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At least 1,783 records · Page 99

Comparison Between Navier-Stokes and Thin-Layer Computations for Separated Supersonic Flow

In the numerical simulation of high Reynolds-number flow, one can frequently supply only enough grid points to resolve the viscous terms in a thin layer. As a consequence, a body-or stream-aligned coordinate system is frequently used and viscous terms in this direction are discarded. It is argued that these terms cannot be resolved and computational efficiency is gained by their neglect. Dropping the streamwise viscous terms in this manner has been termed the thin-layer approximation. The thin-layer concept is an old one, and similar viscous terms are dropped, for example, in parabolized Navier-Stokes schemes. However, such schemes also make additional assumptions so that the equations can be marched in space, and such a restriction is not usually imposed on a thin-layer model. The thin-layer approximation can be justified in much the same way as the boundary-layer approximation; it requires, therefore, a body-or stream-aligned coordinate and a high Reynolds number. Unlike the boundary-layer approximation, the same equations are used throughout, so there is no matching problem. Furthermore, the normal momentum equation is not simplified and the convection terms are not one-sided differenced for marching. Consequently, the thin-layer equations are numerically well behaved at separation and require no special treatment there. Nevertheless, the thin-layer approximation receives criticism. It has been suggested that the approximation is invalid at separation and, more recently, that it is inadequate for unsteady transonic flow. Although previous comparisons between the thin-layer and Navier-Stokes equations have been made, these comparisons have not been adequately documented.

Degani, David↗

Sculpting a Pre-Planetary Nebula with a Precessing Jet: IRAS 16342-3814

We have imaged the bipolar pre-planetary nebula IRAS 16342-3814 with the Keck adaptive optics (AO) system in four near-infrared bands in the 1.6-4.7 (micro)m range. The lobes, which showed smoothly varying brightness distributions in previous optical images taken with the Hubble Space Telescope, have a limb-brightened appearance in the AO images, with a remarkable corkscrew structure inscribed on the lobe walls. A well-collimated, precessing jet with a diameter less than or approximately equal to 100 AU and a precession period less than or approximately equal to 50 yr, interacting with ambient circumstellar material, is most likely responsible for the corkscrew structure and the lobes, as indicated by a detailed comparison of our observations with published numerical simulations. The very red colors of the lobes in the near-infrared, coupled with their visibility at optical wavelengths, require that at least half, but not all, of the light of the central star be trapped by a compact circumstellar dust cloud heated to approximately 600-700 K and reradiated in the infrared. The lobes are thus illuminated both by the infrared light from this dust cloud as well as by the optical light from the central star.

circumstellar matter↗

Unique Results and Lessons Learned from the TSS Missions

In 1924, Irvin Langmuir and H. M. Mott-Smith published a theoretical model for the complex plasma sheath phenomenon in which they identified some very special cases which greatly simplified the sheath and allowed a closed solution to the problem. The most widely used application is for an electrostatic, or "Langmuir," probe in laboratory plasma. Although the Langmuir probe is physically simple (a biased wire) the theory describing its functional behavior and its current-voltage characteristic is extremely complex and, accordingly, a number of assumptions and approximations are used in the LMS model. These simplifications, correspondingly, place limits on the model's range of application. Adapting the LMS model to real-life conditions is the subject of numerous papers and dissertations. The Orbit-Motion Limited (OML) model that is widely used today is one of these adaptions that is a convenient means of calculating sheath effects. The OML equation for electron current collection by a positively biased body is simply: I is approximately equal to A x j(sub eo) x 2/√𝜋(phi)(exp ½) where A is the area of the body and phi is the electric potential on the body with respect to the plasma. Since the Langmuir probe is a simple biased wire immersed in plasma, it is particularly tempting to use the OML equation in calculating the characteristics of the long, highly biased wires of an Electric Sail in the solar wind plasma. However, in order to arrive at the OML equation, a number of additional simplifying assumptions and approximations (beyond those made by Langmuir-Mott-Smith) are necessary. The OML equation is a good approximation when all conditions are met, but it would appear that the Electric Sail problem lies outside of the limits of applicability.

Stone, Nobie H.↗

Classical symmetries and the Quantum Approximate Optimization Algorithm

Here, we study the relationship between the Quantum Approximate Optimization Algorithm (QAOA) and the underlying symmetries of the objective function to be optimized. Our approach formalizes the connection between quantum symmetry properties of the QAOA dynamics and the group of classical symmetries of the objective function. The connection is general and includes but is not limited to problems defined on graphs. We show a series of results exploring the connection and highlight examples of hard problem classes where a nontrivial symmetry subgroup can be obtained efficiently. In particular, we show how classical objective function symmetries lead to invariant measurement outcome probabilities across states connected by such symmetries, independent of the choice of algorithm parameters or number of layers. To illustrate the power of the developed connection, we apply machine learning techniques toward predicting QAOA performance based on symmetry considerations. We provide numerical evidence that a small set of graph symmetry properties suffices to predict the minimum QAOA depth required to achieve a target approximation ratio on the MaxCut problem, in a practically important setting where QAOA parameter schedules are constrained to be linear and hence easier to optimize.

97 MATHEMATICS AND COMPUTING↗

Approximate optimal guidance for the advanced launch system

A real-time guidance scheme for the problem of maximizing the payload into orbit subject to the equations of motion for a rocket over a spherical, non-rotating earth is presented. An approximate optimal launch guidance law is developed based upon an asymptotic expansion of the Hamilton - Jacobi - Bellman or dynamic programming equation. The expansion is performed in terms of a small parameter, which is used to separate the dynamics of the problem into primary and perturbation dynamics. For the zeroth-order problem the small parameter is set to zero and a closed-form solution to the zeroth-order expansion term of Hamilton - Jacobi - Bellman equation is obtained. Higher-order terms of the expansion include the effects of the neglected perturbation dynamics. These higher-order terms are determined from the solution of first-order linear partial differential equations requiring only the evaluation of quadratures. This technique is preferred as a real-time, on-line guidance scheme to alternative numerical iterative optimization schemes because of the unreliable convergence properties of these iterative guidance schemes and because the quadratures needed for the approximate optimal guidance law can be performed rapidly and by parallel processing. Even if the approximate solution is not nearly optimal, when using this technique the zeroth-order solution always provides a path which satisfies the terminal constraints. Results for two-degree-of-freedom simulations are presented for the simplified problem of flight in the equatorial plane and compared to the guidance scheme generated by the shooting method which is an iterative second-order technique.

Feeley, T. S.↗

Numerical solution for propagation of coupled longitudinal and transverse waves normal to the applied magnetic field in a three-fluid medium.

The solution was obtained without approximating the dispersion relation. This was made possible by the use of a computer method for carrying out the extremely large number of algebraic manipulations involved. The three-fluid model employed accounts for the interaction of the electron, ion, and neutral species. The solution for the e-folding distance describes the damping characteristics of each wave mode. Each of the e-folding solutions corresponds to one of the phase velocity solutions.

Mcclendon, R. W.↗

Numerical Evaluation by Harmonic Analysis of the (Epsilon)-Function of the Theodorsen Arbitrary-Airfoil Potential Theory

Finite trigonometric series is fitted by harmonic analysis as an approximation function to the psi function of the Theodorsen arbitrary-airfoil potential theory. By harmonic synthesis, the corresponding conjugate trigonometric series is used as an approximation to the epsilon function. A set of coefficients of particularly simple form is obtained algebraically for direct calculation of the epsilon values from the corresponding set of psi values. Complete derivation of this process is presented.

Naiman, Irven↗

The semidiscrete Galerkin finite element modeling of compressible viscous flow past an airfoil

The primary project was the numerical simulation, by a finite element/finite difference method, of the viscous flow about an airfoil. The secondary project involved the numerical simulation of the three-dimensional separated and vortex-dominated flow about a hemispherically capped cylinder in the transonic regime. Preliminary calculations were started for the hemisphere-cylinder at 0 and 5 degree angle of attack. The solution of the flow field about airfoils and wings is required to determine the important parameters of lift, moment, and drag. Viscous effects must be accounted for if the drag is to be accurately calculated. At present there are basically two approaches to the numerical simulation of the flow field, the use of fully viscous models and the inviscid/viscous models. The fully viscous models require the solution of an approximation of the Navier-Stokes equations and therefore should simulate most of the physical mechanisms. A fast, accurate, and computationally efficient inviscid flow solver was recently developed by Hartwich. It is thought that Hartwich's program coupled to a fast, accurate, and computationally efficient boundary layer code, will make an excellent tool for airfoil design. The purpose of the primary project was to develop a compressible boundary layer code using the semidiscrete Galerkin finite element method. The numerical scheme employed used the combination of a Dorodnitsyn formulation of the boundary layer equations, with a finite difference/finite element procedure (semidiscrete Galerkin method), in the solution of the compressible two-dimensional boundary layer equations. A laminar compressible boundary layer code was developed and tested for a NACA 0012 airfoil at a Mach number of 0.5, a Reynolds number of 5000, and zero angle of attack. At present the boundary layer program solves up to, but not beyond, separation.

Meade, Andrew J.↗

DeepM&Mnet: Inferring the electroconvection multiphysics fields based on operator approximation by neural networks

Electroconvection is a multiphysics problem involving coupling of the flow field with the electric field as well as the cation and anion concentration fields. Here, we use electroconvection as a benchmark problem to put forward a new data assimilation framework, the DeepM&Mnet, for simulating multiphysics and multiscale problems at speeds much faster than standard numerical methods using pre-trained neural networks. We first pre-train DeepONets that can predict independently each field, given general inputs from the rest of the fields of the coupled system. DeepONets can approximate nonlinear operators and are composed of two sub-networks, a branch net for the input fields and a trunk net for the locations of the output field. DeepONets, which are extremely fast, are used as building blocks in the DeepM&Mnet and form constraints for the multiphysics solution along with some sparse available measurements of any of the fields. We demonstrate the new methodology and document the accuracy of each individual DeepONet, and subsequently we present two different DeepM&Mnet architectures that infer accurately and efficiently 2D electroconvection fields for unseen electric potentials. Furthermore, the DeepM&Mnet framework is general and can be applied for building any complex multiphysics and multiscale models based on very few measurements using pre-trained DeepONets in a “plug-and-play” mode.

97 MATHEMATICS AND COMPUTING↗

Numerical solution of a two-dimensional jet in a supersonic crossflow using an upwind relaxation scheme

A numerical scheme for predicting complex two-dimensional viscous flow fields is presented. The algorithm uses Roe's method for defining the inviscid fluxes and a line relaxation scheme to solve the resulting discrete approximation. The effects of turbulence are modelled using an algebraic eddy viscosity model. An adaptive grid scheme is employed to improve the resolution of complex flow field phenomena. The algorithm is applied to the solution of a sonic jet in a supersonic crossflow. Numerical results are compared with experimental data to validate the numerical approach.

Thompson, D. S.↗

Improved opacity expansion at NNLO for medium induced gluon radiation

When an energetic parton propagates in a hot and dense QCD medium it loses energy by elastic scatterings or by medium-induced gluon radiation. The gluon radiation spectrum is suppressed at high frequency due to the LPM effect and encompasses two regimes that are known analytically: at high frequencies &#x03C9;<!-- ω --> > &#x03C9;<!-- ω --> c = q &#x005E;<!-- ^ --> L 2 , where q &#x005E;<!-- ^ --> is the jet quenching transport coefficient and L the length of the medium, the spectrum is dominated by a single hard scattering, whereas the regime ω < ωc is dominated by multiple low momentum transfers. In this paper, we extend a recent approach (dubbed the Improved Opacity Expansion (IOE)), which allows an analytic (and systematic) treatment beyond the multiple soft scattering approximation, matching this result with the single hard emission spectrum. We calculate in particular the NNLO correction analytically and numerically and show that it is strongly suppressed compared to the NLO indicating a fast convergence of the IOE scheme and thus, we conclude that it is sufficient to truncate the series at NLO. We also propose a prescription to compare the GW and the HTL potentials and relate their parameters for future phenomenological works.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Domain decomposition in the GPU-accelerated Shift Monte Carlo code

The GPU solver within the Shift continuous-energy Monte Carlo neutron transport code has been extended to provide domain decomposition in addition to domain replication to enable the solution of problems with memory requirements exceeding the capacity of a single GPU. The strategy follows the Multiple Set, Overlapping Domain (MSOD) approach that is used in Shift’s CPU solver and integrates into the event-based algorithm used for Shift’s GPU solver. Furthermore, the ability to assign processors to spatial domains non-uniformly has been maintained. In this work, two different approaches for communicating particle data between domains are considered, and multiple criteria for load balancing problems have been investigated. Numerical results are presented for both fresh and depleted small modular nuclear reactor (SMR) cores. A parallel efficiency of approximately 80% was achieved with up to 16 spatial domains measured relative to full domain replication. A scaling study on the Summit supercomputer demonstrates a weak scaling parallel efficiency of over 90% on over 24000 GPUs.

97 MATHEMATICS AND COMPUTING↗

Multidisciplinary benchmarks of a conservative spectral solver for the nonlinear Boltzmann equation

The Boltzmann equation describes the evolution of the phase-space probability distribution of classical particles under binary collisions. Approximations to it underlie the basis for several scholarly fields, including aerodynamics and plasma physics. While these approximations are appropriate in their respective domains, they can be violated in niche but diverse applications which require direct numerical solution of the original nonlinear Boltzmann equation. An expanded implementation of the Galerkin–Petrov conservative spectral algorithm is employed to study a wide variety of physical problems. Enabled by distributed precomputation, solutions of the spatially homogeneous Boltzmann equation can be achieved in seconds on modern personal hardware, while spatially-inhomogeneous problems are solvable in minutes. Here, several benchmarks are presented focusing on accuracy compared to both analytic theoretical predictions and other Boltzmann solvers. These benchmarks span several physical domains including weakly ionized plasma, gaseous fluids, and atomic-plasma interaction.

97 MATHEMATICS AND COMPUTING↗

Definitive Assessment of the Accuracy, Variationality, and Convergence of Relativistic Coupled Cluster and Density Matrix Renormalization Group in 100-Orbital Space

Accuracy, variationality, and convergence underpin the reliability of modern electronic structure methods, yet definitive benchmarks in the relativistic regime remain elusive due to the absence of numerically exact full configuration interaction (CI) references. Recent algorithmic advances in the CI framework, enabled by the small-tensor-product (STP) decomposition approach, have dramatically extended the tractable size of the configuration space, making numerically exact CI calculations feasible in large active spaces previously beyond reach. In this paper, we employ the recently developed STP-CI framework to perform large-scale numerically exact CI calculations and directly benchmark relativistic coupled cluster and density matrix renormalization group methods. Definitive benchmarking of approximate relativistic electronic structure methods is ensured through the application of the gap theorem, which provides rigorous error bounds on the CI reference and establishes a controlled standard for assessing accuracy, variationality, and convergence.

Chemical calculations↗

Drift waves enstrophy, zonal flow, and nonlinear evolution of the modulational instability

The interaction of the drift wave (DW) turbulence and zonal flow (ZF) is investigated with the modified Hasegawa–Mima equation taking into account the backreaction of ZF velocity on DW turbulence. It is shown that the y-averaged enstrophy of DW turbulence and the velocity of ZF are intrinsically related. By utilizing this feature, a nonlinear stage of DW modulational instability is considered within the framework of the wave kinetic equation. It is shown that in this approximation, the nonlinear stage of the modulational instability results in the collapsing solutions, accompanied by the “wave breaking” phenomenon. Numerical simulations based on the Hasegawa–Mima equation show that for a weak DW turbulence, Φ ̃ = ( e φ ̃ / T e ) ( L n / ρ s ) ⪝ 1 , the collapsing-like features on both ZF and y-averaged enstrophy of DW turbulence decay in time and then re-emerge again at different locations. For the case of a strong DW turbulence, Φ ̃ > 1 , where nonlinear interactions of DW harmonics dominate, stable spatial structures of ZF and y-averaged enstrophy of DW turbulence emerge.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Effect of parallel flow on resonant layer responses in high beta plasmas

Abstract Resonant layers in a tokamak respond to non-axisymmetric magnetic perturbations by amplifying the mode amplitude and balancing the plasma rotation through magnetic reconnection and force balance, respectively. This resonant response can be characterized by local layer parameters and especially by a single quantity in the linear regime, the so-called inner-layer Δ. The computation of Δ under two-fluid drift-MHD formalism has been progressed by reducing the order of the system in the phase space, where the shielding current is approximated as being only carried by electrons, a posteriori . In this study, we relax the approximation and compute Δ accounted for by the parallel flow associated with the ion shielding current. The posteriori is numerically verified in great agreement with the original SLAYER developed in a previous paper (J.-K. Park 2022 Phys. Plasmas 29 072506). Extending the resonant layer response theory to high β plasmas, our research findings answer two important questions: how the parallel flow influences the resonant layer response and why the parallel flow effect appears in high β plasmas. The complicated plasma compression in high β regime allows the parallel flow response to give rise to the ion shielding current, which not only shifts the zero-crossing condition of the ExB flow but also enhances the field penetration threshold. Technically, the Riccati matrix transformation method is adapted to handle the numerical stiffness due to the increased order of the system. The high fidelity of this numerical method makes use of further extension of the model to higher-order systems to take other physical phenomena into account. This work is envisaged to predict the resonant layer response under high β fusion reactor conditions.

Lee, Yeongsun (ORCID:000000034474416X)↗

Validity of Machine Learning in the Quantitative Analysis of Complex Scanning Near-Field Optical Microscopy Signals Using Simulated Data

Scattering-type scanning near-field optical microscope (s-SNOM) is a modern technique for subdiffractional optical imaging and spectroscopy. Over the past two decades, tremendous efforts have been devoted to modeling complex tip-sample interactions in s-SNOM, aimed at understanding the electrodynamics of materials at the nanoscale. However, due to complexities in analytical methods and the limited computation power for fully numerical simulations, compromises must be made to facilitate the modeling of tip-sample interaction, such as using quasistatic approximation or unrealistic tip geometries. Here, we apply a variety of widely utilized machine-learning methods, including k nearest neighbor and feedforward neural network etc. to study the phase-resolved spectroscopic near-field response. With only a small set of training data, which is simulated using the finite-dipole model, we demonstrate that the relation between the experimental near-field signal and sample optical constant can be one to one mapped without the need for tip modeling: for a given material with a moderate dielectric function, its complex near-field spectrum can be accurately determined within the mid-IR spectral range, and vice versa. Our preliminary study sets the stage for future exploration using real experimental data. Our method is beneficial for processing the increasing amount of data accumulated across many research groups and especially useful for user facilities such as synchrotron-based national laboratories where a large amount of data is generated on a daily basis.

36 MATERIALS SCIENCE↗

Hamiltonian parameter inference from resonant inelastic x-ray scattering with active learning

Identifying model Hamiltonians is a vital step toward creating predictive models of materials. Here, in this study, we combine Bayesian optimization with the EDRIXS numerical package to infer Hamiltonian parameters from resonant inelastic x-ray scattering (RIXS) spectra within the single atom approximation. To evaluate the efficacy of our method, we test it on experimental RIXS spectra of NiPS 3 , NiCl 2 , Ca 3 ⁢LiOsO 6 , and Fe 2⁢ O 3 , and demonstrate that it can reproduce results obtained from hand-fitted parameters to a precision similar to expert human analysis while providing a more systematic mapping of parameter space. Our work provides a key first step toward solving the inverse scattering problem to extract effective multi-orbital models from information-dense RIXS measurements, which can be applied to a host of quantum materials. We also propose atomic model parameter sets for two materials, Ca 3⁢ LiOsO 6 and Fe 2⁢ O 3 , that were previously missing from the literature.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗