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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 1,459 records · Page 81
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

CALCULATING ROTATING HYDRODYNAMIC AND MAGNETOHYDRODYNAMIC WAVES TO UNDERSTAND MAGNETIC EFFECTS ON DYNAMICAL TIDES

To understand magnetic effects on dynamical tides, we study the rotating magnetohydrodynamic (MHD) flow driven by harmonic forcing. The linear responses are analytically derived in a periodic box under the local WKB approximation. Both the kinetic and Ohmic dissipations at the resonant frequencies are calculated, and the various parameters are investigated. Although magnetic pressure may be negligible compared to thermal pressure, the magnetic field can be important for the first-order perturbation, e.g., dynamical tides. It is found that the magnetic field splits the resonant frequency, namely the rotating hydrodynamic flow has only one resonant frequency, but the rotating MHD flow has two, one positive and the other negative. In the weak field regime the dissipations are asymmetric around the two resonant frequencies and this asymmetry is more striking with a weaker magnetic field. It is also found that both the kinetic and Ohmic dissipations at the resonant frequencies are inversely proportional to the Ekman number and the square of the wavenumber. The dissipation at the resonant frequency on small scales is almost equal to the dissipation at the non-resonant frequencies, namely the resonance takes its effect on the dissipation at intermediate length scales. Moreover, the waves with phase propagation that is perpendicular to the magnetic field are much more damped. It is also interesting to find that the frequency-averaged dissipation is constant. This result suggests that in compact objects, magnetic effects on tidal dissipation should be considered.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2016

Investigating Global Ion and Neutral Atom Populations with IBEX and Voyager

The main objective of this project was to investigate pickup ion (PUI) production in the solar wind and heliosheath (the region between the termination shock and the heliopause) and compute the distributed energetic neutral atom fluxes throughout the helioshpere. The simulations were constrained by comparing the model output against observations from Ulysses, New Horizons, Voyager 1 and 2, and IBEX space probes. As evidenced by the number of peer reviewed journal publications resulting from the project (13 plus three submitted) and their citation rate (156 citations over three years), the project has made a lasting contribution to the field. The outcome is a significant improvement of our understanding of the pickup ion production and distribution in the distant heliosphere. The team has accomplished the entire set of tasks A-H set forth in the proposal. Namely, the transport modeling framework has been augmented with two populations of pickup ions (PUIs), the boundary conditions for the plasma and interstellar neutral hydrogen were verified against Ulysses and New Horizons PUI and an optimal set of velocity diffusion parameters established. The multi-component fluxes of PUIs were computed and isotropic velocity distributions generated for each cell in the computer simulation that covered the heliosphere from 1.5 AU to the heliopause. The distributions were carefully compared with in situ measurements at 3 AU (Ulysses), 12 AU (New Horizons), and 80-90 AU (Voyager 1 and 2) as well as those inferred from ENA fluxes measured by Cassini and IBEX (Wu et al., 2016). Some examples of modeldata comparison are shown in Figure 1. We have used coupled MHD-plasma and kinetic-neutral code to investigate the likely range of plasma and magnetic field parameters in the local interstellar medium (LISM), based on the assumption that the shape of the IBEX ribbon could be used to determine the orientation of the interstellar magnetic field. While the magnetic field is believed to be oriented toward the center of the ribbon, constraining its strength requires comparing the model-predicted angular diameter and circularity of the ribbon with the observations. The study, published in Heerikhuisen et al. (2014), found that the most likely range for the LISM magnetic field strength is between 0.2 and 0.3 nT, which is less than previously thought. Figure 2 shows the IBEX data (left) and compares it to the simulation with a 0.2 nT interstellar magnetic field (center) and a 0.4 nT (right).

Florinski, Vladimir↗
DOE OSTI2016

A theoretical study of the relaxation of a phenyl group chemisorbed to an RDX freestanding thin film

Energy relaxation from an excited phenyl group chemisorbed to the surface of a crystalline thin film of α-1,3,5-trinitro-1,3,5-triazacyclohexane (α-RDX) at 298 K and 1 atm is simulated using molecular dynamics. Two schemes are used to excite the phenyl group. In the first scheme, the excitation energy is added instantaneously as kinetic energy by rescaling momenta of the 11 atoms in the phenyl group. In the second scheme, the phenyl group is equilibrated at a higher temperature in the presence of static RDX geometries representative of the 298 K thin film. An analytical model based on ballistic phonon transport that requires only the harmonic part of the total Hamiltonian and includes no adjustable parameters is shown to predict, essentially quantitatively, the short-time dynamics of the kinetic energy relaxation (∼200 fs). The dynamics of the phenyl group for times longer than about 6 ps follows exponential decay and agrees qualitatively with the dynamics described by a master equation. Long-time heat propagation within the bulk of the crystal film is consistent with the heat equation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

KINETIC SIMULATION OF SLOW MAGNETOSONIC WAVES AND QUASI-PERIODIC UPFLOWS IN THE SOLAR CORONA

Quasi-periodic disturbances of emission-line parameters are frequently observed in the corona. These disturbances propagate upward along the magnetic field with speeds of ∼100 km s{sup −1}. This phenomenon has been interpreted as evidence of the propagation of slow magnetosonic waves or has been argued to be a signature of intermittent outflows superposed on the background plasmas. Here we aim to present a new “wave + flow” model to interpret these observations. In our scenario, the oscillatory motion is a slow-mode wave, and the flow is associated with a beam created by the wave–particle interaction owing to Landau resonance. With the help of a kinetic model, we simulate the propagation of slow-mode waves and the generation of beam flows. We find that weak periodic beam flows can be generated by to Landau resonance in the solar corona, and the phase with the strongest blueward asymmetry is ahead of that with the strongest blueshift by about 1/4 period. We also find that the slow wave damps to the level of 1/ e after the transit time of two wave periods, owing to Landau damping and Coulomb collisions in our simulation. This damping timescale is similar to that resulting from thermal conduction in the MHD regime. The beam flow is weakened/attenuated with increasing wave period and decreasing wave amplitude since Coulomb collisions become more and more dominant over the wave action. We suggest that this “wave + flow” kinetic model provides an alternative explanation for the observed quasi-periodic propagating perturbations in various parameters in the solar corona.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

Development of an in situ temperature stage for synchrotron X-ray spectromicroscopy

In situ characterization of micro- and nanoscale defects in polycrystalline thin-film materials is required to elucidate the physics governing defect formation and evolution during photovoltaic device fabrication and operation. X-ray fluorescence spectromicroscopy is particularly well-suited to study defects in compound semiconductors, as it has a large information depth appropriate to study thick and complex materials, is sensitive to trace amounts of atomic species, and provides quantitative elemental information, non-destructively. Current in situ methods using this technique typically require extensive sample preparation. In this work, we design and build an in situ temperature stage to study defect kinetics in thin-film solar cells under actual processing conditions, requiring minimal sample preparation. Careful selection of construction materials also enables controlled non-oxidizing atmospheres inside the sample chamber such as H 2 Se and H 2 S. Temperature ramp rates of up to 300 °C/min are achieved, with a maximum sample temperature of 600 °C. As a case study, we use the stage for synchrotron X-ray fluorescence spectromicroscopy of CuIn x Ga 1–x Se 2 (CIGS) thin-films and demonstrate predictable sample thermal drift for temperatures 25–400°C, allowing features on the order of the resolution of the measurement technique (125 nm) to be tracked while heating. As a result, the stage enables previously unattainable in situ studies of nanoscale defect kinetics under industrially relevant processing conditions, allowing a deeper understanding of the relationship between material processing parameters, materials properties, and device performance.

47 OTHER INSTRUMENTATION↗
NASA NTRS1980

Kinetic energy budgets in areas of intense convection

A kinetic energy budget analysis of the AVE-SESAME 1 period which coincided with the deadly Red River Valley tornado outbreak is presented. Horizontal flux convergence was found to be the major kinetic energy source to the region, while cross contour destruction was the major sink. Kinetic energy transformations were dominated by processes related to strong jet intrusion into the severe storm area. A kinetic energy budget of the AVE 6 period also is presented. The effects of inherent rawinsonde data errors on widely used basic kinematic parameters, including velocity divergence, vorticity advection, and kinematic vertical motion are described. In addition, an error analysis was performed in terms of the kinetic energy budget equation. Results obtained from downward integration of the continuity equation to obtain kinematic values of vertical motion are described. This alternate procedure shows promising results in severe storm situations.

Fuelberg, H. E.↗
DOE OSTI2017

Simulation and control of a passively cooled small modular reactor Samet - 142

This work regulates a small modular reactor (SMR) with traditional control methodologies and analyzes its response to typical disturbances. An analytical model for the passively cooled NuScale SMR is developed to represent the essential dynamics. The MATLAB/Simulink based model consists of reactor core, steam generator, pressurizer, hot leg riser and downcomer, and turbine representations. The point kinetics equations with a single combined neutron precursor group and the lumped parameter representations with single-phase natural circulation account for the neutronics and thermohydraulics in the reactor core. A lumped parameter, moving-boundary approach forms the basis of the nonlinear model adopted for the once-through helical-coil heat exchangers in which boundaries between regions of different fluid states (i.e., subcooled, boiling, and superheated) vary over time. A proportional-integral-derivative controller employing a sliding-average temperature strategy commonly used for pressurized water reactors is implemented. The responses of the SMR to two different disturbances are analyzed and discussed in detail. For the first scenario, a 5% step increase in the load is applied to the system, which results in a change in the steam valve opening. For comparison, two different simulations under this same disturbance are run: one including and one excluding the control systems. The second scenario tests the effectiveness of the control system to increase (or decrease) the reactor thermal power to a certain level within a desired time period. The simulation results show that important system variables are kept at the desired values by the proposed control strategy. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2013

THERMAL ESCAPE IN THE HYDRODYNAMIC REGIME: RECONSIDERATION OF PARKER's ISENTROPIC THEORY BASED ON RESULTS OF KINETIC SIMULATIONS

The one-dimensional steady-state problem of thermal escape from a single-component atmosphere of mon- and diatomic gases is studied in the hydrodynamic (blow-off) regime using the direct simulation Monte Carlo method for an evaporative-type condition at the lower boundary. The simulations are performed for various depths into an atmosphere, indicated by a Knudsen number, Kn{sub 0}, equal to the ratio of the mean free path of molecules to the radial position of the source surface, ranging from 10 to 10{sup -5}, and for the range of the source Jeans parameter, {lambda}{sub 0}, equal to the ratio of gravitational and thermal energies, specific to blow-off. The results of kinetic simulations are compared with the isentropic model (IM) and the Navier-Stokes model. It is shown that the IM can be simplified if formulated in terms of the local Mach number and Jeans parameter. The simulations predict that at Kn{sub 0} < {approx} 10{sup -3} the flow includes a near-surface non-equilibrium Knudsen layer, a zone where the flow can be well approximated by the IM, and a rarefied far field. The corresponding IM solutions, however, only approach Parker's critical solution as {lambda}{sub 0} approaches the upper limit for blow-off. The IM alone is not capable for predicting the flow and requires boundary conditions at the top of the Knudsen layer. For small Kn{sub 0}, the scaled escape rate and energy loss rate are found to be independent of {lambda}{sub 0}. The simulation results can be scaled to any single-component atmosphere exhibiting blow-off if the external heating above the lower boundary is negligible, in particular, to sublimation-driven atmospheres of Kuiper belt objects.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

Kinetic model of force-free current sheets with non-uniform temperature

The kinetic model of a one-dimensional force-free current sheet (CS) developed recently by Harrison and Neukirch [Phys. Rev. Lett. 102(13), 135003 (2009)] predicts uniform distributions of the plasma temperature and density across the CS. However, in realistic physical systems, inhomogeneities of these plasma parameters may arise quite naturally due to the boundary conditions or local plasma heating. Moreover, as the CS spatial scale becomes larger than the characteristic kinetic scales (the regime often referred to as the MHD limit), it should be possible to set arbitrary density and temperature profiles. Thus, an advanced model has to allow for inhomogeneities of the macroscopic plasma parameters across the CS, to be consistent with the MHD limit. In this paper, we generalise the kinetic model of a force-free current sheet, taking into account the inhomogeneity of the density and temperature across the CS. In the developed model, the density may either be enhanced or depleted in the CS central region. The temperature profile is prescribed by the density profile, keeping the plasma pressure uniform across the CS. All macroscopic parameters, as well as the distribution functions for the protons and electrons, are determined analytically. Applications of the developed model to current sheets observed in space plasmas are discussed.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2022

Stability analysis of a one-dimensional multiphysics model of a molten salt fast reactor

Reactor designs with a fast neutron spectrum have recently moved into the research focus for possible Generation IV reactor concepts - a representative of which is the molten salt fast reactor (MSFR). In order to assess the safety and reliability of this reactor concept, it is necessary to obtain knowledge of the system behaviour. An important part of this research concerns the dynamical stability of the MSFR. Research regarding the MSFR stability so far has either been using linearized models for stability criteria or only been examining certain transients at fixed parameter values. This work delivers a comprehensive stability analysis for a non-linearized MSFR model, and a wide range of values for all relevant parameters. For this purpose, a one-dimensional MSFR model was set up, taking neutron kinetics and thermal hydraulics in the form of a system of differential equations into account. The stability of this model was investigated by means of the numerical tool MATCONT, which was used to monitor the evolution of a so-called fixed-point solution, here referring to the steady state at operating conditions of the system, while system parameters got varied. The MATCONT analyses showed no loss of stability for any of the considered parameter variations and no solutions that might co-exist in parallel with the steady-state fixed-point solution. Therefore these results indicate a stable fixed point to which all solution transients converge, making the considered MSFR model insusceptible to deviations from the equilibrium. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
NASA NTRS1992

Evolution of a terrestrial magma ocean: Thermodynamics, kinetics, rheology, convection, differentiation

The evolution of an initially totally molten magma ocean is constrained on the basis of analysis of various physical problems in the magma ocean. First of all an equilibrium thermodynamics of the magma ocean is developed in the melting temperature range. The equilibrium thermodynamical parameters are found as functions only of temperature and pressure and are used in the subsequent models of kinetics and convection. Kinematic processes determine the crystal size and also determine a non-equilibrium thermodynamics of the system. Rheology controls all dynamical regimes of the magma ocean. The thermal convection models for different rheological laws are developed for both the laminar convection and for turbulent convection in the case of equilibrium thermodynamics of the multiphase system. The evolution is estimated on the basis of all the above analysis.

Solomatov, V. S.↗
DOE OSTI2015

Synthesis of phase-pure and monodisperse iron oxide nanoparticles by thermal decomposition

We present a comprehensive template for the design and synthesis of iron oxide nanoparticles with control over size, size distribution, phase, and resulting properties. Monodisperse superparamagnetic iron oxide nanoparticles were synthesized by thermal decomposition of three different iron containing precursors (iron oleate, iron pentacarbonyl, and iron oxyhydroxide) in organic solvents under a variety of synthetic conditions. We compare the suitability of these three kinetically controlled synthesis protocols, which have in common the use of iron oleate as a starting precursor or reaction intermediate, for producing nanoparticles with specific size and magnetic properties. Monodisperse particles were produced over a tunable range of sizes from approximately 2-30 nm. Reaction parameters such as precursor concentration, addition of surfactant, temperature, ramp rate, and time were adjusted to kinetically control size and size-distribution. In particular, large quantities of excess surfactant (up to 25:1 molar ratio) alter reaction kinetics and result in larger particles with uniform size; however, there is often a trade-off between large particles and a narrow size distribution. Iron oxide phase is also critical for establishing magnetic properties. As an example, we show the importance of obtaining the required iron oxide phase for application to Magnetic Particle Imaging (MPI), and describe how phase purity can be controlled.

Environmental Molecular Sciences Laboratory↗
DOE OSTI2018

Regular instantons in the Eddington-inspired-Born-Infeld gravity: Lorentzian wormholes from bubble nucleations

The O(4)-symmetric regular instanton solutions are studied within the framework of the Eddington-inspired-Born-Infeld gravity (EiBI). Here we find that the behavior of the solution would deviate from that in Einstein gravity when the kinetic energy of the scalar field is sufficiently large. The tunneling probability is calculated numerically in different parameter space. We find that the tunneling probability would increase with the Born-Infeld coupling constant, which is assumed to be positive in this paper. Furthermore, we discover a neck feature in the physical instanton solutions when the kinetic energy of the scalar field is sufficiently large. This feature can be interpreted as a Lorentzian time-like wormhole geometry formed during the bubble materialization.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Design Tool for Estimating Chemical Hydrogen Storage System Characteristics for Light-Duty Fuel Cell Vehicles

The U.S. Department of Energy (DOE) has developed a vehicle framework model to simulate fuel cell-based light-duty vehicle operation for various hydrogen storage systems. This transient model simulates the performance of the storage system, fuel cell, and vehicle for comparison to DOE’s Technical Targets using four drive cycles/profiles. Chemical hydrogen storage models have been developed for the Framework model for both exothermic and endothermic materials. Despite the utility of such models, they require that material researchers input system design specifications that cannot be easily estimated. To address this challenge, a design tool has been developed that allows researchers to directly enter kinetic and thermodynamic chemical hydrogen storage material properties into a simple sizing module that then estimates the systems parameters required to run the storage system model. Additionally, this design tool can be used as a standalone executable file to estimate the storage system mass and volume outside of the framework model and compare it to the DOE Technical Targets. These models will be explained and exercised with existing hydrogen storage materials.

hydrogen storage materials, Fuel Cell Vehicles, de↗
DOE OSTI2011

Decay kinetics of the excited S{sub 1} state of the cyanine dye Cy{sup +}I{sup -} (thiacarbocyanine iodide): The computation of quantum yields for different pathways

This work explains the unordinary solvent effect which was observed in the photochemical decay kinetics for the cyanine dye thiacarbocyanine iodide (Cy{sup +}I{sup -}) in binary solvent mixtures toluene/dimethylsulfoxide. The interpretation is formulated in terms of the probability density F(R) describing the distribution of interionic distances R in the ion pair Cy{sup +}I{sup -} and depending on the solvent composition. The proper normalization of this distribution is expressed via the degree of association {alpha} for the ion pair in a given solvent mixture. The {alpha} values are, in turn, extracted by means of the mass action law from the ionic association constants computed in a separate publication. The detailed kinetic scheme includes the empirical parametrization of the R-dependent kinetic constants for different decay channels. The multiparameter fitting procedure represents, with the reasonable parameter values, the dependence of the observed quantum yields on the solvent composition.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1992

A self-consistent model for the particles and fields upstream of an outgassing comet. II - A time-dependent description

In a previous paper, the global variation of the magnetic field and solar wind flow parameters in the unshocked region upstream of an outgassing comet was determined using a kinetic treatment for the cometary ions. Two different assumptions were made concerning the cometary ion distribution function: the pickup cometary ions formed either a velocity space gyrotropic ring distribution or a velocity space isotropic shell distribution in the solar wind frame of reference. In the present paper the general case is considered wherein the newly picked up ions are elastically pitch angle scattered from the initial ring distribution to a shell with some characteristic time scale. Using theoretically determined parameters which reflect the conditions expected at Comet Kopff (a typical short-period comet and a possible target for the CRAF/Cassini mission) for various heliocentric distances, how the pitch angle scattering rate affects the global morphology is determined.

Flammer, K.↗
DOE OSTI2022

A Coupled Small and Wide-Angle X-Ray Scattering Study of Phase Transformation Mechanisms in U-6Wt Pct Nb

The elevated temperature phase transformation kinetics of U-6wt%Nb in both wrought and cast conditions were investigated using in-situ high energy synchrotron X-ray scattering. The evolution of the phase content, γ-phase composition, and microstructure morphology was determined through the analysis of simultaneously collected wide-angle diffraction and small-angle scattering (SAXS) data. The results of the wide-angle scattering analysis, especially the phase fractions and average composition of the γ-phase, provide model parameters to enable a quantitative analysis using the SAXS data. Greater clarity regarding the kinetics of different precipitation mechanisms, namely the continuous precipitation (CP) of α-U within the γ-phase matrix and the discontinuous (DP) grain boundary precipitation of a lamellar microstructure, consisting of α-U and Nb-rich γ-phase are obtained from the coupled measurement modes. These results indicate that the CP mechanism is responsible for the initial precipitation of α-U at all temperatures considered. Near the nose in the time-temperature-transformation (TTT) diagram at ~798 K, both mechanisms are active during the early stages of phase transformation. However, the DP mechanism has an increasingly long incubation period with decreasing temperature below the TTT nose. In conclusion, the average interlamellar spacing obtained from the SAXS analysis increases with time, providing further evidence of the so-called divergent DP behavior previously observed in U-6wt%Nb alloys.

36 MATERIALS SCIENCE↗