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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 289 records · Page 16

Semi-Empirical Interatomic Potential for Large-Scale Molecular Dynamics Simulation of Metal-Oxide Systems

Classical molecular dynamics (MD) simulation can be applied to systems containing billions of atoms during times up to microseconds. However, utilization of a large-scale MD simulation requires reliable but computationally cheap interatomic potentials. In the case of metallic systems, embedded atom method (EAM) and Finnis-Sinclair (FS) potentials are the reasonable choices, but their development for multicomponent alloys is a challenge. Addition of oxygen atoms makes the problem of developing semi-empirical potentials even more difficult because the long-range Coulomb interaction cannot be neglected, and different atoms have different charges which vary during MD relaxation such that a charge equilibration procedure should be applied every MD step. As results researchers tend to avoid simulating metal-oxide systems. In this talk, a new Finnis-Sinclair (FS) Ni-Co-Cr potential will be presented. Special attention will be paid to reproducing of the element melting temperatures and clustering. Next, a charge transfer ionic potential (CTIP) developed to simulate the NiO properties will be presented. This potential utilizes the Ni FS potential and accounts for the Coulomb interaction in the vicinity of oxygen atoms. Fitting of the CTIP parameters and FS potential functions describing the interaction with oxygen atoms to the available experimental and ab initio data will be discussed. Results of MD simulation of interaction of NiO particles with dislocations in Ni will be shown.

molecular dynamics simulation↗

Large-Signal Impedance Modeling of Three-Phase Voltage Source Converters: Preprint

Resonance problems have become a major hurdle in the large-scale grid integration of renewable energy. It is important to be able to predict the amplitude of resonance-induced distortions for the protection and control design of power electronic converters. We recently presented an impedance-based approach for the prediction of resonance amplitude. It was shown that the impedance response of a converter starts changing with the amplitude of resonance; this blocks the amplitude growth beyond a certain point where the converter forms a limit cycle mode of sustained oscillations. The large-signal impedance of a converter captures the change in its impedance response with the resonance amplitude, and it can be used to predict the resonance amplitude under different operation conditions. This paper presents large-signal sequence impedance modeling for three-phase voltage source converters (VSC) with dq-current control and PLL. Modeling challenges encountered in the absence of the small-signal approximation are addressed by a) leveraging the dominating influence of hard non-linearities such as pulse-width modulation saturation and limiters over soft non-linearities in shaping the converter large-signal behavior and b) modeling the large-signal gain of hard non-linearities using appropriate describing functions. Developed large-signal impedance models are validated using numerical simulations. Measurements of the large-signal impedance responses of a commercial 1-MW VSC-based inverter are also presented to experimentally demonstrate the effects of the injected perturbation amplitude on impedance response as predicted by the developed model.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Plant functional types broadly describe water use strategies in the Caatinga, a seasonally dry tropical forest in northeast Brazil

In seasonally dry tropical forests, plant functional type can be classified as deciduous low wood density, deciduous high wood density, or evergreen high wood density species. While deciduousness is often associated with drought-avoidance and low wood density is often associated with tissue water storage, the degree to which these functional types may correspond to diverging and unique water use strategies has not been extensively tested. We examined (a) tolerance to water stress, measured by predawn and mid-day leaf water potential; (b) water use efficiency, measured via foliar δ 13 C; and (c) access to soil water, measured via stem water δ 18 O. We found that deciduous low wood density species maintain high leaf water potential and low water use efficiency. Deciduous high wood density species have lower leaf water potential and variable water use efficiency. Both groups rely on shallow soil water. Evergreen high wood density species have low leaf water potential, higher water use efficiency, and access alternative water sources. These findings indicate that deciduous low wood density species are drought avoiders, with a specialized strategy for storing root and stem water. Deciduous high wood density species are moderately drought tolerant, and evergreen high wood density species are the most drought tolerant group. Our results broadly support the plant functional type framework as a way to understand water use strategies, but also highlight species-level differences.

54 ENVIRONMENTAL SCIENCES↗

Space Station Program implications from the viewpoint of the Space Station Operations Task Force

An operational concept for the Space Station which has been developed by the Space Station Operations Task Force is described. The operations functions are described, and the relationships of these functions to the overall framework for operations are defined. Product flows for the recommended framework are discussed, and the roles and responsibilities for the proposed operations organization during both the development and the mature operations phases of the Space Station Program are examined.

Paules, Granville E.↗

A quadratic pulse height analyzer for space applications.

A flight-worthy pulse height analyzer that has a quadratic transfer function is described. This quadratic function permits optimum usage of the entire PHA dynamic range due to the quadratic nature of the gamma ray spectrometer's resolution vs energy. After the theoretical design discussion, the implementation of the design is examined and test results described. The analyzer is part of the University of New Hampshire gamma ray monitor for OSO-H.

Burtis, D. W.↗

Design of ceramic components with the NASA/CARES computer program

The ceramics analysis and reliability evaluation of structures (CARES) computer program is described. The primary function of the code is to calculate the fast-fracture reliability or failure probability of macro-scopically isotropic ceramic components. These components may be subjected to complex thermomechanical loadings, such as those found in heat engine applications. CARES uses results from MSC/NASTRAN or ANSYS finite-element analysis programs to evaluate how inherent surface and/or volume type flaws component reliability. CARES utilizes the Batdorf model and the two-parameter Weibull cumulative distribution function to describe the effects of multiaxial stress states on material strength. The principle of independent action (PIA) and the Weibull normal stress averaging models are also included. Weibull material strength parameters, the Batdorf crack density coefficient, and other related statistical quantities are estimated from four-point bend bar or uniform uniaxial tensile specimen fracture strength data. Parameter estimation can be performed for a single or multiple failure modes by using a least-squares analysis or a maximum likelihood method. Kolmogorov-Smirnov and Anderson-Darling goodness-to-fit-tests, 90 percent confidence intervals on the Weibull parameters, and Kanofsky-Srinivasan 90 percent confidence band values are also provided. Examples are provided to illustrate the various features of CARES.

Nemeth, Noel N.↗

More About Vector Adaptive/Predictive Coding Of Speech

Report presents additional information about digital speech-encoding and -decoding system described in "Vector Adaptive/Predictive Encoding of Speech" (NPO-17230). Summarizes development of vector adaptive/predictive coding (VAPC) system and describes basic functions of algorithm. Describes refinements introduced enabling receiver to cope with errors. VAPC algorithm implemented in integrated-circuit coding/decoding processors (codecs). VAPC and other codecs tested under variety of operating conditions. Tests designed to reveal effects of various background quiet and noisy environments and of poor telephone equipment. VAPC found competitive with and, in some respects, superior to other 4.8-kb/s codecs and other codecs of similar complexity.

Jedrey, Thomas C.↗

Data management system CIU and DIU. Appendix A: CIU and DIU schematics

The Computer Interface Unit (CIU) and the Data Interface Unit (DIU) of the Data Management System (DMS) were described as to their functional location, purpose and function. This describes the CIU and DIU at the unit level illustrating their interface thru the Data Bus (DBUS) and to other DMS units. All unit level interfaces are defined as to function and characteristics. The controls, indicators, test points and connectors are listed and function, location and application are described for each. The mechanical configuration is defined and illustrated to provide card and component location for modification or repair purposes. Unique disassembly and assembly requirements are outlined where applicable. A unit internal functional block diagram level description is provided.

Source record↗

Condensed-matter energetics from diatomic molecular spectra

Analyses of molecular spectra and compression data from crystals show that a single function successfully describes the dependence on interatomic separation of both the potential energy of diatomic molecules and the cohesive binding energy of condensed matter. The empirical finding that one function describes interatomic energies for such diverse forms of matter and over a wide range of conditions can be used to extend condensed-matter equations of state but warrants further theoretical study.

Kim, In H.↗

A three-point form factor through five loops

We bootstrap the three-point form factor of the chiral part of the stress­tensor supermultiplet in planar $\mathcal{N}$ = 4 super-Yang-Mills theory, obtaining new results at three, four, and five loops. Our construction employs known conditions on the first, second, and final entries of the symbol, combined with new multiple-final-entry conditions, “extended-Steinmann-like” conditions, and near-collinear data from the recently-developed form factor operator product expansion. Our results are expected to give the maximally transcendental parts of the gg → Hg and H → ggg amplitudes in the heavy-top limit of QCD. At two loops, the extended-Steinmann-like space of functions we describe contains all transcendental functions required for four-point amplitudes with one massive and three massless external legs, and all massless internal lines, including processes such as gg → Hg and γ * → $q\overline{q}g$. We expect the extended-Steinmann-like space to contain these amplitudes at higher loops as well, although not to arbitrarily high loop order. We present evidence that the planar $\mathcal{N}$ = 4 three-point form factor can be placed in an even smaller space of functions, with no independent ζ values at weights two and three.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Gravitational forces and moments on spacecraft

The solution of problems of attitude dynamics of spacecraft and the influence of gravitational forces and moments is examined. Arguments are presented based on Newton's law of gravitation, and employing the methods of Newtonian (vectorial) mechanics, with minimal recourse to the classical concepts of potential theory. The necessary ideas were developed and relationships were established to permit the representation of gravitational forces and moments exerted on bodies in space by other bodies, both in terms involving the mass distribution properties of the bodies, and in terms of vector operations on those scalar functions classically described as gravitational potential functions.

Kane, T. R.↗

Symbolic Laplace transforms of special functions

A MACSYMA implementation of the Laplace transform for special functions is described. The generalized hypergeometric functions are used as a basis for the representation of approximately fifty special functions. Only a relatively small number of formulas that generally involve generalized hypergeometric functions are utilized for the integration stage. A sample of actual examples and their timing is provided.

Avgoustis, Y.↗

C-MOS bulk metal design handbook

The LSI standard cell array technique was used in the fabrication of more than 20 CMOS custom arrays. This technique consists of a series of computer programs and design automation techniques referred to as the Computer Aided Design And Test (CADAT) system that automatically translate a partitioned logic diagram into a set of instructions for driving an automatic plotter which generates precision mask artwork for complex LSI arrays of CMOS standard cells. The standard cell concept for producing LSI arrays begins with the design, layout, and validation of a group of custom circuits called standard cells. Once validated, these cells are given identification or pattern numbers and are permanently stored. To use one of these cells in a logic design, the user calls for the desired cell by pattern number. The Place, Route in Two Dimension (PR2D) computer program is then used to automatically generate the metalization and/or tunnels to interconnect the standard cells into the required function. Data sheets that describe the function, artwork, and performance of each of the standard cells, the general procedure for implementation of logic in CMOS standard cells, and additional detailed design information are presented.

Edge, T. M.↗

Mechanically Induced g-Jitter from Space Station Rotary Joints

The mission of the International Space Station is to provide a working laboratory in orbit for research in engineering, life sciences, and microgravity. Among the microgravity disciplines that are preparing to utilize this international resource are materials processing, combustion, fluid dynamics, biotechnology, and fundamental physics. The Station promises to enable significant advances in each of these areas by making available a research facility in which gravitational and other accelerations, and their corresponding buoyancy and diffusion effects on various physical processes, are orders of magnitude lower than they are on Earth. In order to fulfill this promise, it is not enough for the Space Station to simply replicate a typical terrestrial scientific laboratory in orbit. Although an orbiting laboratory is free of most of the effects of gravitational acceleration by virtue of its free fall condition, it also produces structural vibration or jitter that can interfere with the processes under study. To ensure the quality of the acceleration environment and enable a successful mission, the Space Station Program has limited potential disturbances in two ways: first, by isolating the most sensitive payloads from the vehicle structure, and second, by quieting major disturbances at their sources. The first area, payload isolation, is implemented inside the pressurized modules at the rack level. Sub-rack level isolators have also been developed. This paper addresses the second area, disturbance source limits, for one of the major sources of mechanical noise on the Space Station: the Solar Alpha Rotary Joints. Due to the potential for large disturbances to the microgravity environment, an initial analytical prediction of rotary joint vibration output was made. Key components were identified and tested to validate the analytical predictions. Based on the component test results, the final vibration output of the joints was verified by a test on each fully assembled flight unit. This paper describes the Space Station microgravity requirements, the rotary joint hardware, and the disturbance producing aspects of joint operation. The test setup, instrumentation, test conditions, and results for the component level and system level measurements are described. An overall forcing function that describes the maximum torque imparted to the Station is created based on the test results, and these disturbances are shown to meet the applicable Space Station microgravity requirements.

Boucher, Robert L.↗

The faintest stars - From Schmidt plates to luminosity functions

We describe the construction of a photometric catalog from scans of IIIaF and IVN plate material in 11 fields of the UKSRC and POSSII surveys. The procedures used and quality checks applied are described in detail, and should be considered as illustrative for those planning scientific programs with the forthcoming scans of these surveys. We find our plate material is complete to I of about 18 and R of about 20.5 with photometric uncertainties of +/- 0.20 and +/- 0.25 magnitudes (respectively) at those limits. These data are used to construct luminosity functions for stars within 150 pc of the sun in four distinct directions. We find no significant evidence for variations in the form of the luminosity function in different locations within the Galactic disk. Approximately 10-20 percent variations are seen in the normalization of the luminosity function.

Tinney, C. G.↗

Computational models of direct and indirect X‐ray breast imaging detectors for in silico trials

Abstract Background To facilitate in silico studies that investigate digital mammography (DM) and breast tomosynthesis (DBT), models replicating the variety in imaging performance of the DM and DBT systems, observed across manufacturers are needed. Purpose The main purpose of this work is to develop generic physics models for direct and indirect detector technology used in commercially available systems, with the goal of making them available open source to manufacturers to further tweak and develop the exact in silico replicas of their systems. Methods We recently reported on an in silico version of the SIEMENS Mammomat Inspiration DM/DBT system using an open‐source GPU‐accelerated Monte Carlo x‐ray imaging simulation code (MC‐GPU). We build on the previous version of the MC‐GPU codes to mimic the imaging performances of two other Food and Drug Administration (FDA)‐approved DM/DBT systems, such as Hologic Selenia Dimensions (HSD) and the General Electric Senographe Pristina (GSP) systems. In this work, we developed a hybrid technique to model the optical spread and signal crosstalk observed in the GSP and HSD systems. MC simulations are used to track each x‐ray photon till its first interaction within the x‐ray detector. On the other hand, the signal spread in the x‐ray detectors is modeled using previously developed analytical equations. This approach allows us to preserve the modeling accuracy offered by MC methods in the patient body, while speeding up secondary carrier transport (either electron–hole pairs or optical photons) using analytical equations in the detector. The analytical optical spread model for the indirect detector includes the depth‐dependent spread and collection of optical photons and relies on a pre‐computed set of point response functions that describe the optical spread as a function of depth. To understand the capabilities of the computational x‐ray detector models, we compared image quality metrics like modulation transfer function (MTF), normalized noise power spectrum (NNPS), and detective quantum efficiency (DQE), simulated with our models against measured data. Please note that the purpose of these comparisons with measured data would be to gauge if the model developed as part of this work could replicate commercially used direct and indirect technology in general and not to achieve perfect fits with measured data. Results We found that the simulated image quality metrics such as MTF, NNPS, and DQE were in reasonable agreement with experimental data. To demonstrate the imaging performance of the three DM/DBT systems, we integrated the detector models with the VICTRE pipeline and simulated DM images of a fatty breast model containing a spiculated mass and a calcium oxalate cluster. In general, we found that the images generated using the indirect model appeared more blurred with a different noise texture and contrast as compared to the systems with direct detectors. Conclusions We have presented computational models of three commercially available FDA‐approved DM/DBT systems, which implement both direct and indirect detector technology. The updated versions of the MC‐GPU codes that can be used to replicate three systems are available in open source format through GitHub.

Sengupta, Aunnasha↗

Results from 1984 airborne Doppler lidar wind measurements

Observations made with the revised Airborne Doppler Lidar System (ADLS) during research flights in the summer of 1984 are described. The functioning of the ADLS system is described. The research flights measured the flow around Mt. Shasta about 3 km above the surrounding terrain as well as the flow in the area of the Carquenez Strait in the Sacramento River Valley. The flight tracks are described and the resulting scan radial velocities are shown and discussed. The results demonstrate the success of the modifications made in order to correct major error sources present in the 1981 flights of the ADLS system.

Rothermel, Jeffry↗

Computing Proximity to Threat Along Uncertain Trajectory to Support Urban Air Mobility

Many airspace threats affect the selection of a flight route, such as terrain, physical obstacles, adverse weather, and special-use airspace, among others. Threat avoidance during Urban Air Mobility (UAM) and Low Altitude Mobility (LAM) flights is especially challenging due to their lower cruising altitudes. These operations may be exposed to buildings, towers, trees, terrain undulations, etc., along much of their flight route. Moreover, these low-altitude flights in urban environments are expected to encounter very busy airspace, increasing the workload associated with threat avoidance. The Proximity to Threat (PtT) function aims to support onboard or remote pilots by computing the risk from geospatial threats in the airspace along an aircraft’s flight path. The threats are both static entities and dynamic airspace restrictions that have been modeled and stored in geo-referenced mapping databases. The flight path may be specified by waypoints, airways, or similar discrete route elements or by a time series of closely spaced position and altitude points. Flight path uncertainty can also be taken into account by assuming both the position and altitude to be sampled from two normal distributions, each being specified by a mean and variance. PtT uses this additional information to verify that the flight path remains clear of threats along a wider path or if a position is reached earlier or later than anticipated, assuring the pilot or operator that there will be an available safety margin even if the aircraft deviates due to one or more occurrences of unexpected wind gusts, mechanical failures, airspeed changes, collision avoidance maneuvers, etc. The client can specify an uncertainty confidence level to bound the set of trajectories evaluated for threats so that the confidence level corresponds to the client’s risk tolerance under the expected conditions. PtT can be used as a pre-flight planning tool to determine a safe route through known threats and in-flight to avoid emerging or changing threats. In this report, we present the PtT function, discuss how the trajectory uncertainty is incorporated into the PtT function, and describe the use of this PtT function in a representative scenario.

urban air mobility↗