING↗

Nonlinear and Digital Man-machine Control Systems Modeling

An adaptive modeling technique is examined by which controllers can be synthesized to provide corrective dynamics to a human operator's mathematical model in closed loop control systems. The technique utilizes a class of Liapunov functions formulated for this purpose, Liapunov's stability criterion and a model-reference system configuration. The Liapunov function is formulated to posses variable characteristics to take into consideration the identification dynamics. The time derivative of the Liapunov function generate the identification and control laws for the mathematical model system. These laws permit the realization of a controller which updates the human operator's mathematical model parameters so that model and human operator produce the same response when subjected to the same stimulus. A very useful feature is the development of a digital computer program which is easily implemented and modified concurrent with experimentation. The program permits the modeling process to interact with the experimentation process in a mutually beneficial way.

Mekel, R.↗

Comments on 'Luenberger's canonical form revisited'

Results similar to those presented in the paper entitled 'Canonical forms for linear multivariable systems' by Luenberger (1967) have previously been developed for a slightly different version of Luenberger's canonical form. These results are summarized herein to provide an alternate canonical form that can be used for system identification. For certain applications, such as observer design, the canonical form presented is particularly well suited. Both canonical forms provide the same number of undefined parameters.

Denery, D. G.↗

SEASAT - A candidate ocean industry economic verification experiments

The economic benefits of an operational SEASAT system are discussed in the areas of marine transportation, offshore oil and natural gas exploration and development, ocean fishing, and Arctic operations. A description of the candidate economic verification experiments which could be performed with SEASAT-A is given. With the exception of the area of Arctic operations, experiments have been identified in each of the areas of ocean based activity that are expected to show an economic impact from the use of operational SEASAT data. Experiments have been identified in the areas of the offshore oil and natural gas industry, as well as ice monitoring and coastal zone applications. Emphasis has been placed on the identification and the development of those experiments which meet criteria for: (1) end user participation; (2) SEASAT-A data utility; (3) measurability of operational parameters to demonstrate economic effect; and (4) non-proprietary nature of results.

Miller, B. P.↗

Demonstration of various rotor instabilities (exhibit of Bently Rotor Dynamics Research Corporation Laborator rigs at symposium on instability in rotaing machinery)

The operation of rotor rigs used to demonstrate various instability phenomena occurring in rotating machines is described. The instability phenomena demonstrated included oil whirl/whip antiswirl, rub, loose rotating parts, water-lubricated bearing instabilities, and cracked shaft. The rotor rigs were also used to show corrective measures for preventing instabilities. Vibrational response data from the rigs were taken with modern, computerized instrumentation. The rotor nonsynchronous perturbation rig demonstrated modal identification techniques for rotor/bearing systems. Computer-aided data acquisition and presentation, using the dynamic stiffness method, makes it possible to identify rotor and bearing parameters for low modes. The shaft mode demonstrator presented the amplified modal shape line of the shaft excited by inertia forces of unbalance (synchronous perturbation). The first three bending modes of the shaft can be demonstrated. The user-friendly software, Orbits, presented a simulation of rotor precessional motion that is characteristic of various instability phenomena. The data presentation demonstration used data measured on a turbine driven compressor train as an example of how computer aided data acquisition and presentation assists in identifying rotating machine malfunctions.

Muszynska, A.↗