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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 1,603 records · Page 89
All sourcesNASA NTRSDOE OSTI
NASA NTRS1983

Doubly diffusive magnetic buoyancy instability in the solar interior

An investigation of the buoyancy of diffuse magnetic fields has shown that in the presence of rotation, static equilibrium configurations of the toroidal magnetic field and ambient plasma can exist. In that case, the escape of toroidal magnetic flux from the solar interior may be determined by the growth of instabilities which the equilibrium configuration may be subject to. In connection with the present investigation, it is assumed that in the region of toroidal magnetic flux amplification, the magnetic field has not as yet filamented into flux ropes, and is therefore 'diffuse'. A study is conducted of the MHD stability of an electrically conducting and differentially rotating gas in the presence of a toroidal magnetic field, an external constant gravitational field, and radiance pressure. The full dispersion relation for the magnetic buoyancy problem is developed, and the solutions of the dispersion relation are discussed.

Schmitt, J. H. M. M.↗
NASA NTRS1984

On the acceleration of energetic ions in Jupiter's magnetosphere

Several aspects of the problem of high-energy ions in the Jovian magnetosphere are addressed. Voyager observations pertaining to the problem of high-energy ions in the magnetosphere are summarized, and the charge exchange emission of fast neutral sulfur and oxygen atoms and their subsequent recapture by electron impact, charge exchange, and photoionization is considered. Solutions are given to the diffusion equation assuming a source of ions injected with a gyroenergy corresponding to pickup in the middle and outer magnetosphere. It is concluded that no reasonable model parameters exist to produce the required steep spectra of the particle observations with only pickup and adiabatic radial diffusion included. A local acceleration mechanism based on nonadiabatic wave-particle interactions is needed. The assumptions and model predictions of stochastic acceleration by MHD turbulence for the Jovian magnetosphere are described. The model makes a specific correspondence between MHD wave spectrum properties and particle spectrum properties at energies above the Alfven energy.

Barbosa, D. D.↗
NASA NTRS1985

Calculation of three-dimensional, viscous flow through turbomachinery blade passages by parabolic marching

The three-dimensional compressible Navier-Stokes equations are formulated in a rotating coordinate system, so as to include centrifugal and Coriolis forces. The equations are parabolized by using a previously calculated inviscid static pressure field. The thin layer Navier-Stokes approximation, which neglects streamwise diffusion, is used. A body-fitted coordinate system is used. The streamwise momentum equation is uncoupled from the cross-stream momentum equation by using contravariant momentum components, and then using the contravariant velocity components as primary unknowns. To reduce problems with small separated regions, the Reyhner and Flugge-Lotz approximation is used. The energy equation is included to allow for calculation of heat transfer. The flow may be laminar, or a simple eddy-viscosity turbulence may be used. A number of curved ducts and an axial stator were analyzed, including cases for which experimental data are available.

Katsanis, T.↗
NASA NTRS1985

Calculation of three-dimensional, viscous flow through turbomachinery blade passages by parabolic marching

The three-dimensional compressible Navier-Stokes equations are formulated in a rotating coordinate system, so as to include centrifugal and Coriolis forces. The equations are parabolized by using a previously calculated inviscid static pressure field. The thin layer Navier-Stokes approximation, which neglects streamwise diffusion, is used. A body-fitted coordinate system is used. The streamwise momentum equation is uncoupled from the cross-stream momentum equation by using contravariant momentum components, and then using the contravariant velocity components as primary unknowns. To reduce problems with small separating regions, the Reyhner and Flugge-Lotz approximation is used. The energy equation is included to allow for calculation of heat transfer. The flow may be laminar, or a simple eddy-viscosity turbulence may be used. A number of curved ducts and an axial stator were analyzed, including cases for which experimental data are available.

Katsanis, T.↗
NASA NTRS1987

Thermochemical erosion

A quasi-steady multidimensional Stefan problem is treated by means of similarity, asymptotic methods, and numerical analysis. The continuous wearing away of a solid 'erodee' is effected by gradual consumption of a solid 'eroder'. In the process under study, the erodee melts and the (liquid) melt diffuses to the eroder, where an exothermic, indefinitely rapid, diffusion-controlled surface reaction occurs. The products of reaction convey some of the chemically-generated heat to the surface of the erodee, so that further melting may occur, and the process may proceed. The analysis seeks to estimate the quasi-steady rates of consumption of the erodee and eroder, for the (convenient) self-similar case of confocal parabolas defining the boundaries of the melt layer. The analysis is simplified by observing that the flow is of lubrication-theory type: creeping, primarily unidirectional motion owing to the thinness of the melt layer between the erodee and eroder, with diffusion of heat and mass predominantly perpendicular to the principal motion. The analysis is completed by consideration of the force balance on the eroder.

Butler, Gerald↗
NASA NTRS2017

Decoupled Method for Reconstruction of Surface Conditions From Internal Temperatures On Ablative Materials With Uncertain Recession Model

Obtaining measurements of flight environments on ablative heat shields is both critical for spacecraft development and extremely challenging due to the harsh heating environment and surface recession. Thermocouples installed several millimeters below the surface are commonly used to measure the heat shield temperature response, but an ill-posed inverse heat conduction problem must be solved to reconstruct the surface heating environment from these measurements. Ablation can contribute substantially to the measurement response making solutions to the inverse problem strongly dependent on the recession model, which is often poorly characterized. To enable efficient surface reconstruction for recession model sensitivity analysis, a method for decoupling the surface recession evaluation from the inverse heat conduction problem is presented. The decoupled method is shown to provide reconstructions of equivalent accuracy to the traditional coupled method but with substantially reduced computational effort. These methods are applied to reconstruct the environments on the Mars Science Laboratory heat shield using diffusion limit and kinetically limited recession models.

Oliver, A. Brandon↗
DOE OSTI2024

Finite domain solution of a KGD hydraulic fracture in the viscosity-dominated regime

This paper describes a numerical algorithm for solving the classic problem of a plane strain (KGD) fracture propagating in an impermeable elastic medium with zero toughness. The method, which takes advantage of the self-similar nature of the solution, combines a domain-based scheme to solve the elasticity equations and a finite volume method to solve the nonlinear lubrication equation. This work represents a first step towards developing a model able to account for pore pressure diffusion in the medium and corresponding poroelastic effects, noting that these processes are more efficiently solved using a domain-based rather than a boundary integral method. To enhance the efficiency and accuracy of the numerical scheme, the far-field crack asymptotics is embedded in the discretized elastic relationship between the fluid pressure and the crack opening, while the coupled fluid-solid tip asymptote is enforced in a weak form when solving the nonlinear lubrication equation. The proposed technique yields results that closely match the analytical solution, even with a coarse mesh. This approach offers potential for addressing more complex hydraulic fracturing problems in the future.

Domain-based method↗
DOE OSTI2016

A Neutron Streaming Problem to Test Rattlesnake Methods for TREAT

This work demonstrates the progress made at Idaho National Laboratory in the neutronic modeling of neutron streaming in the TREAT reactor core. The streaming in the slotted elements is important because of its effect on the axial distribution and energy deposition in the experiment vehicle. Two methods implemented in Rattlesnake: 1) tensor diffusion coefficients and, 2) superhomogenization, yield much improved power distributions using a diffusion solution with homogenized fuel elements. The RMS difference in the power distribution decreases below 0.661% compared to a reference Monte Carlo simulation. The maximum differences are within 1.5% of this reference.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2016

A Neutron Streaming Problem to Test Rattlesnake Methods for TREAT

This work demonstrates the progress made at Idaho National Laboratory in the neutronic modeling of neutron streaming in the TREAT reactor core. The streaming in the slotted elements is important because of its effect on the axial distribution and energy deposition in the experiment vehicle. Two methods implemented in Rattlesnake: 1) tensor diffusion coefficients and, 2) super-homogenization, yield much improved power distributions using a diffusion solution with homogenized fuel elements. The RMS difference in the power distribution decreases below 0.661% compared to a reference Monte Carlo simulation. The maximum differences are within 1.5% of this reference. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2026

Enhanced accuracy through ensembling of randomly initialized auto-regressive models for dynamical systems

Computational mechanics simulations using traditional finite element methods (FEM) require prohibitively expensive computational resources for real-time engineering applications, design optimization, and digital twin implementations. While machine learning (ML) surrogate models offer significant computational speedups, autoregressive ML models for time-dependent mechanical systems suffer from error accumulation that compromises long-term prediction reliability - a critical concern for engineering applications where accuracy over extended time horizons is essential for safety and performance assessments. Here, we propose a deep ensemble framework specifically designed to address this challenge in computational mechanics applications, where multiple ML surrogate models with random weight initializations are trained in parallel and their predictions aggregated during inference. This approach leverages statistical diversity to maximize information gain from a fixed set of training data and to mitigate error propagation, while maintaining the computational efficiency that makes ML surrogates attractive for engineering practice. We validate the framework on three representative problems spanning critical areas of computational mechanics: stress field evolution in heterogeneous microstructures under complex loading (relevant to advanced materials design and composite analysis), planetary-scale shallow water dynamics (applicable to environmental and geotechnical engineering), and Gray-Scott reaction-diffusion systems (relevant to mass transport and chemical process engineering). Across all test cases, the ensemble approach demonstrates consistent error reduction of 15-33% compared to individual models. The codes for this work are available on GitHub (https://github.com/Graham-Brady-Research-Group/AutoregressiveEnsemble_SpatioTemporal_Evolution).

autoregressive prediction↗
DOE OSTI2014

Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes

We present mixed quantum classical calculations of the proton transfer (PT) reaction rates represented by a double well system coupled to a dissipative bath. The rate constants are calculated within the so called nontraditional view of the PT reaction, where the proton motion is quantized and the solvent polarization is used as the reaction coordinate. Quantization of the proton degree of freedom results in a problem of non-adiabatic dynamics. By employing the reactive flux formulation of the rate constant, the initial sampling starts from the transition state defined using the collective reaction coordinate. Dynamics of the collective reaction coordinate is treated classically as over damped diffusive motion, for which the equation of motion can be derived using the path integral, or the mixed quantum classical Liouville equation methods. The calculated mixed quantum classical rate constants agree well with the results from the numerically exact hierarchical equation of motion approach for a broad range of model parameters. Moreover, we are able to obtain contributions from each vibrational state to the total reaction rate, which helps to understand the reaction mechanism from the deep tunneling to over the barrier regimes. The numerical results are also compared with those from existing approximate theories based on calculations of the non-adiabatic transmission coefficients. It is found that the two-surface Landau-Zener formula works well in calculating the transmission coefficients in the deep tunneling regime, where the crossing point between the two lowest vibrational states dominates the total reaction rate. When multiple vibrational levels are involved, including additional crossing points on the free energy surfaces is important to obtain the correct reaction rate using the Landau-Zener formula.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

Numerical analysis of flows of rarefied gases in long channels with octagonal cross section shapes

Isothermal, pressure driven rarefied gas flows through long channels with octagonal cross section shapes are analyzed computationally. The capillary is between inlet and outlet reservoirs. The cross section is constant along the axial direction. The boundary condition at the solid-gas interface is assumed to be diffuse reflection. Since the channel is long, the gaseous velocity is small compared to the average molecular speed. Consequently, a linearized description can be used. The flow is described by the linearized Bhatnagar-Gross-Krook kinetic model. The solution of the problem is divided into two stages. First, the local flow field is determined by assuming the local pressure gradient. Secondly, the global flow behavior is deduced by the consideration of the conservation of the mass along the axis of the capillary. The kinetic equation is solved by the discrete velocity method on the cross section. Both spatial and velocity spaces are discretized. A body fitted rectangular grid is used for the spatial space. Near the boundary, first-order, while in the interior part of the flow domain, second-order finite-differences are applied to approximate the spatial derivatives. This combination results into an efficient and straightforward numerical treatment. The velocity space is represented by a Gauss-Legendre quadrature. The kinetic equation is solved in an iterative manner. The local dimensionless flow rate is calculated and tabulated for a wide range of the gaseous rarefaction for octagonal cross sections with various geometrical parameters. It exhibits the Knudsen minimum phenomenon. The flow rates in the octagonal channel are compared to those through capillaries with circular and square cross sections. Typical velocity profiles are also shown. The mass flow rate and the distribution of the pressure are determined and presented for global pressure driven flows.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Deep learning of interface structures from simulated 4D STEM data: cation intermixing vs. roughening ∗

Abstract Interface structures in complex oxides remain an active area of condensed matter physics research, largely enabled by recent advances in scanning transmission electron microscopy (STEM). Yet the nature of the STEM contrast in which the structure is projected along the given direction precludes separation of possible structural models. Here, we utilize deep convolutional neural networks (DCNN) trained on simulated 4D STEM datasets to predict structural descriptors of interfaces. We focus on the widely studied interface between LaAlO 3 and SrTiO 3 , using dynamical diffraction theory and leveraging high performance computing to simulate thousands of possible 4D STEM datasets to train the DCNN to learn properties of the underlying structures on which the simulations are based. We test the DCNN on simulated data and show that it is possible (with >95% accuracy) to identify a physically rough from a chemically diffuse interface and create a DCNN regression model to predict step positions. We quantify the applicability of the model to different thicknesses and the transferability of the approach. The method shown here is general and can be applied for any inverse imaging problem where forward models are present.

42 ENGINEERING↗
DOE OSTI2017

The Weakly Nonlinear Magnetorotational Instability in a Local Geometry

The magnetorotational instability (MRI) is a fundamental process of accretion disk physics, but its saturation mechanism remains poorly understood despite considerable theoretical and computational effort. We present a multiple-scales analysis of the non-ideal MRI in the weakly nonlinear regime—that is, when the most unstable MRI mode has a growth rate asymptotically approaching zero from above. Here, we develop our theory in a local, Cartesian channel. Our results confirm the finding by Umurhan et al. that the perturbation amplitude follows a Ginzburg–Landau equation. We further find that the Ginzburg–Landau equation will arise for the local MRI system with shear-periodic boundary conditions, when the effects of ambipolar diffusion are considered. A detailed force balance for the saturated azimuthal velocity and vertical magnetic field demonstrates that, even when diffusive effects are important, the bulk flow saturates via the combined processes of reducing the background shear and rearranging and strengthening the background vertical magnetic field. We directly simulate the Ginzburg–Landau amplitude evolution for our system, and demonstrate the pattern formation our model predicts on long scales of length- and timescales. We compare the weakly nonlinear theory results to a direct numerical simulation of the MRI in a thin-gap Taylor Couette flow.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1984

Computation of viscous flow in planar and axisymmetric ducts by an implicit marching procedure

A streamwise marching procedure, approximately 200 times faster than a full Navier-Stokes procedure with comparable accuracy, is presented for solving problems of compressible viscous subsonic flow. Results are presented and compared with experimental data for the cases of developing turbulent flow in a circular pipe; turbulent flow in a two-dimensional S-duct; and turbulent flow in a typical subsonic diffuser. Prior to each main marching step, a preliminary marching step is taken in which the integral continuity equation and an uncoupled form of the streamwise momentum equation are solved simultaneously to obtain the viscous pressure correction. During the main marching step the equations for continuity, streamwise momentum, cross-flow momentum, and energy are solved simultaneously as a coupled system using an implicit finite-difference method, with the viscous pressure correction treated as a source term. The analysis may be used for flows with both favorable and adverse pressure gradients and to predict the location of flow separation.

Towne, C. E.↗
NASA NTRS1986

Magnetized thermal conduction fronts

The evolution of planar thermal conduction fronts in the presence of a dynamically weak, but otherwise self-consistent, magnetic field is considered. The field is assumed to be connected and untangled. In the diffusion limit for the thermal conductivity, these fronts exhibit self-similar behavior, even in the presence of a field. The role of the field is restricted to channeling the heat flux along its lines of force, and it enters into the problem as a dimensionless angle variable. 'Combing' (or opening) of insulating field lines by the evaporative flow is explicitly demonstrated. Unless the field is nearly perpendicular to the front normal in the hot gas, insulating effects are not profound. Self-similarity breaks down if the front becomes saturated, and under certain conditions magnetized saturated conduction fronts cannot propagate: the solution characteristics of the wave equation form caustics. The physical resolution is the advent of two-fluid (nonlocal) heating. Such Coulomb-heated fronts are expected to be relatively rare in typical astrophysical systems. The large-scale effects of a magnetic field on cloud evaporation in the interstellar medium are briefly discussed, and it is suggested that these fields preclude the presence of time-independent evaporative solutions. Thermal interfaces may then continue to evolve until radiative cooling halts their development; large tracts of warm 10,000 K gas may result.

Balbus, S. A.↗
NASA NTRS1993

An adaptive grid with directional control

An adaptive grid generator for adaptive node movement is here derived by combining a variational formulation of Winslow's (1981) variable-diffusion method with a directional control functional. By applying harmonic-function theory, it becomes possible to define conditions under which there exist unique solutions of the resulting elliptic equations. The results obtained for the grid generator's application to the complex problem posed by the fluid instability-driven magnetic field reconnection demonstrate one-tenth the computational cost of either a Eulerian grid or an adaptive grid without directional control.

Brackbill, J. U.↗
NASA NTRS1995

The Method of Space-time Conservation Element and Solution Element: Development of a New Implicit Solver

The method of space-time conservation element and solution element is a nontraditional numerical method designed from a physicist's perspective, i.e., its development is based more on physics than numerics. It uses only the simplest approximation techniques and yet is capable of generating nearly perfect solutions for a 2-D shock reflection problem used by Helen Yee and others. In addition to providing an overall view of the new method, we introduce a new concept in the design of implicit schemes, and use it to construct a highly accurate solver for a convection-diffusion equation. It is shown that, in the inviscid case, this new scheme becomes explicit and its amplification factors are identical to those of the Leapfrog scheme. On the other hand, in the pure diffusion case, its principal amplification factor becomes the amplification factor of the Crank-Nicolson scheme.

Chang, S. C.↗