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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 451 records · Page 25

Revealing the Electrochemical Kinetics of Electrolytes in Nanosized LiFePO 4 Electrodes

Lithium-ion battery rate performance is ultimately limited by the electrolyte, yet the behaviors of electrolytes during high-rate (dis)charge remain elusive to electrochemical measurement. Herein, we develop and study a nanosized LiFePO 4 model system in which the electrolyte completely controls the electrochemical kinetics of the porous electrode. Impedance spectroscopy, cyclic voltammetry, and rate performance testing prove that ion transport in the electrolyte is the sole rate-limiting process, even in thin electrodes. A novel pseudo-steady-state extrapolation (S3E) method for Tafel analysis shows that LiFePO 4 obeys Butler-Volmer kinetics with a transfer coefficient of 3. The combination of these unexpectedly rapid interfacial kinetics and an activation barrier for phase transformation causes extreme reaction heterogeneity, which manifests as a moving reaction zone. Resistance versus capacity analysis enables direct measurement of electrolyte resistance growth during high-rate (dis)charge, revealing how the interaction between concentration polarization and a moving reaction zone controls electrolyte rate performance in LiFePO 4 electrodes. This work elucidates the profound impacts of the electrolyte on electrochemical measurements in porous battery electrodes: when the active material is not rate limiting, it is impossible to directly measure the intrinsic kinetics of the active material, but conversely, it becomes possible to directly measure the kinetics of the electrolyte.

Electrochemistry↗

Equation Discovery Using Fast Function Extraction: a Deterministic Symbolic Regression Approach

Advances in machine learning (ML) coupled with increased computational power have enabled identification of patterns in data extracted from complex systems. ML algorithms are actively being sought in recovering physical models or mathematical equations from data. This is a highly valuable technique where models cannot be built using physical reasoning alone. In this paper, we investigate the application of fast function extraction (FFX), a fast, scalable, deterministic symbolic regression algorithm to recover partial differential equations (PDEs). FFX identifies active bases among a huge set of candidate basis functions and their corresponding coefficients from recorded snapshot data. This approach uses a sparsity-promoting technique from compressive sensing and sparse optimization called pathwise regularized learning to perform feature selection and parameter estimation. Furthermore, it recovers several models of varying complexity (number of basis terms). FFX finally filters out many identified models using non-dominated sorting and forms a Pareto front consisting of optimal models with respect to minimizing complexity and test accuracy. Numerical experiments are carried out to recover several ubiquitous PDEs such as wave and heat equations among linear PDEs and Burgers, Korteweg–de Vries (KdV), and Kawahara equations among higher-order nonlinear PDEs. Additional simulations are conducted on the same PDEs under noisy conditions to test the robustness of the proposed approach.

42 ENGINEERING↗

Quenching of N sub 2

Rate coefficient for primary process in removing molecular nitrogen in high vibrational levels from active nitrogen by N atoms

Mannella, G. G.↗

Zr and Nb partition coefficients - Implications for the genesis of mare basalts, KREEP, and sea floor basalts

The distribution coefficients of Zr and Nb have been found between armalcolite, ilmenite, clinopyroxene, rutile, plagioclase, and a coexisting high-Ti mare basalt melt in the 1105-1128 C temperature range. Henry's Law is not broken over the compositional range evaluated. The distribution coefficients of clinopyroxene are strongly dependent on melt and crystal compositions. The Al2O3 activity in the melt is a strong controlling parameter. It is concluded that: (1) Apollo 11 (low K) and Apollo 17 high-Ti mare basalts may have been generated by the partial melting of an ilmenite-rich cumulate, (2) Apollo 11 (high K) basalts may have been generated by a small amount of partial melting of a more fractionated ilmenite-rich cumulate, (3) KREEP magmas may have been formed as residual melts produced by fractional crystallization of the lunar magma ocean, and (4) anomalous (type II) MOR basalts may have been generated by small degrees of partial melting of a relatively undepleted mantle with clinopyroxene remaining in the residium.

Mccallum, I. S.↗

Estimation of biophysical properties of forest canopies through inversion of microwave scatterometer data

A method for estimating the biophysical properties of a forest canopy through inversion of microwave scatterometer data is discussed. A C-band scatterometer flown over an aspen site in northern Minnesota during 19 days from May 2 to October 20, 1984, was modified to enable continuous recording of the range of the target. This provided the backscatter cross section as a function of range and was used to study scattering processes within the canopy. The remote estimates of HH, VV, and HV extinction coefficient values agreed well with the estimates obtained with the use of an active radar calibrator.

Pitts, D. E.↗

Newly found evidence of Sun-climate relationships

Solar radiation cycles drive climatic changes intercyclically. These interdecadal changes were detected as variations in solar total irradiances over the time period of recorded global surface-air-temperature (SAT) and have been restored utilizing Earth Radiation Budget Channel 10C measurements (1978-1990), Greenwich Observatory faculae data (1874-1975), and Taipei Observatory Active Region data (1964-1991). Analysis of the two separate events was carried out by treating each as a discrete time series determined by the length of each solar cycle. The results show that the global SAT responded closely to the input of solar cyclical activities, S, with a quantitative relation of T = 1.62 * S with a correlation coefficient of 0.61. This correlation peaks at 0.71 with a built-in time lag of 32 months in temperature response. Solar forcing in interannual time scale was also detected and the derived relationship of T = 0.17 * S with a correlation coefficient of 0.66 was observed. Our analysis shows derived climate sensitivities approximately fit the theoretical feedback slope, 4T(sup 3).

Kim, Hongsuk H.↗

Robust Gain-Scheduled Fault Tolerant Control for a Transport Aircraft

This paper presents an application of robust gain-scheduled control concepts using a linear parameter-varying (LPV) control synthesis method to design fault tolerant controllers for a civil transport aircraft. To apply the robust LPV control synthesis method, the nonlinear dynamics must be represented by an LPV model, which is developed using the function substitution method over the entire flight envelope. The developed LPV model associated with the aerodynamic coefficient uncertainties represents nonlinear dynamics including those outside the equilibrium manifold. Passive and active fault tolerant controllers (FTC) are designed for the longitudinal dynamics of the Boeing 747-100/200 aircraft in the presence of elevator failure. Both FTC laws are evaluated in the full nonlinear aircraft simulation in the presence of the elevator fault and the results are compared to show pros and cons of each control law.

Shin, Jong-Yeob↗

Attitude Determination and Control Subsystem (ADCS) Preparations for the EPOXI Flyby of Comet Haley 2

On November 4, 2010 the already "in-flight" Deep Impact spacecraft flew within 700km of comet 103P/Hartley 2 as part of its extended mission EPOXI, the 5th time to date any spacecraft visited a comet. In 2005, the spacecraft had previously imaged a probe impact comet Tempel 1. The EPOXI flyby marked the first time in history that two comets were explored with the same instruments on a re-used spacecraft-with hardware and software originally designed and optimized for a different mission. This made the function of the attitude determination and control subsystem (ADCS) critical to the successful execution of the EPOXI flyby. As part of the spacecraft team preparations, the ADCS team had to perform thorough sequence reviews, key spacecraft activities and onboard calibrations. These activities included: review of background sequences for the initial conditions vector, sun sensor coefficients, and reaction wheel assembly (RWA) de-saturations; design and execution of 10 trajectory correction maneuvers; science calibration of the two telescope instruments; a flight demonstration of the fastest turns conducted by the spacecraft between Earth and comet point; and assessment of RWA health (given RWA problems on other spacecraft).

Harley↗

Thermal diode and thermal switch for bi-directional heat transfer in building envelopes

The present disclosure relates to a directional heat transfer using thermal control devices, including a dual phase change thermal diode and an active contact-based thermal switch. The thermal diode includes a positive temperature coefficient switching material and a negative temperature coefficient switching material arranged in series. The thermal switch includes two thermally conducting surfaces which may be moved to contact (i.e., having a distance between them of substantially zero) creating minimal thermal contact resistance. Both thermal control devices may be used to control heat flow into and/or out of a building.

Kishore, Ravi Anant↗

Oxygen diffusion in alpha-Al2O3

Oxygen self diffusion coefficients were determined in single crystal alpha-Al2O3 using the gas exchange technique. The samples were semi-infinite slabs cut from five different boules with varying background impurities. The diffusion direction was parallel to the c-axis. The tracer profiles were determined by two techniques, single spectrum proton activation and secondary ion mass spectrometry. The SIMS proved to be a more useful tool. The determined diffusion coefficients, which were insensitive to impurity levels and oxygen partial pressure, could be described by D = .00151 exp (-572kJ/RT) sq m/s. The insensitivities are discussed in terms of point defect clustering. Two independent models are consistent with the findings, the first considers the clusters as immobile point defect traps which buffer changes in the defect chemistry. The second considers clusters to be mobile and oxygen diffusion to be intrinsic behavior, the mechanism for oxygen transport involving neutral clusters of Schottky quintuplets.

Cawley, J. D.↗

Flow Physics Study of Sweeping Jet Actuation on a NACA 0015 Swept Wing Configuration

Preliminary results from a recently completed active flow control (AFC) experiment on a 30 deg swept, semispan wing are presented. The constant chord NACA 0015 wing is configured with sweeping jet actuators at the flap shoulder to study the effects of excitation introduced into a separated, three-dimensional flowfield. The research is aimed at developing efficient active flow control approaches for swept wing configurations. Oil and tuft flow visualization data, steady and unsteady pressure data, particle image velocimetry (PIV), oil flow interferometry (OFI), and force and moment data are used to compare the flowfields with and without AFC. The parameters that were varied include freestream velocity, actuator momentum coefficient, and flap deflection angle.

active flow control↗

Software Validation Work With The ZPPR-15 Data

The analysis activities for fast reactors involve using many different pieces of software that are relied upon for their predictive capabilities. For this software to be considered reliable, documented proof that the predictions of the software are accurate is required. In this manuscript, the validation work that covers some of the Argonne software used in fast reactor design activities is discussed and displayed. This validation work includes neutron and gamma flux distributions, reaction rate distributions, and reactivity worth. In an ideal world, a reactor development program would have access to a comprehensive set of experimental facilities to help inform the design aspects of the reactor itself. While thermal-hydraulics experiments, and to a limited degree mechanical experiments, can be carried out today for validation needs, neutronics related experimental facilities are rather impractical because of the lack of experimental facilities. Given the desired time table for construction of new reactors, the reconstitution or creation of new neutronic experimental facilities is untenable and thus those reactor development programs must rely upon any available experimental measurements that are qualitatively similar to the design. While a methodology has been proposed to assess the similarity between the past experimental measurements and the reactor itself, that aspect is beyond the scope of this manuscript. In this manuscript, the focus is entirely placed on the analysis results for a series of experiments carried out at the ZPPR facility in Idaho in the mid-1980s. In this regard, this manuscript only shows the validation of the stated neutronics software for specific loadings of the ZPPR reactor. Because of the fuel form, its proposed enrichment, and the material content of the reactor core, the ZPPR-15 experiments were identified as potential validation data for the reactor. The ZPPR-15 experiments were intended as mockups of a 330 MWe Integral Fast Reactor program which was a follow on program to the Clinch River Breeder Reactor. In the ZPPR-15 series of experiments, measurements of the neutron spectrum, control rod worth, sodium void worth, foil reaction rate distributions, Doppler worth of heated samples, gamma dose, and axial expansion worth were all carried out and published. In many cases, these reactivity coefficients are good candidates to validate the reactivity coefficient calculation scheme used by the analysis software and included in the safety analysis activities of fast reactor development projects today. This manuscript discusses the modeling methodology and accuracy of the calculated experimental results using the LANL software MCNP and the ANL software package ARC (Argonne Reactor Codes). As will be shown, for many of the experimental measurements, the two software packages are found to be good predictive analysis tools for those experiments. In other cases, problems with the analysis methodology or underlying cross section data are exposed which indicates where predictive analysis is not as reliable. Finally, in some of the measurements the conclusion is reached that the experimental measurement cannot be reproduced with the analysis software as it is simply too difficult.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Software Validation Work With The ZPPR-15 Data

The analysis activities for fast reactors involve using many different pieces of software that are relied upon for their predictive capabilities. For this software to be considered reliable, documented proof that the predictions of the software are accurate is required. In this manuscript, the validation work that covers some of the Argonne software used in fast reactor design activities is discussed and displayed. This validation work includes neutron and gamma flux distributions, reaction rate distributions, and reactivity worth. In an ideal world, a reactor development program would have access to a comprehensive set of experimental facilities to help inform the design aspects of the reactor itself. While thermal-hydraulics experiments, and to a limited degree mechanical experiments, can be carried out today for validation needs, neutronics related experimental facilities are rather impractical because of the lack of experimental facilities. Given the desired time table for construction of new reactors, the reconstitution or creation of new neutronic experimental facilities is untenable and thus those reactor development programs must rely upon any available experimental measurements that are qualitatively similar to the design. While a methodology has been proposed to assess the similarity between the past experimental measurements and the reactor itself, that aspect is beyond the scope of this manuscript. In this manuscript, the focus is entirely placed on the analysis results for a series of experiments carried out at the ZPPR facility in Idaho in the mid-1980s. In this regard, this manuscript only shows the validation of the stated neutronics software for specific loadings of the ZPPR reactor. Because of the fuel form, its proposed enrichment, and the material content of the reactor core, the ZPPR-15 experiments were identified as potential validation data for the reactor. The ZPPR-15 experiments were intended as mockups of a 330 MWe Integral Fast Reactor program which was a follow on program to the Clinch River Breeder Reactor. In the ZPPR-15 series of experiments, measurements of the neutron spectrum, control rod worth, sodium void worth, foil reaction rate distributions, Doppler worth of heated samples, gamma dose, and axial expansion worth were all carried out and published. In many cases, these reactivity coefficients are good candidates to validate the reactivity coefficient calculation scheme used by the analysis software and included in the safety analysis activities of fast reactor development projects today. This manuscript discusses the modeling methodology and accuracy of the calculated experimental results using the LANL software MCNP and the ANL software package ARC (Argonne Reactor Codes). As will be shown, for many of the experimental measurements, the two software packages are found to be good predictive analysis tools for those experiments. In other cases, problems with the analysis methodology or underlying cross section data are exposed which indicates where predictive analysis is not as reliable. Finally, in some of the measurements the conclusion is reached that the experimental measurement cannot be reproduced with the analysis software as it is simply too difficult.

Aliberti, Gerardo↗

Verification of the PERSENT Software

Ongoing commercial design activities require a thorough verification of the Argonne Reactor Computation codes be performed. DIF3D is central to this system and substantial work has been done to verify its accuracy on several identified commercial needs. This manuscript details the verification work done on PERSENT which relies upon the DIF3D code for its forward and adjoint flux solution. Previous work identified the PERSENT features required to be verified to support commercial design activities, features of which are generally applicable to hexagonal-Z fast reactor designs. The scope of this verification effort includes verifying PERSENT’s ability to correctly calculate four key quantities: perturbation worth distributions, kinetics parameters, sensitivity coefficients, and cross section uncertainty quantification. This manuscript provides the verification tasks and their results with respect to these quantities needed for commercial design activities. For the perturbation worth distributions, hand calculations are deployed to verify the PERSENT calculated results. Similarly, hand calculation of the PERSENT computed kinetics parameters is also used to verify the PERSENT results. In both of these, the input to PERSENT is manipulated to ensure the hand calculation exactly matches the equations PERSENT is calculating. The sensitivity coefficients involve calculating the derivatives of a parameter (such as reactivity worth), with respect to the cross section data. Direct finite difference calculations with DIF3D are used to verify the PERSENT calculated results. For the uncertainty quantification, manufactured input to PERSENT is used to allow an exact hand calculation to reproduce the PERSENT calculated results. The work detailed in this report verified that significant issues were identified for earlier versions of PERSENT for sensitivity coefficients which were corrected in this work and thus version 12.1.0 of PERSENT must be used to reproduce all of the verified work in this report.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Comparisons of Characteristics of Magnetic Clouds and Cloud-Like Structures During 1995-2012

Using eighteen years (1995 - 2012) of solar wind plasma and magnetic field data (observed by the Wind spacecraft), solar activity (e.g. sunspot number: SSN), and the geomagnetic activity index (Dst), we have identified 168 magnetic clouds (MCs) and 197 magnetic cloud - like structures (MCLs), and we have made relevant comparisons. The following features are found during seven different periods (TP: Total period during 1995 - 2012, P1 and P2: first and second half period during 1995 - 2003 and 2004 - 2012, Q1 and Q2: quiet periods during 1995 - 1997 and 2007 - 2009, A1 and A2: active periods during 1998 - 2006 and 2010 - 2012). (1) During the total period the yearly occurrence frequency is 9.3 for MCs and 10.9 for MCLs. (2) In the quiet periods Q1 > Q1 and Q2 > Q2, but in the active periods A1 < A1 and A2 < A2. (3) The minimum Bz (Bzmin) inside of a MC is well correlated with the intensity of geomagnetic activity, Dstmin (minimum Dst found within a storm event) for MCs (with a Pearson correlation coefficient, c.c. = 0.75, and the fitting function is Dstmin = 0.90+7.78Bzmin), but Bzmin for MCLs is not well correlated with the Dst index (c.c. = 0.56, and the fitting function is Dstmin = -9.40+ 4.58 Bzmin). (4) MCs play a major role in producing geomagnetic storms: the absolute value of the average Dstmin ( MC = -70 nT) for MCs associated geomagnetic storms is two times stronger than that for MCLs ( MCL = -35 nT), due to the difference in the IMF (interplanetary magnetic field) strength. (5) The SSN is not correlated with MCs ( TP, c.c. = 0.27), but is well associated with MCLs ( TP, c.c. = 0.85). Note that the c.c. for SSN vs. P2 is higher than that for SSN vs. P2. (6) Averages of IMF, solar wind speed, and density inside of the MCs are higher than those inside of the MCLs. (7) The average of MC duration (approx. = 18.82 hours) is approx. = 20 % longer than the average of MCL duration (approx. = 15.69 hours). (8) There are more MCs than MCLs in the quiet solar period, and more MCLs than MCs in the active solar period, probably due to the interaction between a MC and another significant interplanetary disturbance (including another MC) which could obviously change the character of a MC, but we speculate that some MCLs are no doubt due to other factors such as complex birth conditions at the Sun.

CME↗

Diffusion of self-propelled particles in complex media

The diffusion of active microscopic organisms in complex environments plays an important role in a wide range of biological phenomena from cell colony growth to single organism transport. Here, we investigate theoretically and computationally the diffusion of a self-propelled particle (the organism) embedded in a complex medium composed of a collection of nonmotile solid particles that mimic soil or other cells. Under such conditions we find that the rotational relaxation time of the swimming direction depends on the swimming velocity and is drastically reduced compared to a pure Newtonian fluid. This leads to a dramatic increase (of several orders of magnitude) in the effective rotational diffusion coefficient of the self-propelled particles, which can lead to “self-trapping” of the active particles in such complex media. An analytical model is put forward that quantitatively captures the computational results. Our work sheds light on the role that the environment plays in the behavior of active systems and can be generalized in a straightforward fashion to understand other synthetic and biological active systems in heterogenous environments.

36 MATERIALS SCIENCE↗

Synergic inversion technique for active and passive microwave remote sensing of the ocean

A unified approach for combining active and passive microwave measurements for remote sensing applications is described. A synergic inversion technique has been developed and applied to the retrieval of geophysical parameters of the ocean surface and of the atmosphere. It is based on the combination of radiometric and radar measurements at the electromagnetic and cell level and not only on the correction of radar measurements by radiometric measurements, or conversely. Such a combination is performed through a common quantity: the bistatic scattering coefficient of the observed surface. This is used in a direct model to simulate combined measurements from active and passive sensors. It requires a rather complete and accurate calculation of the scattering of microwaves by the rough sea surface. Comparisons with experimental models derived for scatterometers and radar altimeters or with data derived from radiometric measurements show that the results of this unified approach are consistent with those from separate microwave sensors, at least for a foam-free sea surface.

Sobieski, Piotr↗

Corrosion and Tribocorrosion Behavior of Ti-B{sub 4}C Composites Joined with TiCuNi Brazing Alloy

Corrosion behavior of joined Ti-B{sub 4}C composites was evaluated in 9 g/L NaCl solution using cyclic polarization and electrochemical impedance spectroscopy. Tribocorrosion behavior was investigated by sliding against an alumina ball under open-circuit potential and potentiodynamic polarization. The results showed that joining did not negatively affect the corrosion behavior of the composites. Regarding tribocorrosion, while joining did not significantly influence the coefficient of friction and total wear volume loss, it resulted in slightly increased electrochemical activity under sliding. These results showed that brazing may be considered as a simple and low-cost technique for joining Ti-B{sub 4}C composites to be operated in tribocorrosive environments.

36 MATERIALS SCIENCE↗