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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 217 records · Page 12
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Compositional Methods for Schrödinger's Equation with Application to Optimal Control

The evolution of the state of a quantum computer is governed by Schrödinger's equation. We introduce compositional methods, a way to increase the order of symmetric methods by replacing one timestep by multiple timesteps. We perform several numerical experiments, including a simulation of a two qubit CNOT gate, using compositional variants of Störmer-Verlet and the implicit midpoint rule. We observe that the compositional methods demonstrate greater computational efficiency than the base methods when the desired error tolerance is less than ~ 10 -4 to 10 -5 . We discuss the trade-offs of using each compositional method, as well as differences between using Störmer-Verlet or the implicit midpoint rule as the base integrator of the compositional methods.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1972

Application of Contraction Mappings to the Control of Nonlinear Systems

The theoretical and applied aspects of successive approximation techniques are considered for the determination of controls for nonlinear dynamical systems. Particular emphasis is placed upon the methods of contraction mappings and modified contraction mappings. It is shown that application of the Pontryagin principle to the optimal nonlinear regulator problem results in necessary conditions for optimality in the form of a two point boundary value problem (TPBVP). The TPBVP is represented by an operator equation and functional analytic results on the iterative solution of operator equations are applied. The general convergence theorems are translated and applied to those operators arising from the optimal regulation of nonlinear systems. It is shown that simply structured matrices and similarity transformations may be used to facilitate the calculation of the matrix Green functions and the evaluation of the convergence criteria. A controllability theory based on the integral representation of TPBVP's, the implicit function theorem, and contraction mappings is developed for nonlinear dynamical systems. Contraction mappings are theoretically and practically applied to a nonlinear control problem with bounded input control and the Lipschitz norm is used to prove convergence for the nondifferentiable operator. A dynamic model representing community drug usage is developed and the contraction mappings method is used to study the optimal regulation of the nonlinear system.

Killingsworth, W. R., Jr.↗
NASA NTRS1987

A technique for the prediction of airfoil flutter characteristics in separated flow

A solution procedure is described for determining the two-dimensional, one- or two-degree-of-freedom flutter characteristics of arbitrary airfoils at large angles of attack. The same procedure is used to predict stall flutter. This procedure requires a simultaneous integration in time of the solid and fluid equations of motion. The fluid equations of motion are the unsteady compressible Navier-Stokes equations, solved in a body-fitted moving coordinate system using an approximate factorization scheme. The solid equations of motion are integrated in time using an Euler implicit scheme. Flutter is said to occur if small disturbances imposed on the airfoil attitude lead to divergent oscillatory motions at subsequent times. Results for a number of special cases are presented to demonstrate the suitability of this scheme to predict flutter at large mean angles of attack. Some stall flutter applications are also presented.

Wu, Jiunn-Chi↗
NASA NTRS1988

Application of Navier-Stokes analysis to stall flutter

A solution procedure was developed to investigate the two-dimensional, one- or two-dimensional flutter characteristics of arbitrary airfoils. This procedure requires a simultaneous integration in time of the solid and fluid equations of motion. The fluid equations of motion are the unsteady compressible Navier-Stokes equations, solved in a body-fitted moving coordinate system using an approximate factorization scheme. The solid equations of motion are integrated in time using an Euler implicit scheme. Flutter is said to occur if small disturbances imposed on the airfoil attitude lead to divergent oscillatory motions at subsequent times. The flutter characteristics of airfoils in subsonic speed at high angles of attack and airfoils in high subsonic and transonic speeds at low angles of attack are investigated. The stall flutter characteristics are also predicted using the same procedure.

Wu, J. C.↗
NASA NTRS1987

Numerical experiments on transition control in wall-bounded shear flows

Results are presented from a numerical simulation of transition control in plane channel and boundary layer flows. The analysis is based on a pseudo-spectral/finite difference semi-implicit solution procedure employed to numerically integrate the time-dependent, three-dimensional, incompressible Navier-Stokes equations in a doubly periodic domain. In the channel flow, it was found that the active periodic suction/blowing method was effective in controlling strongly three-dimensional disturbances. In the boundary layer, the preliminary analysis indicated that in the early stages, passive control by suction is as effective as active control to suppress instabilities. The current work is focused on a detailed comparison of active and passive control by suction/blowing in the boundary layer.

Biringen, S.↗
NASA NTRS1989

Oscillatory flow with heat transfer in a square cavity

A computational study is presented for the flow inside an oscillatory cavity. The numerical scheme employs a semi-implicit, time-splitting method to integrate the two-dimensional full Navier-Stokes equations satisfying continuity to machine accuracy. The efficient use of direct solvers for the uncoupled momentum and pressure equations is demonstrated. The oscillatory cavity flow is studied considering the effects of heat transfer, Reynolds number, and oscillatory Stokes number.

Biringen, S.↗
NASA NTRS1991

Numerical prediction of the unsteady flowfield around the F-18 aircraft at large incidence

This paper describes a numerical method capable of solving the steady and unsteady viscous flow around complete aircraft configurations at high angles of attack. This method is used to simulate the external flow around the F-18 aircraft, including deflected control surfaces. The current technique employs a generalized overset zonal grid scheme to decompose the computational space around the aircraft. The grid around various components of the aircraft are created numerically using a three-dimensional hyperbolic grid generation procedure. The Reynolds-averaged Navier-Stokes equations are integrated using a time-accurate, implicit procedure. Results for the turbulent flow around the F-18 aircraft at 30 degrees angle of attack show the details of the flowfield structure, including the unsteadiness created by the vortex burst and the resulting fluctuating airloads exerted on the vertical tail. The computed results agree fairly well with flight data for surface pressure, surface flow pattern, vortex burst location, and the dominant frequency for tail load fluctuations.

Rizk, Yehia M.↗
NASA NTRS1991

Transient thermoelasticity and other body force effects in boundary element shape sensitivity analysis

Structural shape design sensitivity analysis (DSA) is presented for objects subjected to gravity, centrifugal, and general thermal loading. DSA employs implicit differentiation of the governing boundary integral equations. Both a surface integral and a particular integral approach are discussed for computation of these effects in response analysis and sensitivity analysis. It is shown that the particular integral approach is capable of computing the sensitivities of objects subjected to nonharmonic temperature distributions. Attention is also given to several techniques for the modeling of temperature distributions in the DSA process. In particular, an approach that eliminates the need for the incorporation of thermal response analysis and sensitivity analysis is described in the overall shape optimization process. A sharp corner formulation is also presented that can account for the jump in the surface traction components at a sharp corner in an interzone boundary.

Kane, James H.↗
NASA NTRS1991

Boundary-element shape sensitivity analysis for thermal problems with nonlinear boundary conditions

Implicit differentiation of the discretized boundary integral equations governing the conduction of heat in solid objects subjected to nonlinear boundary conditions is shown to generate an accurate and economical approach for the computation of shape sensitivities for this class of problems. This approach involves the employment of analytical derivatives of boundary-element kernel functions with respect to shape design variables. A formulation is presented that can consistently account for both temperature-dependent convection and radiation boundary conditions. Several iterative strategies are presented for the solution of the resulting sets of nonlinear equations and the computational performances examined in detail. Multizone analysis and zone condensation strategies are demonstrated to provide substantive computational economies in this process for models with either localized nonlinear boundary conditions or regions of geometric insensitivity to design variables. A series of nonlinear example problems are presented that have closed-form solutions.

Kane, James H.↗
NASA NTRS1992

Boundary formulations for shape sensitivity of temperature dependent conductivity problems

Used in concert with the Kirchhoff transformation, implicit differentiation of the discretized boundary integral equations governing the conduction of heat in solids with temperature dependent thermal conductivity is shown to generate an accurate and economical approach for computation of shape sensitivities. For problems with specified temperature and heat flux boundary conditions, a linear problem results for both the analysis and sensitivity analysis. In problems with either convection or radiation boundary conditions, a nonlinear problem is generated. Several iterative strategies are presented for the solution of the resulting sets of nonlinear equations and the computational performances examined in detail. Multizone analysis and zone condensation strategies are demonstrated to provide substantive computational economies in this process for models with either localized nonlinear boundary conditions or regions of geometric insensitivity to design variables. A series of nonlinear example problems is presented that have closed form solutions. Exact analytical expressions for the shape sensitivities associated with these problems are developed and these are compared with the sensitivities computed using the boundary element formulation.

Kane, James H.↗
NASA NTRS1992

Numerical investigation of tail buffet on F-18 aircraft

Numerical investigation of vortex induced tail buffet is conducted on the F-18 aircraft at high angles of attack. The Reynolds-averaged Navier-Stokes equations are integrated using a time-accurate, implicit procedure. A generalized overset zonal grid scheme is used to decompose the computational space around the complete aircraft with faired-over inlet. A weak coupling between the aerodynamics and structures is assumed to compute the structural oscillation of the flexible vertical tail. Time-accurate computations of the turbulent flow around the F-18 aircraft at 30 degrees angle of attack show the surface and off-surface flowfield details, including the unsteadiness created by the vortex burst and its interaction with the vertical twin tail which causes the tail buffet. The effect of installing a LEX fence on modifying the vortex structure upstream of the tail is also examined.

Rizk, Yehia M.↗
NASA NTRS1995

Flow simulations about steady-complex and unsteady moving configurations using structured-overlapped and unstructured grids

The limiting factor in simulating flows past realistic configurations of interest has been the discretization of the physical domain on which the governing equations of fluid flow may be solved. In an attempt to circumvent this problem, many Computational Fluid Dynamic (CFD) methodologies that are based on different grid generation and domain decomposition techniques have been developed. However, due to the costs involved and expertise required, very few comparative studies between these methods have been performed. In the present work, the two CFD methodologies which show the most promise for treating complex three-dimensional configurations as well as unsteady moving boundary problems are evaluated. These are namely the structured-overlapped and the unstructured grid schemes. Both methods use a cell centered, finite volume, upwind approach. The structured-overlapped algorithm uses an approximately factored, alternating direction implicit scheme to perform the time integration, whereas, the unstructured algorithm uses an explicit Runge-Kutta method. To examine the accuracy, efficiency, and limitations of each scheme, they are applied to the same steady complex multicomponent configurations and unsteady moving boundary problems. The steady complex cases consist of computing the subsonic flow about a two-dimensional high-lift multielement airfoil and the transonic flow about a three-dimensional wing/pylon/finned store assembly. The unsteady moving boundary problems are a forced pitching oscillation of an airfoil in a transonic freestream and a two-dimensional, subsonic airfoil/store separation sequence. Accuracy was accessed through the comparison of computed and experimentally measured pressure coefficient data on several of the wing/pylon/finned store assembly's components and at numerous angles-of-attack for the pitching airfoil. From this study, it was found that both the structured-overlapped and the unstructured grid schemes yielded flow solutions of comparable accuracy for these simulations. This study also indicated that, overall, the structured-overlapped scheme was slightly more CPU efficient than the unstructured approach.

Newman, James C., III↗
NASA NTRS1997

On spurious behavior of CFD simulations

Spurious behavior in underresolved grids and/or semi-implicit temporal discretizations for four computational fluid dynamics (CFD) simulations are studied. The numerical simulations consist of (a) a 1-D chemically relaxed nonequilibrium model, (b) the direct numerical simulation (DNS) of 2-D incompressible flow over a backward facing step, (c) a loosely-coupled approach for a 2-D fluid-structure interaction, and (d) a 3-D compressible unsteady flow simulation of vortex breakdown in delta wings. Using knowledge from dynamical systems theory, various types of spurious behaviors that are numerical artifacts were systematically identified. These studies revealed the various possible dangers of misinterpreting numerical simulation of realistic complex flows that are constrained by the available computing power. In large scale computations underresolved grids, semi-implicit procedures, loosely-coupled implicit procedures, and insufficiently long time integration in DNS are most often unavoidable. Consequently, care must be taken in both computation and in interpretation of the numerical data. The results presented confirm the important role that dynamical systems theory can play in the understanding of the nonlinear behavior of numerical algorithms and in aiding the identification of the sources of numerical uncertainties in CFD.

Numerical Solution↗
NASA NTRS2018

Solution of Ordinary Differential Equations in Gradient-Based Multidisciplinary Design Optimization

A gradient-based approach to multidisciplinary design optimization enables efficient scalability to large numbers of design variables. However, the need for derivatives causes difficulties when integrating ordinary differential equations (ODEs) in models. To simplify this, we propose the use of the general linear methods framework, which unifies all Runge-Kutta and linear multistep methods. This approach enables rapid implementation of integration methods without the need to differentiate each one, even in a gradient-based optimization context. We also develop a new parallel time integration algorithm that enables vectorization across time steps. We present a set of benchmarking results using a stiff ODE, a non-stiff nonlinear ODE, and an orbital dynamics ODE, and compare integration methods. In a modular gradient-based multidisciplinary design optimization context, we find that the new parallel time integration algorithm with high-order implicit methods, especially Gauss-Legendre collocation, is the best choice for a broad range of problems.

Hwang, John T.↗
DOE OSTI2025

Evaluation of Maximum Allowable Working Pressure and Svensson Burst Pressure Recommended in API 579-1 2021 Edition

ABSTRACT API 579-1/ASME FFS-1 2021 Edition provides the minimum wall thickness, the maximum allowable working pressure (MAWP), and the membrane stress equations for thin and thick-walled cylindrical shells subject to internal pressure in Section 2C.3.3.1 of Appendix 2C – Thickness, MAWP, and Stress Equations for an FFS Assessment. The minimum wall thickness and MAWP are determined using the hoop stress and the Tresca yield criterion. Section 2C.7 – Estimation of Burst Pressure newly added the Svensson method for calculating burst pressure of cylindrical shells under internal pressure, where the plastic yielding is characterized by the von Mises yield criterion. For thin-walled cylinders, the von Mises flow solution of burst pressure in Equation (2C.179) was recommended. For thick-walled cylinders, an implicit burst pressure solution in an integral equation (2C.176) was recommended. But this integral equation is inconvenient to use in practice. It is well known that the classic plasticity theory includes the Tresca and von Mises yield criteria, with the Tresca criterion predicting a lower bound solution and the von Mises criteria predicting an upper bound solution. In addition, the present author developed an average shear stress yield criterion that can determine more accurate limit and burst pressures for thin and thick-walled cylinders. This work uses these three yield criteria to evaluate the minimum required wall thickness, MAWP and Svensson burst pressure recommended in the API 579 code.

burst pressure↗
DOE OSTI2022

Time-discretization of a plasma-neutral MHD model with a semi-implicit leapfrog algorithm

The semi-implicit leapfrog time-discretization is a workhorse algorithm for initial-value MHD codes to bridge between vastly separated time scales. Inclusion of atomic interactions with neutrals breaks the functional structure of the MHD equations that exploited by the leapfrog. In this work, we address how to best integrate atomic physics into the semi-implicit leapfrog. Following the Crank-Nicolson method, one approach is to time-center the atomic interactions in the linear solver and use a Newton method to include the nonlinear contributions. Alternatively, another family of methods are based on operator-splitting the terms associated with the atomic interactions using a Strang-splitting technique. These methods naturally break equations into constituent ODE and PDE parts and preserve the structure exploited by the semi-implicit leapfrog. We study the accuracy and efficiency of these methods through a battery of 0D and 1D cases and show that a second-order-in-time Douglas-Rachford inspired coupling between the ODE and PDE advances is effective in reducing the time-discretization error to be comparable to that of Crank-Nicolson with Newton iteration of the nonlinear terms. Splitting ODE and PDE parts results in independent matrix solves for each field which reduces the computational cost considerably and provides parallelization over species relative to Crank-Nicolson.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

A novel implicit hybrid machine learning model and its application for reinforcement learning

A novel methodology to develop implicit hybrid models is presented. PyTorch is used to integrate physics-based equations with machine learning models. Automatic differentiation of the hybrid model is leveraged to solve the implicit equations. Iterative solving enables gradient based updates to the machine learning model. The novel methodology is compared to an explicit hybrid approach on a continuously stirred tank reactor (CSTR). The novel method results in a lower modelling error. Both hybrid models effectively train with noisy data. To test the implicit hybrid model, it is employed as a reinforcement learning (RL) training model. The RL algorithm trained on the hybrid model outperforms real time optimization of the CSTR and performs nearly as well as RL trained directly on the CSTR and a traditional gradient based approach. Training RL directly on the CSTR requires over 60,000 system interactions compared to 6000 historical data points for hybrid model development.

42 ENGINEERING↗
DOE OSTI2025

Electromagnetic Transient Simulation of Photovoltaic Inverter Using Implicit-Explicit Solver

This paper introduces the implementation of electromagnetic transient (EMT) simulations of a photovoltaic (PV) inverter module using the Implicit-Explicit (ImEx) solver in the Suite of Nonlinear and Differential/Algebraic Equation Solvers (SUNDIALS). This study demonstrates the effectiveness of the ImEx solver in overcoming the challenges inherent in simulating the complex dynamics of PV inverter modules. Furthermore, using SUNDIALS’ ImEx solver module ARKODE for EMT simulation automates key aspects of the process, such as numerical integration, providing substantial benefits including enhanced consistency, faster implementation, reduced human error, and the capability to handle the complexities of advanced numerical integration. By conducting comparative simulations with an implicit method used in commercial software, the research showcases the ImEx solver’s capability in achieving high accuracy and reliability. Results indicate that leveraging the ImEx approach significantly enhances modeling fidelity and reduces simulation setup times, offering a promising tool for the EMT analysis of PV inverter systems in power electronics-dominated power grids.

Choi, Jongchan [ORNL] (ORCID:000000025952455X)↗