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At least 1,315 records · Page 73

$\text{GPLaSDI}$: Gaussian Process-based interpretable Latent Space Dynamics Identification through deep autoencoder

Numerically solving partial differential equations (PDEs) can be challenging and computationally expensive. This has led to the development of reduced-order models (ROMs) that are accurate but faster than full order models (FOMs). Recently, machine learning advances have enabled the creation of non-linear projection methods, such as Latent Space Dynamics Identification (LaSDI). LaSDI maps full-order PDE solutions to a latent space using autoencoders and learns the system of ODEs governing the latent space dynamics. By interpolating and solving the ODE system in the reduced latent space, fast and accurate ROM predictions can be made by feeding the predicted latent space dynamics into the decoder. In this paper, we introduce GPLaSDI, a novel LaSDI-based framework that relies on Gaussian process (GP) for latent space ODE interpolations. Using GPs offers two significant advantages. First, it enables the quantification of uncertainty over the ROM predictions. Second, leveraging this prediction uncertainty allows for efficient adaptive training through a greedy selection of additional training data points. This approach does not require prior knowledge of the underlying PDEs. Consequently, GPLaSDI is inherently non-intrusive and can be applied to problems without a known PDE or its residual. Here we demonstrate the effectiveness of our approach on the Burgers equation, Vlasov equation for plasma physics, and a rising thermal bubble problem. Our proposed method achieves between 200 and 100,000 times speed-up, with up to 7% relative error.

97 MATHEMATICS AND COMPUTING↗

The analysis of high spatial resolution UV and X-ray images by computational modeling

Very high resolution stereoscopic images of high temperature loop structures observed at UV and X-ray wavelengths in the solar corona can be used to understand physical processes in the corona. An existing computational model is described and sample results are given to demonstrate that computational modeling of coronal structures can indeed take advantage of very high resolution images. The sample results include the run of temperature and number density along a typical loop and the variation of the differential emission measure with temperature. The integration of the differential emission measure with temperature along a column commensurate with an instrument's spatial resolution is the relevant parameter obtained from UV and X-ray observations. The effects of loop geometry and energy input are examined.

Vesecky, J. F.↗

Non-contact temperature measurement requirements of ground-based research and flight programs at JPL

The Modular Containerless Processing Facility project is responsible for the development of flight equipment and of the accompanying scientific and technological research necessary to carry out containerless investigations in the low gravity of earth orbit. The requirement for sample temperature measurement is just one of the many physical properties determination needs that must be satisfied before the useful exploitation of low gravity and containerless experimentation techniques can be achieved. The specific implementation of temperature measurement for the ground-based research program is different from that of the flight hardware development project. The needs of the latter must also be differentiated according to the chronological order of the relevant space flight missions. Immediate demands of Spacelab instruments must be addressed by the adaptation of existing reliable technology to the special and restrictive on-orbit environment, while more advanced and yet unperfected techniques will be assigned to enterprises further in the future. The wide range of application of the containerless methods to the study of phenomena involving different states of matter and environmental conditions requires the satisfaction of a variety of boundary conditions through different approaches. An important issue to be resolved will be whether an integrated program dedicated to solve the problems of all the microgravity experimental effort will allow the solution of specific demands of existing as well as future flight equipment.

Trinh, E. H.↗

Core formation in asteroids

The chemical and physical aspects of metal segregation in asteroids are considered. Evidence for the existence of metallic cores in asteroids, meteorite parent bodies, and planetesimals and for the amount of melting required to form cores is reviewed, and the physics of metal segregation is discussed. These considerations lead to the conclusion that about 50 percent of melting is required for metal to drain away and form a core. It is pointed out that such high amounts of melting were not always attained in asteroids, indicating that many asteroids might consist of partially differentiated silicates and metallic masses that did not segregate to a core. It is suggested that S asteroids might represent such partially differentiated bodies.

Taylor, G. J.↗

Summary of the Third AIAA CFD Drag Prediction Workshop

The workshop focused on the prediction of both absolute and differential drag levels for wing-body and wing-al;one configurations of that are representative of transonic transport aircraft. The baseline DLR-F6 wing-body geometry, previously utilized in DPW-II, is also augmented with a side-body fairing to help reduce the complexity of the flow physics in the wing-body juncture region. In addition, two new wing-alone geometries have been developed for the DPW-II. Numerical calculations are performed using industry-relevant test cases that include lift-specific and fixed-alpha flight conditions, as well as full drag polars. Drag, lift, and pitching moment predictions from previous Reynolds-Averaged Navier-Stokes computational fluid Dynamics Methods are presented, focused on fully-turbulent flows. Solutions are performed on structured, unstructured, and hybrid grid systems. The structured grid sets include point-matched multi-block meshes and over-set grid systems. The unstructured and hybrid grid sets are comprised of tetrahedral, pyramid, and prismatic elements. Effort was made to provide a high-quality and parametrically consistent family of grids for each grid type about each configuration under study. The wing-body families are comprised of a coarse, medium, and fine grid, while the wing-alone families also include an extra-fine mesh. These mesh sequences are utilized to help determine how the provided flow solutions fair with respect to asymptotic grid convergence, and are used to estimate an absolute drag of each configuration.

Vassberg, John C.↗

APOLLO: a facility-scale differentiable virtual accelerator at Fermilab FAST/IOTA

As the design complexity of modern accelerators grows, there is more interest in using advanced simulations that have fast execution time or yield additional insights like gradients. The FAST/IOTA facility has been working on implementing and experimentally validating an end-to-end digital twin that is both fast and gradient-aware, allowing for rapid prototyping of new software and experiments with minimal beam time costs. Our framework integrates physics and ML codes for linac and ring simulation through a set of generic interfaces between surrogate and physics-based sections. To reproduce device inputs and outputs, system state is exposed as a deterministic event loop in a specialized discrete event simulator architecture. Because Fermilab is undergoing control system transition, several APIs were implemented as final user interfaces - a fully asynchronous EPICS soft IOC, a gRPC-based Data Pool Manager (DPM), and legacy ACNET protocols. We discuss implementation details as well as challenges handling live data assimilation and future plans to extend modelling to main complex proton accelerators like PIPII and Booster.

Kuklev, Nikita [Fermilab]↗

A Miniature Multilevel Structures for Lossless Ion Manipulations Ion Mobility Spectrometer with Wide Mobility Range Separation Capabilities

Here, ion mobility spectrometry employing structures for lossless ion manipulations (SLIM-IMS) is an attractive gas-phase separation technique due to its ability to achieve unprecedented effective ion path lengths (>1 km) and IMS resolving powers in a small footprint. The emergence of multilevel SLIM technology, where ions are transferred between vertically stacked SLIM electrode surfaces, has subsequently allowed for ultralong single pass path lengths (>40 m) to be achieved, enabling ultrahigh resolution IMS measurements to be performed over the entire mobility range in a single experiment. The implementation of multiple SLIM levels requires very little additional space for the SLIM system, and we developed a miniature SLIM module (miniSLIM) based on multilevel SLIM technology and report the performance here. The module is 11.1 cm x 6.7 cm x 1.4 cm (L x W x H) and consists of three SLIM levels totaling 1-meter path length. Ion trajectory simulations were used to optimize the SLIM board spacings and SLIM board thicknesses of the miniSLIM IMS system. Methods of efficiently transferring ions between SLIM levels were examined and a new approach using asymmetric traveling waves (TWs) was developed and implemented in the miniSLIM. We experimentally characterized the performance of the --meter multilevel miniSLIM IMS-MS relative to a drift tube IM--MS using an Agilent tuning mixture and tetraalkylammonium cations. The 1-meter miniSLIM achieved a resolving power of up to 131 (CCS/ΔCCS), ~1.5x higher than achievable with a 78 cm path length drift tube IMS, and successfully transmitted the entire ion mobility range in a single separation. We also demonstrated the miniSLIM’s performance as a standalone IMS system (i.e., without MS), showing baseline separation between Agilent tuning mixture cations with the full mobility range observed, and a standard peptide mixture with different charge states readily differentiated. Overall the miniSLIM provides a compact alternative to high performance IMS instruments possessing similar path lengths.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Structural Complexity and Tuned Thermoelectric Properties of a Polymorph of the Zintl Phase Ca 2 CdSb 2 with a Non-centrosymmetric Monoclinic Structure

The Zintl phase Ca 2 CdSb 2 was found to be dimorphic. Besides the orthorhombic Ca 2 CdSb 2 (-o), here we report on the synthesis, the structural characterization, and the thermoelectric transport properties of its monoclinic form, Ca 2 CdSb 2 (-m), and its Lu-doped variant Ca 2–x Lu x CdSb 2 (x ≈ 0.02). The monoclinic structure exhibits complex structural characteristics and constitutes a new structure type with the non-centrosymmetric space group Cm (Z = 30). The electrical resistivity ρ(T) measured on single crystals of both phases portrays a transition from a semiconductor to a degenerate p-type semiconductor upon doping with Lu and with an attendant change in the Hall carrier concentration nH from 7.15 × 10 18 to 2.30 × 10 19 cm –3 at 300 K. The Seebeck coefficient S(T) of both phases are comparable and indicate a hole-dominated carrier transport mechanism with magnitudes of 133 and 116 μV/K at 600 K for Ca 2 CdSb 2 (-m) and Ca 2–x Lu x CdSb 2 , respectively. The convoluted atomic bonding with an attendant large unit cell volume of ~4365 Å 3 drives a putative low thermal conductivity in these materials resulting in a power factor PF of 1.63 μW/cm K 2 and an estimated thermoelectric figure of merit zT of ~0.5 for Ca 2–x Lu x CdSb 2 at 600 K. Furthermore, differential scanning calorimetry results reveal the stability of these phases up to about 960 K, making them candidates for moderate temperature thermoelectric materials.

36 MATERIALS SCIENCE↗

An Orbital Basis Set for Double Photoionization of Atoms and Molecules

The ab initio theoretical treatment of one-photon double photoionization processes has been limited to atoms and diatomic molecules by the challenges posed by large grid-based representations of the double ionized continuum wave function. To provide a path for extensions to polyatomics, an energy-adapted orbital basis approach is demonstrated that reduces the dimensions of such representations and simultaneously allows larger time steps in time-dependent computational descriptions of double ionization. Additionally, an algorithm that exploits the diagonal nature of the two-electron integrals in the grid basis and dramatically accelerates the transformation between grid and orbital representations is presented. Excellent agreement between the present results and benchmark theoretical calculations is found for H – and Be atoms, as well as the hydrogen molecule, including for the triply differential cross sections that relate the angular distribution and energy sharing of all of the particles in the molecular frame.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The transport dynamics of tens of micrometer-sized water droplets in RF atmospheric pressure glow discharges

Abstract Charging of particles having diameters of tens of microns has been extensively studied at atmospheric pressure in the context of, for example, electrostatic precipitators where the focus was on unipolar charging. The ambipolar charging of particles in atmospheric pressure plasmas, and of droplets in particular, has received less attention. The plasma activation of droplets is of interest for water purification, fertilizer production and materials synthesis, all of which depend on the transport of the droplets through the plasma, which in turn depends on their charging. In this paper, we report on the transport dynamics of water droplets, tens of microns in diameter, carried by the gas flow through an atmospheric pressure radiofrequency glow discharge sustained in helium. The droplets pass through the plasma with minimal evaporation and without reaching the Rayleigh limit. The droplet trajectory in the presence and absence of the plasma provides insights on the forces acting on the droplet. The measurements were analyzed using results from a three-dimensional fluid model and a two-dimensional plasma hydrodynamics model. We found that the transport dynamics as the droplet enters and leaves the plasma are due to differential charging of the droplet in the plasma gradients of the bounding sheaths to the plasma.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Fractional Modeling in Action: A Survey of Nonlocal Models for Subsurface Transport, Turbulent Flows, and Anomalous Materials

Modeling of phenomena such as anomalous transport via fractional-order differential equations has been established as an effective alternative to partial differential equations, due to the inherent ability to describe large-scale behavior with greater efficiency than fully-resolved classical models. In this review article, we first provide a broad overview of fractional-order derivatives with a clear emphasis on the stochastic processes that underlie their use. We then survey three exemplary application areas – subsurface transport, turbulence, and anomalous materials – in which fractional-order differential equations provide accurate and predictive models. For each area, we report on the evidence of anomalous behavior that justifies the use of fractional-order models, and survey both foundational models as well as more expressive state-of-the-art models. We also propose avenues for future research, including more advanced and physically sound models, as well as tools for calibration and discovery of fractional-order models.

97 MATHEMATICS AND COMPUTING↗

Muon-Neutrino Charged-Current Cross Sections from MicroBooNE: First Simultaneous Measurements of Final States with and without Protons for Muon-Neutrino Scattering on Argon

A detailed understanding of muon neutrino charged-current interactions on argon is crucial to the study of neutrino oscillations in current and future experiments using liquid argon time projection chambers. To help fill this need, MicroBooNE has produced a comprehensive set of cross section measurements which simultaneously probe the leptonic and hadronic systems by dividing the inclusive channel into final states with and without protons. Data-driven model validation utilizing the conditional constraint formalism is employed to detect mismodeling that may bias the nominal flux averaged cross section results, which are extracted with the Wiener-SVD unfolding method. The results are compared to widely used event generator predictions revealing significant mismodeling of final states without protons, possibly due to insufficient treatment of final state interactions. These are first differential muon neutrino-argon cross section measurements made simultaneously for final states with and without protons and provide novel information that will help stimulate the improvement of event generator modeling.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

First Extraction of Single Differential Cross-Sections on Argon for CC1$\mu$2p0$\pi$ Event Topologies in the MicroBooNE Detector

The precise measurement of cross-sections for a variety of interactions is critical to the success of forthcoming flagship neutrino experiments. Of special interest are neutrino interactions that leave the nucleus in a 2-particle 2-hole state (2p2h). This note will present the first cross-section measurement for the production of 2p2h states on argon. Using MicroBooNE data collected from the first three years of operation, we select events corresponding to a charged-current $ν_µ$ interaction that left the argon nucleus in a 2p2h state. These interactions produce a topology with one muon and two protons in the final state (CC1$\mu$2p0$\pi$). This analysis targets a single differential cross-section measurement for CC1$\mu$2p0$\pi$ event topologies in a variety of kinematic variables. Comparisons are made to a set of theoretical models that explore different cross-section modeling configurations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

A physics-based ensemble machine-learning approach to identifying a relationship between lightning indices and binary lightning hazard

To convert lightning indices generated by numerical weather prediction experiments into binary lightning hazard, a machine-learning tool was developed. This tool, consisting of parallel multilayer perceptron classifiers, was trained on an ensemble of planetary boundary layer schemes and microphysics parameterizations that generated four different lightning indices over 1 week. In a subsequent week, the multi-physics ensemble was applied and the machine-learning tool was used to evaluate the accuracy. Unintuitively, the machine-learning tool performed better on the testing dataset than the training dataset. Much of the error may be attributed to mischaracterizing the convection. The combination of the machine learning model and simulations could not differentiate between cloud-to-cloud lightning and cloud-to-ground lightning, despite being trained on cloud-to-ground lightning. It was found that the simulation most representative of the local operational model was the most accurate simulation tested.

54 ENVIRONMENTAL SCIENCES↗

Remote sensing of chlorophyll and temperature in marine and fresh waters.

An airborne differential radiometer was demonstrated to be a sensitive, real-time detector of surface chlorophyll content in water bodies. The instrument continuously measures the difference in radiance between two wavelength bands, one centered near the maximum of the blue chlorophyll a absorption region and the other at a reference wavelength outside this region. Flights were made over fresh water lakes, marine waters, and an estuary, and the results were compared with 'ground truth' measurements of chlorophyll concentration. A correlation between output signal of the differential radiometer and the chlorophyll concentration was obtained. Examples of flight data are illustrated. Simultaneous airborne measurements of chlorophyll content and water temperature revealed that variations in chlorophyll are often associated with changes in temperature. Thus, simultaneous sensing of chlorophyll and temperature provides useful information for studies of marine food production, water pollution, and physical processes such as upwelling.

Arvesen, J. C.↗

On phase and ray directions of magnetosonic waves

The behavior of phase speed for 'slow' and 'fast' magnetosonic waves is well documented in the literature. Not so well documented is the behavior of the ray direction and its relation to the phase direction - indeed the ray behavior recorded in most of the standard plasma physics texts has not been found. This situation is rectified, and some of the curiosities associated with the direction of the 'slow' ray relative to the direction of the 'slow' phase wave are indicated. These calculations have been performed as a necessary basis for discussion of phase and ray evolution of magnetosonic waves in differentially shearing plasmas.

Lerche, I.↗

Distributed system modeling of a large space antenna

A general approach for distributed parameter modeling of complex dynamical systems is described. The method consists of dividing the system in parts which can be modeled by simple partial differential equations and coupling the equations thus obtained by applying Hamilton's variational formalism to the entire system. The modeling of a large, offset-fed, wrap-rib antenna is presented to illustrate the approach. Although such models are perhaps not as precise as finite element models, they can be useful for initial physical insight and parametric design.

Hamidi, M.↗

A new approach for shaping of dual-reflector antennas

The shaping of 2-D dual-reflector antenna systems to generate a prescribed distribution with uniform phase at the aperture of the second reflector is examined. This method is based on the geometrical nature of Cassegrain and Gregorian dual-reflector antennas. The method of syntheses satisfies the principles of geometrical optics which are the foundations of dual-reflector designs. Instead of setting up differential equations or heuristically designing the subreflector, a set of algebraic equations is formulated and solved numerically to obtain the desired surfaces. The caustics of the reflected rays from the subreflector can be obtained and examined. Several examples of 2-D dual-reflector shaping are shown to validate the study. Geometrical optics and physical optics are used to calculate the scattered fields from the reflectors.

Lee, Teh-Hong↗