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NASA NTRS1996

The Effects of Acoustic Treatment on Pressure Disturbances From a Supersonic Jet in a Circular Duct

The pressure disturbances generated by an instability wave in the shear layer of a supersonic jet are studied for an axisymmetric jet inside a lined circular duct. For the supersonic jet, locally linear stability analysis with duct wall boundary conditions is used to calculate the eigenvalues and the eigenfunctions at each axial location. These values are used to determine the growth rates and phase velocities of the instability waves and the near field pressure disturbance patterns. The study is confined to the dominant Kelvin-Helmholtz instability mode and to the region just downstream of the nozzle exit where the shear layer is growing but is still small in size compared to the radius of the duct. Numerical results are used to study the effects of changes in the outer flow, growth in the shear layer thickness, wall distance, and wall impedance, and the effects of these changes on non-axisymmetric modes. The primary results indicate that the effects of the duct wall on stability characteristics diminish as the outer flow increases and as the jet azimuthal mode number increases. Also, wall reflections are reduced when using a finite impedance boundary condition at the wall; but in addition, reflections are reduced and growth rates diminished by keeping the imaginary part of the impedance negative when using the negative exponential for the harmonic dependence.

Dahl, Milo D.↗

NASA NTRS1997

Effects of Acoustically Lined Cylindrical Ducts on Instability Waves in Confined Supersonic Jets

The pressure disturbances generated by an instability wave in the shear layer of a supersonic jet are studied for an axisymmetric jet inside a lined cylindrical duct. For the supersonic jet, locally linear stability analysis with duct wall boundary conditions is used to calculate the eigenvalues and the eigenfunctions. These values are used to determine the growth rates and phase velocities of the instability waves and the radial pressure disturbance patterns. The study is confined to the dominant Kelvin-Helmholtz instability mode and to the region just downstream of the nozzle exit where the shear layer is growing but is still small in size compared to the radius of the duct. Numerical results are used to study the effects of changes in the outer flow, growth in the shear layer thickness, wall distance, wall impedance, and frequency. Results indicate that the effects of the duct wall on shear layer growth rates diminish as the outer flow increases. Also, wall reflections cause variations in growth rates depending on wall height and Strouhal number. These variations are due to the phase relationship between the outgoing and the reflected incoming pressure disturbances at the shear layer. The growth rate variations can be reduced and the maximum growth rate minimized by keeping the imaginary part of the impedance negative.

Dahl, Milo D.↗

DOE OSTI2022

Extension of the PINN diffusion model to k-eigenvalue problems

This paper extends our recent work on the Physics-Informed Neural Networks (PINN) approach for the fixed source diffusion models and applies it to the diffusion theory based k-eigenvalue problems. To make the PINN equitable for the eigenvalue problems, we introduce a novel integral regularization term to the loss function in the framework, and allow the direct inference of the principal eigenvalue and the associated eigenfunction. The regularization term enforces a pre-defined value on the integration of the model predictions, and this value can be directly related to a physical property of the system. We also introduce an additional learnable parameter to approximate the principal eigenvalue. As a proof of principle, we solve the one-group two-dimensional k-eigenvalue neutron diffusion equation in this work. We then provide two numerical examples to demonstrate the applicability of the PINN approach. In each example, we solve the k-eigenvalue diffusion equation in a multi-region configuration constrained with a set of Robin boundary conditions for generality. We use a FEM solution based on the power-iteration method to verify the results of the PINN solution. The results showed relative percentage error in the predicted eigenvalue of about 0.77% and about 1.2% for example 1 and example 2, respectively. The mean absolute error in the predicted flux for example 1 is ∼ 0.002 and for example 2 is ∼ 0.0024. These results indicate some preliminary successes of the PINN application to k-eigenvalue problems. (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

DOE OSTI2021

Electronic structure of chromium trihalides beyond density functional theory

In this work, we explore the electronic band structure of freestanding monolayers of chromium trihalides Cr X 3 , X = Cl, Br, I, within an advanced ab initio theoretical approach based on the use of Green's function functionals. We compare the local density approximation with the quasiparticle self-consistent GW (QS GW ) approximation and its self-consistent extension ( QS G W ^ ) by solving the particle-hole ladder Bethe-Salpeter equations to improve the effective interaction W . We show that, at all levels of theory, the valence band consistently changes shape in the sequence Cl → Br → I , and the valence band maximum shifts from the M point to the Γ point. By analyzing the dynamic and momentum-dependent self-energy, we show that QS G W ^ adds to the localization of the systems in comparison with QS GW , thereby leading to a narrower band and reduced amount of halogens in the valence band manifold. Further analysis shows that X = Cl is most strongly correlated, and X = I is least correlated (most bandlike) as the hybridization between Cr d and X p enhances in the direction Cl → Br → I . For CrBr 3 and CrI 3 , we observe remarkable differences between the QS GW and QS G W ^ valence band structures, while their eigenfunctions are very similar. We show that weak perturbations, like moderate strain, weak changes to the d - p hybridization, and adding small U , can flip the valence band structures between these two solutions in these materials.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS1981

Efficient computation of the stability of three-dimensional compressible boundary layers

Methods for the computer analysis of the stability of three-dimensional compressible boundary layers are discussed and the user-oriented Compressible Stability Analysis (COSAL) computer code is described. The COSAL code uses a matrix finite-difference method for local eigenvalue solution when a good guess for the eigenvalue is available and is significantly more computationally efficient than the commonly used initial-value approach. The local eigenvalue search procedure also results in eigenfunctions and, at little extra work, group velocities. A globally convergent eigenvalue procedure is also developed which may be used when no guess for the eigenvalue is available. The global problem is formulated in such a way that no unstable spurious modes appear so that the method is suitable for use in a black-box stability code. Sample stability calculations are presented for the boundary layer profiles of an LFC swept wing.

Malik, M. R.↗

NASA NTRS1982

Finite-difference solution of the compressible stability eigenvalue problem

A compressible stability analysis computer code is developed. The code uses a matrix finite difference method for local eigenvalue solution when a good guess for the eigenvalue is available and is significantly more computationally efficient than the commonly used initial value approach. The local eigenvalue search procedure also results in eigenfunctions and, at little extra work, group velocities. A globally convergent eigenvalue procedure is also developed which may be used when no guess for the eigenvalue is available. The global problem is formulated in such a way that no unstable spurious modes appear so that the method is suitable for use in a black box stability code. Sample stability calculations are presented for the boundary layer profiles of a Laminar Flow Control (LFC) swept wing.

Malik, M. R.↗

NASA NTRS1987

Linear stability analysis of three-dimensional compressible boundary layers

A compressible stability analysis computer code is developed. The code uses a matrix finite-difference method for local eigenvale solution when a good guess for the eigenvalue is available and is significantly more computationally efficient than the commonly used inital-value approach. The local eigenvalue search procedure also results in eigenfunctions and, at little extra work, group velocities. A globally convergent eigenvalue procedure is also developed that may be used when no guess for the eigenvalue is available. The global problem is formulated in such a way that no unstable spurious modes appear so that the method is suitable for use in a black-box stability code. Sample stability calculations are presented for the boundary layer profiles of an LFC swept wing.

Malik, Mujeeb R.↗

DOE OSTI2023

Accurate Prediction of HSE06 Band Structures for a Diverse Set of Materials Using Δ-Learning

Here we used machine learning (ML) to accurately predict eigenvalues of the hybrid HSE06 functional using eigenvalues computed by the less computationally expensive PBE functional and associated electronic features based on the k-point resolved atomic band character. The ML model was trained by using eigenvalues from only one k-point for each of the 168 compounds in the training set. The HSE06 eigenvalues across all k-points were then predicted for a separate set of 169 compounds with a mean absolute error (MAE) of 0.13 eV, representing a significant improvement over the error of PBE-computed eigenvalues relative to that of HSE06 (MAE = 0.96 eV). These accurately predicted eigenvalues result in remarkably accurate predictions for the band structures, projected density of states, and band gaps, even though the model was not explicitly trained on these other properties. Finally, we demonstrate that our ML model has a similar accuracy for both ternary and quaternary compounds well outside the initial training set and on systems with 112 and 160 atoms, demonstrating its potential to rapidly predict HSE06-quality electronic structures of complex materials that are practically unfeasible for HSE06.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2021

Sparsity of Radiating Characteristic Modes on Infinite Periodic Structures

Characteristic modes on infinite periodic structures are studied using spectral dyadic Green’s functions. This formulation demonstrates that, in contrast to the modal analysis of finite structures, the number of radiating characteristic modes is limited by unit cell size and incident wave vector (i.e., scan angle or phase shift per unit cell). Here, the reflection tensor is decomposed into modal contributions from radiating modes, indicating that characteristic modes are a predictably sparse basis in which to study reflection phenomena.

42 ENGINEERING↗

DOE OSTI2023

Fault Detection via Occupation Kernel Principal Component Analysis

Reliable operation of automatic systems is heavily dependent on the ability to detect faults in the underlying dynamics. While traditional model-based methods have been widely used for fault detection, data-driven approaches have garnered increasing attention due to their ease of deployment and minimal need for expert knowledge. In this letter, we present a novel principal component analysis (PCA) method that uses occupation kernels. Occupation kernels result in feature maps that are tailored to the measured data, have inherent noise-robustness due to the use of integration, and can utilize irregularly sampled system trajectories of variable lengths for PCA. The occupation kernel PCA method is used to develop a reconstruction error approach to fault detection and its efficacy is validated using numerical simulations.

42 ENGINEERING↗

DOE OSTI2023

A Refinement-by-Superposition -Method for (curl)- and (div)-Conforming Discretizations

Here, we present refinement-by-superposition (RBS) hp-refinement infrastructure for computational electromagnetics (CEMs), which permits exponential rates of convergence. In contrast to dominant approaches to hp-refinement for continuous Galerkin methods, which rely on explicit constraint equations, the multilevel strategy presented drastically reduces the implementation complexity. Through the RBS methodology, enforcement of continuity occurs by construction, enabling arbitrary levels of refinement with ease, and without the practical (but not theoretical) limitations of constrained-node refinement. We outline the construction of the RBS hp-method for refinement with H (curl)- and H (div)-conforming finite cells. Numerical simulations for the 2-D finite element method (FEM) solution of the Maxwell eigenvalue problem demonstrate the effectiveness of RBS hp-refinement. As an additional goal of this work, we aim to promote the use of mixed-order (low- and high-order) elements in practical CEM applications.

42 ENGINEERING↗

NASA NTRS1980

Note on the eigensolution of a homogeneous equation with semi-infinite domain

The 'variation-iteration' method using Green's functions to find the eigenvalues and the corresponding eigenfunctions of a homogeneous Fredholm integral equation is employed for the stability analysis of fluid hydromechanics problems with a semiinfinite (infinite) domain of application. The objective of the study is to develop a suitable numerical approach to the solution of such equations in order to better understand the full set of equations for 'real-world' flow models. The study involves a search for a suitable value of the length of the domain which is a fair finite approximation to infinity, which makes the eigensolution an approximation dependent on the length of the interval chosen. In the examples investigated y = 1 = a seems to be the best approximation of infinity; for y greater than unity this method fails due to the polynomial nature of Green's functions.

Wadia, A. R.↗

NASA NTRS1985

Multigrid method for nearly singular and slightly indefinite problems

This paper deals with nearly singular, possibly indefinite problems for which the usual multigrid solvers converge very slowly or even diverge. The main difficulty is related to some badly approximated smooth functions which correspond to eigenfunctions with nearly zero eigenvalues. A correction to the usual coarse-grid equations is derived, both in the correction scheme and in the full approximation scheme. The performance of the new algorithm using this correction is essentially as that of usual multigrid for definite problems.

Brandt, A.↗

NASA NTRS1986

Multigrid method for nearly singular and slightly indefinite problems

Brandt, A.↗

NASA NTRS1996

A Computer Program for the Computation of Running Gear Temperatures Using Green's Function

A new technique has been developed to study two dimensional heat transfer problems in gears. This technique consists of transforming the heat equation into a line integral equation with the use of Green's theorem. The equation is then expressed in terms of eigenfunctions that satisfy the Helmholtz equation, and their corresponding eigenvalues for an arbitrarily shaped region of interest. The eigenfunction are obtalned by solving an intergral equation. Once the eigenfunctions are found, the temperature is expanded in terms of the eigenfunctions with unknown time dependent coefficients that can be solved by using Runge Kutta methods. The time integration is extremely efficient. Therefore, any changes in the time dependent coefficients or source terms in the boundary conditions do not impose a great computational burden on the user. The method is demonstrated by applying it to a sample gear tooth. Temperature histories at representative surface locatons are given.

GREENS FUNCTIONS↗

NASA NTRS1974

Multiple eigenvalues of sound-absorbing circular and annular ducts

Eigenvalue equations of the form D(lambda) = 0 are studied for acoustic modes in circular and annular ducts without flow. The ducts have locally reacting walls with arbitrary wall admittance. It is shown that circular ducts may have double eigenvalues, or wall admittances where both D(lambda) and D prime (lambda) are zero. These double eigenvalues are formed by the coalescence of the lowest-order eigenfunction with some higher-order eigenfunction. The eigenfunctions, or acoustic modes, associated with the double eigenvalues are found to be orthogonal to themselves so that the standard expansion formula for the acoustic field, which is obtained from a separation-of-variables analysis, is invalid. An alternate expansion formula for the acoustic field is derived. This alternate formula shows that the coalesced acoustic mode is linearly amplified by the transmission distance and exponentially attenuated at the expected rate. The expansion formula also reveals a new eigenfunction, or acoustic mode, which is exponentially attenuated at the same rate as the coalesced eigenfunction.

Zorumski, W. E.↗

NASA NTRS1989

Wentzel-Kramers-Brillouin method in the Bargmann representation

It is demonstrated that the Bargmann representation of quantum mechanics is ideally suited for semiclassical analysis, using as an example the WKB method applied to the bound-state problem in a single well of one degree of freedom. For the harmonic oscillator, this WKB method trivially gives the exact eigenfunctions in addition to the exact eigenvalues. For an anharmonic well, a self-consistent variational choice of the representation greatly improves the accuracy of the semiclassical ground state. Also, a simple change of scale illuminates the relationship of semiclassical versus linear perturbative expansions, allowing a variety of multidimensional extensions.

Voros, A.↗

NASA NTRS1993

Improved Finite Element Modeling of the Turbofan Engine Inlet Radiation Problem

Improvements have been made in the finite element model of the acoustic radiated field from a turbofan engine inlet in the presence of a mean flow. The problem of acoustic radiation from a turbofan engine inlet is difficult to model numerically because of the large domain and high frequencies involved. A numerical model with conventional finite elements in the near field and wave envelope elements in the far field has been constructed. By employing an irrotational mean flow assumption, both the mean flow and the acoustic perturbation problem have been posed in an axisymmetric formulation in terms of the velocity potential; thereby minimizing computer storage and time requirements. The finite element mesh has been altered in search of an improved solution. The mean flow problem has been reformulated with new boundary conditions to make it theoretically rigorous. The sound source at the fan face has been modeled as a combination of positive and negative propagating duct eigenfunctions. Therefore, a finite element duct eigenvalue problem has been solved on the fan face and the resulting modal matrix has been used to implement a source boundary condition on the fan face in the acoustic radiation problem. In the post processing of the solution, the acoustic pressure has been evaluated at Gauss points inside the elements and the nodal pressure values have been interpolated from them. This has significantly improved the results. The effect of the geometric position of the transition circle between conventional finite elements and wave envelope elements has been studied and it has been found that the transition can be made nearer to the inlet than previously assumed.

Roy, Indranil Danda↗