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Results for “effective diffusivity”

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 505 records · Page 28
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Curvature effects in the reaction-diffusion system governing frontal polymerization

Frontal polymerization is a fast and energy-efficient curing process of thermoset polymers involving the self-sustained propagation of a sharp front that transforms a liquid monomer or gel into a polymer. The temperature, speed, and geometry of the polymerization front are closely intertwined quantities that can affect the curing process and the mechanical properties of the polymer. This work investigates the effect of the front curvature on the front propagation speed based on a reaction-diffusion model. The proposed analytical relations between front speed and curvature are verified by finite element simulations and validated through experiments. The models show that a concave front has a higher front temperature and speed than its convex counterpart. When the curvature of a convex front reaches a critical value, the reaction can no longer be sustained, and the front is quenched. The relation between the speed of a steadily propagating front and its geometry is derived, showing good agreement with experimental observations. This study also provides analytical estimates of the thickness of the polymerization front and insight into the relationship between the front curvature and the kinetics of the exothermic reaction.

42 ENGINEERING↗
DOE OSTI2022

Flexible machine-learning interatomic potential for simulating structural disordering behavior of Li 7 La 3 Zr 2 O 12 solid electrolytes

Batteries based on solid-state electrolytes, including Li 7 La 3 Zr 2 O 12 (LLZO), promise improved safety and increased energy density; however, atomic disorder at grain boundaries and phase boundaries can severely deteriorate their performance. Machine-learning (ML) interatomic potentials offer a uniquely compelling solution for simulating chemical processes, rare events, and phase transitions associated with these complex interfaces by mixing high scalability with quantum-level accuracy, provided that they can be trained to properly address atomic disorder. To this end, we report the construction and validation of an ML potential that is specifically designed to simulate crystalline, disordered, and amorphous LLZO systems across a wide range of conditions. The ML model is based on a neural network algorithm and is trained using ab initio data. Performance tests prove that the developed ML potential can predict accurate structural and vibrational characteristics, elastic properties, and Li diffusivity of LLZO comparable to ab initio simulations. As a demonstration of its applicability to larger systems, we show that the potential can correctly capture grain boundary effects on diffusivity, as well as the thermal transition behavior of LLZO. Here these examples show that the ML potential enables simulations of transitions between well-defined and disordered structures with quantum-level accuracy at speeds thousands of times faster than ab initio methods.

25 ENERGY STORAGE↗
DOE OSTI2024

Characterization of electromigration-induced short-range stress development in Al(0.25 at. % Cu) conductor line

Scanning x-ray microbeam topography and fluorescence experiments were conducted in situ to study the electromigration behavior of a 0.5 μm thick, 10 μm wide, and 200 μm long Al(0.25 at. % Cu) conductor line with 1.5 μm-thick SiO2 passivation on a single crystal Si substrate. The strain sensitivity of x-ray topography measurement allowed detailed examination of the electromigration-induced stress distribution and evolution in the conductor line in response to the depletion of Cu solute early in the electromigration process. Upon electromigration at 0.4 MA/cm2 and 303 °C, a short-range stress gradient was quickly induced by Al migration in the Cu-depleted cathode region to counteract further Al flow. The stress gradient was fully developed during the 5.3 h incubation time, extending over the critical Blech length of about 66 μm from the cathode end. Plastic deformation then occurred at the downstream end of the Cu-depleted region. The preferential electromigration of Cu did not cause detectable stress change outside the Cu-depleted region, except for the significant stress development from the Al2Cu precipitation at the anode end which appeared to initiate the fracture in the passivation. Preliminary finite difference modeling was undertaken to simulate the experimental observations, from which important parameters dictating electromigration in Al(Cu) line were extracted: an apparent effective valence of −5.6 and −1.9 for Cu and Al in Al(Cu), respectively, and a critical Cu concentration of 0.16 at. % above which Al grain boundary diffusion is effectively blocked.

Physics↗
NASA NTRS1985

CNO abundances resulting from diffusion in accreting nova progenitors

The configurations of potential nova progenitors at the onset of a thermonuclear runaway (TNR) are obtained by evolving a series of white dwarf (WD) models through the quasi-static accretion phase preceding the TNR. Special attention is paid to the effect of diffusion on composition profiles. The initial parameters of the accretion phase are the WD mass, the WD luminosity, and the accretion rate. They lead to a wide range of combinations of accreted mass and heavy element content of the envelope Z(env). It is found that the WD mass is the most important parameter in determining the accreted mass. A lower limit exists for the mass of a WD capable of producing a nova-like outburst which decreases with decreasing WD mass. There is a strong correlation between the accretion rate and Z(env), higher Z(env) values resulting from lower accretion rates. Changes in WD luminosity have no dramatic effect on the outcome of the accretion phase.

Kovetz, A.↗
NASA NTRS1991

The role of particle diffusion in the lower transition region: Revised interpretation of emission measures

Our energy-balance models of the lower transit ion region were presented in a previous paper (New Models of the Chromosphere and Transition Region). Here we show the influence of particle diffusion on the calculated hydrogen and helium number densities for a given temperature-density model (model C in the preceding paper). We have also solved the statistical equilibrium and radiative transfer equations for a 13-level He I atom (22 radiative transitions) and a 6-level He II ion (15 radiative transitions) together with He III. The resulting He I and He II level-1 number densities and He III density are shown as functions of temperature. Diffusion substantially increases eta(sub HeI) for T greater than 35,000 K and decreases eta(sub HeI) (while increasing eta(sub(HeII)) between 9,000 and 25,000 K. Including the effects of diffusion also increases eta(sub HeIII) for T less than 60,000 K.

Avrett, Eugene H.↗
NASA NTRS1974

Radiation pressure and air drag effects on the orbit of the balloon satellite 1963 30D

Computed orbits of the balloon satellite 1963 30D are given every 2 days over an interval of 456 days near the beginning of the satellite's lifetime and an interval of 824 days near the end of its lifetime. The effects of radiation pressure on the satellite are examined in some detail. It is found that the variations in all the elements can be represented by use of a single parameter to specify the effect of diffuse reflection from the satellite's surface, and that this parameter remains constant, or nearly so, during the entire 7-year lifetime. Success in obtaining a consistent representation of the radiation-pressure effects is ascribed to the inclusion of the effects of terrestrial radiation pressure, using a model for the earth's albedo that includes seasonal and latitudinal variations. Anomalous effects in the orbital acceleration, as well as in the other elements, are represented quite well by including a small force at right angle to the solar direction and by allowing this to rotate about the solar direction. This implies that the satellite is aspherical, that it is rotating, and that the axis of rotation precesses.

Slowey, J. W.↗
NASA NTRS1979

Some tests on small-scale rectangular throat ejector

A small scale rectangular throat ejector with plane slot nozzles and a fixed throat area was tested to determine the effects of diffuser sidewall length, diffuser area ratio, and sidewall nozzle position on thrust and mass augmentation. The thrust augmentation ratio varied from approximately 0.9 to 1.1. Although the ejector did not have good thrust augmentation performance, the effects of the parameters studied are believed to indicate probable trends in thrust augmenting ejectors.

Dean, W. N., Jr.↗
NASA NTRS1989

Evolution of the sun's polar fields during sunspot cycle 21 - Poleward surges and long-term behavior

Longitudinally averaged observations of the photospheric field during 1976-1986 are analyzed using a flux transport model. The way in which source eruptions, supergranular diffusion, and meridional flow collaborate to produce strong, highly concentrated polar fields near sunspot minimum is clarified as follows: (1) widespread eruptions of individual bipolar magnetic regions, with their leading polarity flux equatorward of their trailing polarity flux, collectively establish a large-scale separation of polarities in latitude; (2) the low-latitude, leading polarity flux diffuses across the equator and merges with its opposite hemisphere counterpart; and (3) meridional flow carries the resulting surplus of trailing polarity flux to the poles, and concentrates it there against the spreading effect of diffusion. Episodic 'surges' of flux to the poles are induced by fluctuations in the source eruption rate. Simulations indicate that relatively weak, trailing polarity surges may occur even in a steady flow field. However, in order to account for the giant surges of alternating polarity and the resulting oscillations in the polar field strength observed during 1980-1982, both accelerated flow and enhanced eruption rates are required.

Wang, Y.-M.↗
NASA NTRS1953

Force and Pressure Recovery Characteristics at Supersonic Speeds of a Conical Spike Inlet with a Bypass Discharging from the Top or Bottom of the Diffuser in an Axial Direction

Force and pressure-recovery characteristics of a nacelle-type conical-spike inlet with a fixed-area bypass located in the top or bottom of the diffuser are presented for flight Mach numbers of 1.6, 1.8, and 2.0 for angles of attack from 0 degrees to 9 degrees. Top or bottom location of the bypass did not have significant effects on diffuser pressure-recovery, bypass mass-flow ratio, or drag coefficient over the range of angles of attack, flight Mach numbers, and stable engine mass-flow ratios investigated. A larger stable subcritical operating range was obtained with the bypass on the bottom at angles of attack from 3 degrees to 9 degrees at a flight Mach number of 2.0. At a flight Mach number of 2.0, the discharge of 14 percent of the critical mass flow of the inlet by means of a bypass increased the drag only one-fifth of the additive drag that would result for equivalent spillage behind an inlet normal shock without significant reductions in diffuser pressure recovery.

DIFFUSERS, SUBSONIC↗
NASA NTRS1989

Proposed uses of laser light scattering instruments for polymerization studies

Microgravity offers a unique environment for studying polymer diffusion and polymer polymerization reactions. The absence of convection currents, which are the major mode of mixing at the molecular level on Earth, are eliminated or reduced in the microgravity environment. More importantly, the prediction of unique copolymer composition development in microgravity allows controlled formation of new compositions of matter. The absence of mixing at the molecular level should produce unique short block copolymers available for the first time for comonomer compositions which normally lead to random or long block copolymer under good mixing. The investigation of fundamental polymer diffusion and polymer polymerization processes in microgravity is proposed. This effort will involve fundamental studies of monomer and polymer diffusion; their effects on initiation, propagation, and especially termination kinetics rate constant; and the accurate evaluation of copolymerization reactivity ratios in microgravity. The experimental design is presented for these studies along with an evaluation technique for in situ monitoring of polymer diffusion and polymerization kinetics.

Mathias, Lon J.↗
NASA NTRS1991

Suppression of turbulent transport by a weak magnetic field

Two-dimensional numerical simulations with high spatial resolution are used to study the effects of a large-scale magnetic field on its turbulent transport. It is commonly believed that the nonlinear back-reaction of the magnetic field on the turbulence becomes important when the field strength is close to equipartition. However, turbulent diffusion is effectively reduced even when the large-scale field is much weaker than equipartition.

Cattaneo, Fausto↗
NASA NTRS1974

Solar modulation

The important aspects of solar modulation of galactic cosmic rays are outlined. The conditions in the interplanetary medium that affect the modulation are summarized, and equations are developed to describe the behavior of cosmic rays in the solar system, including the effects of diffusion, convection, and energy loss due to adiabatic deceleration in the expanding solar wind. The particle diffusion coefficient is determined from the power spectra of interplanetary magnetic field irregularities. After some solutions for the modulation equations have been derived, the probable forms of the unmodulated cosmic ray spectra are discussed. Other topics include solar cycle variations, energy loss effects, anisotrophies, and gradients.

Fisk, L. A.↗
NASA NTRS1980

An experimental investigation of two large annular diffusers with swirling and distorted inflow

Two annular diffusers downstream of a nacelle-mounted fan were tested for aerodynamic performance, measured in terms of two static pressure recovery parameters (one near the diffuser exit plane and one about three diameters downstream in the settling duct) in the presence of several inflow conditions. The two diffusers each had an inlet diameter of 1.84 m, an area ratio of 2.3, and an equivalent cone angle of 11.5, but were distinguished by centerbodies of different lengths. The dependence of diffuser performance on various combinations of swirling, radially distorted, and/or azimuthally distorted inflow was examined. Swirling flow and distortions in the axial velocity profile in the annulus upstream of the diffuser inlet were caused by the intrinsic flow patterns downstream of a fan in a duct and by artificial intensification of the distortions. Azimuthal distortions or defects were generated by the addition of four artificial devices (screens and fences). Pressure recovery data indicated beneficial effects of both radial distortion (for a limited range of distortion levels) and inflow swirl. Small amounts of azimuthal distortion created by the artificial devices produced only small effects on diffuser performance. A large artificial distortion device was required to produce enough azimuthal flow distortion to significantly degrade the diffuser static pressure recovery.

Eckert, W. T.↗
NASA NTRS1973

Effect of sweep angle on the pressure distributions and effectiveness of the ogee tip in diffusing a line vortex

Low-speed wind tunnel tests were conducted to study the influence of sweep angle on the pressure distributions of an ogee-tip configuration with relation to the effectiveness of the ogee tip in diffusing a line vortex. In addition to the pressure data, performance and flow-visualization data were obtained in the wind tunnel tests to evaluate the application of the ogee tip to aircraft configurations. The effect of sweep angle on the performance characteristics of a conventional-tip model, having equivalent planform area, was also investigated for comparison with the ogee-tip configuration. Results of the investigation generally indicate that sweep angle has little effect on the characteristics of the ogee in diffusing a line vortex.

Balcerak, J. C.↗
NASA NTRS1999

Inter-Diffusion in the Presence of Free Convection

Because of their technological importance, establishment of the precise values of interdiffusion coefficients is important in multicomponent fluid systems. Such values are not available because diffusion is influenced by free convection due to compositionally induced density variations. In this project, earth based diffusion experiments are being performed in a viscous fluid system PbO-SiO2 at temperatures between 500-1000 C. This system is chosen because it shows a large variation in density with small changes in composition and is expected to show a large free convection effect. Infinite diffusion couples at different temperatures and times are being studied with different orientations with respect to gravity. Composition fields will be measured using an Electron Microprobe Analyzer and will be compared with the results of a complementary modeling study to extract the values of the true diffusion coefficient from the measured diffusion profiles.

Gupta, Prabhat K.↗
NASA NTRS2010

Multi-Scale Modeling of Global of Magnetospheric Dynamics

To understand the role of magnetic reconnection in global evolution of magnetosphere and to place spacecraft observations into global context it is essential to perform global simulations with physically motivated model of dissipation that is capable to reproduce reconnection rates predicted by kinetic models. In our efforts to bridge the gap between small scale kinetic modeling and global simulations we introduced an approach that allows to quantify the interaction between large-scale global magnetospheric dynamics and microphysical processes in diffusion regions near reconnection sites. We utilized the high resolution global MHD code BATSRUS and incorporate primary mechanism controlling the dissipation in the vicinity of reconnection sites in terms of kinetic corrections to induction and energy equations. One of the key elements of the multiscale modeling of magnetic reconnection is identification of reconnection sites and boundaries of surrounding diffusion regions where non-MHD corrections are required. Reconnection site search in the equatorial plane implemented in our previous studies is extended to cusp and magnetopause reconnection, as well as for magnetotail reconnection in realistic asymmetric configurations. The role of feedback between the non-ideal effects in diffusion regions and global magnetosphere structure and dynamics will be discussed.

Kuznetsova, M. M.↗