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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 217 records · Page 12
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Molecular-Level Insights into the NMR Relaxivity of Gadobutrol Using Quantum and Classical Molecular Simulations

MRI is an indispensable diagnostic tool in modern medicine; however, understanding the molecular-level processes governing NMR relaxation of water in the presence of MRI contrast agents remains a challenge, hindering the molecular-guided development of more effective contrast agents. By using quantum-based polarizable force fields, the first-of-its-kind molecular dynamics (MD) simulations of Gadobutrol are reported where the 1 H NMR longitudinal relaxivity r 1 of the aqueous phase is determined without any adjustable parameters. The MD simulations of r 1 dispersion (i.e., frequency dependence) show good agreement with measurements at frequencies of interest in clinical MRI. Importantly, the simulations reveal key insights into the molecular level processes leading to r 1 dispersion by decomposing the NMR dipole–dipole autocorrelation function G(t) into a discrete set of molecular modes, analogous to the eigenmodes of a quantum harmonic oscillator. The molecular modes reveal important aspects of the underlying mechanisms governing r 1 , such as its multiexponential nature and the importance of the second eigenmodal decay. By simply analyzing the MD trajectories on a parameter-free approach, the Gadobutrol simulations show that the outer-shell water contributes ∼50% of the total relaxivity r 1 compared to the inner-shell water, in contrast to simulations of (nonchelated) gadolinium-aqua where the outer shell contributes only ∼15% of r 1 . The deviation between simulations and measurements of r 1 below clinical MRI frequencies is used to determine the low-frequency electron-spin relaxation time for Gadobutrol, in good agreement with independent studies.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1977

Monte Carlo turbulence simulation

The paper describes turbulence simulation experiments based on the principles of control system theory, that is, the construction of a system characterized by a system function such that upon exciting the system with prescribed noise processes the output of the system is a realization of a random processing the desired statistical attributes of turbulence. An experimental autocorrelation of Jimsphere measurements of wind velocity was approximated to simulate turbulent wind. From the approximate autocorrelation function, the required system function is obtained, and a discrete time system is designed. Another method of simulation is to solve the convolution integral by filter techniques. Other methods include discrete Fourier simulation and self-similar simulation.

Fichtl, G. H.↗
NASA NTRS1980

An experimental distributed microprocessor implementation with a shared memory communications and control medium

The distributed processing concept is defined in terms of control primitives, variables, and structures and their use in performing a decomposed discrete Fourier transform (DET) application function. The design assumes interprocessor communications to be anonymous. In this scheme, all processors can access an entire common database by employing control primitives. Access to selected areas within the common database is random, enforced by a hardware lock, and determined by task and subtask pointers. This enables the number of processors to be varied in the configuration without any modifications to the control structure. Decompositional elements of the DFT application function in terms of tasks and subtasks are also described. The experimental hardware configuration consists of IMSAI 8080 chassis which are independent, 8 bit microcomputer units. These chassis are linked together to form a multiple processing system by means of a shared memory facility. This facility consists of hardware which provides a bus structure to enable up to six microcomputers to be interconnected. It provides polling and arbitration logic so that only one processor has access to shared memory at any one time.

Mejzak, R. S.↗
NASA NTRS1982

An improved switching converter model

The nonlinear modeling and analysis of dc-dc converters in the continuous mode and discontinuous mode was done by averaging and discrete sampling techniques. A model was developed by combining these two techniques. This model, the discrete average model, accurately predicts the envelope of the output voltage and is easy to implement in circuit and state variable forms. The proposed model is shown to be dependent on the type of duty cycle control. The proper selection of the power stage model, between average and discrete average, is largely a function of the error processor in the feedback loop. The accuracy of the measurement data taken by a conventional technique is affected by the conditions at which the data is collected.

Shortt, D. J.↗
NASA NTRS1986

Numerical simulation of boundary layers. Part 1: Weak formulation and numerical method

A numerical method designed to solve the time-dependent, three-dimensional, incompressible Navier-Stokes equations in boundary layers is presented. The fluid domain is the half-space over a flat plate, and periodic conditions are applied in the horizontal directions. The discretization is spectral. The basis functions are divergence-free and a weak formulation of the momentum equation is used, which eliminates the pressure term. An exponential mapping and Jacobi polynomials are used in the semi-infinite direction, with the irrotational component receiving special treatment. Issues related to the accuracy, stability and efficiency of the method are discussed. Very fast convergence is demonstrated on some model problems with smooth solutions. The method has also been shown to accurately resolve the fine scales of transitional and turbulent boundary layers.

Spalart, P. R.↗
NASA NTRS1991

The zeroes of controlled structures - Sensor/actuator attributes and structural modelling

The effects of sensor/actuator design and modeling decisions on the zero frequencies of single input single output structural systems are explored. A zero definition based on the high gain closed loop character of the poles of a system is used to study parametrically zeroes as a function of sensor and actuator location. An infinite order model is adopted so that the effects of finite order modeling are removed. Examples focus on point or localized actuators and sensors and simple uniform structures. The sensitivity of the zero frequencies to changes in the sensor and actuator location for both collocated and non-collocated cases are presented. Non-minimum phase behavior is visible in only certain non-collocated situations. In addition to the sensor/actuator attributes, the zeroes are shown to be a function of the truncation and discretization used to model the structural response for collocated and dual systems. Methods for improving the zero predictions in the control bandwidth are suggested.

Fleming, Farla M.↗
NASA NTRS2002

Simulation of the National Aerospace System for Safety Analysis

Work started on this project on January 1, 1999, the first year of the grant. Following the outline of the grant proposal, a simulator architecture has been established which can incorporate the variety of types of models needed to accurately simulate national airspace dynamics. For the sake of efficiency, this architecture was based on an established single-aircraft flight simulator, the Reconfigurable Flight Simulator (RFS), already developed at Georgia Tech. Likewise, in the first year substantive changes and additions were made to the RFS to convert it into a simulation of the National Airspace System, with the flexibility to incorporate many types of models: aircraft models; controller models; airspace configuration generators; discrete event generators; embedded statistical functions; and display and data outputs. The architecture has been developed with the capability to accept any models of these types; due to its object-oriented structure, individual simulator components can be added and removed during run-time, and can be compiled separately. Simulation objects from other projects should be easy to convert to meet architecture requirements, with the intent that both this project may now be able to incorporate established simulation components from other projects, and that other projects may easily use this simulation without significant time investment.

Pritchett, Amy↗
NASA NTRS2004

Petri Nets as Modeling Tool for Emergent Agents

Emergent agents, those agents whose local interactions can cause unexpected global results, require a method of modeling that is both dynamic and structured Petri Nets, a modeling tool developed for dynamic discrete event system of mainly functional agents, provide this, and have the benefit of being an established tool. We present here the details of the modeling method here and discuss how to implement its use for modeling agent-based systems. Petri Nets have been used extensively in the modeling of functional agents, those agents who have defined purposes and whose actions should result in a know outcome. However, emergent agents, those agents who have a defined structure but whose interaction causes outcomes that are unpredictable, have not yet found a modeling style that suits them. A problem with formally modeling emergent agents that any formal modeling style usually expects to show the results of a problem and the results of problems studied using emergent agents are not apparent from the initial construction. However, the study of emergent agents still requires a method to analyze the agents themselves, and have sensible conversation about the differences and similarities between types of emergent agents. We attempt to correct this problem by applying Petri Nets to the characterization of emergent agents. In doing so, the emergent properties of these agents can be highlighted, and conversation about the nature and compatibility of the differing methods of agent creation can begin.

Bergman, Marto↗
NASA NTRS2014

Modular Pulsed Plasma Electric Propulsion System for Cubesats

Current capabilities of CubeSats must be improved in order to perform more ambitious missions. Electric propulsion systems will play a key role due to their large specific impulse. Compared to other propulsion alternatives, their simplicity allows an easier miniaturization and manufacturing of autonomous modules into the nano and pico-satellite platform. Pulsed Plasma Thrusters (PPTs) appear as one of the most promising technologies for the near term. The utilization of solid and non-volatile propellants, their low power requirements and their proven reliability in the large scale make them great candidates for rapid implementation. The main challenges are the integration and miniaturization of all the electronic circuitry into a printed circuit board (PCB) that can satisfy the strict requirements that CubeSats present. NASA Ames and the George Washington University have demonstrated functionality and control of three discrete Micro-Cathode Arc Thrusters (CAT) using a bench top configuration that was compatible with the ARC PhoneSat Bus. This demonstration was successfully conducted in a vaccum chamber at the ARC Environmental Test Laboratory. A new effort will integrate a low power Plasma Processing Unit and two plasma thrusters onto a single printed circuit board that will utilize less than 13 U of Bus volume. The target design will be optimized for the accommodation into the PhoneSatEDISON Demonstration of SmallSatellite Networks (EDSN) bus as it uses the same software interface application, which was demonstrated in the previous task. This paper describes the design, integration and architecture of the proposed propulsion subsystem for a planned Technology Demonstration Mission. In addition, a general review of the Pulsed Plasma technology available for CubeSats is presented in order to assess the necessary challenges to overcome further development.

PCB↗
NASA NTRS2010

Probabilistic Round Trip Contamination Analysis of a Mars Sample Acquisition and Handling Process Using Markovian Decompositions

A method for evaluating the probability of a Viable Earth Microorganism (VEM) contaminating a sample during the sample acquisition and handling (SAH) process of a potential future Mars Sample Return mission is developed. A scenario where multiple core samples would be acquired using a rotary percussive coring tool, deployed from an arm on a MER class rover is analyzed. The analysis is conducted in a structured way by decomposing sample acquisition and handling process into a series of discrete time steps, and breaking the physical system into a set of relevant components. At each discrete time step, two key functions are defined: The probability of a VEM being released from each component, and the transport matrix, which represents the probability of VEM transport from one component to another. By defining the expected the number of VEMs on each component at the start of the sampling process, these decompositions allow the expected number of VEMs on each component at each sampling step to be represented as a Markov chain. This formalism provides a rigorous mathematical framework in which to analyze the probability of a VEM entering the sample chain, as well as making the analysis tractable by breaking the process down into small analyzable steps.

Hudson, Nicolas↗
NASA NTRS2016

Electron Energization and Structure of the Diffusion Region During Asymmetric Reconnection

Results from particle-in-cell simulations of reconnection with asymmetric upstream conditions are reported to elucidate electron energization and structure of the electron diffusion region (EDR). Acceleration of unmagnetized electrons results in discrete structures in the distribution functions and supports the intense current and perpendicular heating in the EDR. The accelerated electrons are cyclotron turned by the reconnected magnetic field to produce the outflow jets, and as such, the acceleration by the reconnection electric field is limited, leading to resistivity without particle-particle or particle-wave collisions. A map of electron distributions is constructed, and its spatial evolution is compared with quantities previously proposed to be EDR identifiers to enable effective identifications of the EDR in terrestrial magnetopause reconnection.

magnetic reconnection↗
NASA NTRS2018

Active and Passive Radiative Transfer Modeling of the Olympic Mountains Experiment

Sensor forward models are an important tool for interpreting remote sensing observations of geophysical phenomena. By implementing a three-dimensional framework, we can simulate and analyze observations from various sensors on disparate platforms. To demonstrate our model framework, we simulate observations from the Olympic Mountains Experiment (OLYMPEX). The use of cloud model simulations allows us to understand sensor response to cloud ice, falling snow, and other processes and features, and the application of model tools to observations allows us to quantify precipitation.MIIST 3D Forward ModelThe Multi-Instrument Inverse Solver Testbed(MIIST) uses the Atmospheric Radiative TransferSimulator (ARTS) for solving the vector radiativetransfer (RT) equation in up to three spatialdimensions within a spherical geometry• Gas absorptiono Line-by-line calculationso Fast transmittance tables• Hydrometeor scattering solverso Discrete ordinateo RT4 (Evans, 1D)o Radar Single Scattering (1D or 3D)o Monte Carlo (3D)Scattering TablesHigh-fidelity hydrometeor scatteringtables are necessary for accurateand consistent forward modeling ofmulti-frequency observations• Requires full Stokes matriceso And absorption vector• Randomly oriented particleso Discrete Dipole Approximationo Characteristic Basis Function Method(coming soon)• Horizontally-oriented plateso Invariant Imbedding T-matrix MethodCloud Resolving SimulationsCloud resolving simulations (e.g.,NU-WRF) supply output consistentwith ARTS needs• Atmospheric Informationo Temperatureo Pressure / heighto Water vapor• Hydrometeor Profileso ARTS architecture ripe for explicit binmicrophysics• Examples use Morrison 2M schemeThe Olympic Mountains Experiment (OLYMPEX)Validation for GPM of mid-latitudefrontal systems approaching nearcoastalmountains from the ocean• Large collection of ground-based andairborne sensorso Radarso Radiometerso In situ• Contemporaneous with RADEXo Two sets of radar at same frequenciesRadiometer Simulation (3 km NUWRF, 20151203, 15:00)2018.12.14 7Simulate 166 GHz polarizationdifference• Corresponds to the presence of aligned icecrystals• Look at trends for both simulations andobservations• Simulations can tolerate lower resolutiono Larger domainSimulations from Observations: OLYMPEXSimulate sensor response usinggeophysical retrievals as input• Single frequency radar retrievals• Multiple scattering enhancementapparent at W band• Spatially dependent phenomenonModeling Application: 1D Retrievals03 December 2015• DC-8 and ER-2 flightso Focus on APR-3 (DC-8)• Citationo Stacked microphysics legso Qualitative comparisonso Range of frozen habitso Presence of supercooledliquid cloudsResults• Retrievals match probeso Good qualitative match• Bands of increasedreflectivity correspond tolarge Dm and highaggregate fraction• Significant amounts ofsupercooled liquid water

Adams, Ian S.↗
NASA NTRS2021

A Field-Particle Correlation Analysis of a Perpendicular Magnetized Collisionless Shock

Using the field-particle correlation technique, we examine the particle energization in a 1D-2V continuum Vlasov-Maxwell simulation of a perpendicular magnetized collisionless shock. The combination of the field-particle correlation technique with the high fidelity representation of the particle distribution function provided by a direct discretization of the Vlasov equation allows us to ascertain the details of the exchange of energy between the electromagnetic fields and the particles in phase space. We identify the velocity-space signatures of shock-drift acceleration of the ions and adiabatic heating of the electrons due to the perpendicular collisionless shock by constructing a simplified model with the minimum ingredients necessary to produce the observed energization signatures in the self-consistent Vlasov-Maxwell simulation. We are thus able to completely characterize the energy transfer in the perpendicular collisionless shock considered here and provide predictions for the application of the field-particle correlation technique to spacecraft measurements of collisionless shocks.

James Juno↗
NASA NTRS1982

Systematic generation of nonlinear discretized dynamic equilibrium equations of spinning cantilevers

General nonlinear discretized governing equations of motion of spinning elastic solids and structures are adjusted for the case of a spinning cantilever with initial geometric imperfections. Consideration is given to second degree nonlinearities in the strain-displacement and velocity-displacement relationships. Parameters of the discretization are developed to include the type and number of the coordinate functions used in the admissible trial solution in order to unify the discretization approaches associated with stationarity principles. The coordinate functions comprise both sets of continuous and piecewise continuous functions employed in the Rayleigh-Ritz and the finite element methods, respectively. Coefficient matrices are provided which contain the energy density expressions and which are adaptable to computer programming.

El-Essawi, M.↗
NASA NTRS2017

Curved Displacement Transfer Functions for Geometric Nonlinear Large Deformation Structure Shape Predictions

For shape predictions of structures under large geometrically nonlinear deformations, Curved Displacement Transfer Functions were formulated based on a curved displacement, traced by a material point from the undeformed position to deformed position. The embedded beam (depth-wise cross section of a structure along a surface strain-sensing line) was discretized into multiple small domains, with domain junctures matching the strain-sensing stations. Thus, the surface strain distribution could be described with a piecewise linear or a piecewise nonlinear function. The discretization approach enabled piecewise integrations of the embedded-beam curvature equations to yield the Curved Displacement Transfer Functions, expressed in terms of embedded beam geometrical parameters and surface strains. By entering the surface strain data into the Displacement Transfer Functions, deflections along each embedded beam can be calculated at multiple points for mapping the overall structural deformed shapes. Finite-element linear and nonlinear analyses of a tapered cantilever tubular beam were performed to generate linear and nonlinear surface strains and the associated deflections to be used for validation. The shape prediction accuracies were then determined by comparing the theoretical deflections with the finiteelement- generated deflections. The results show that the newly developed Curved Displacement Transfer Functions are very accurate for shape predictions of structures under large geometrically nonlinear deformations.

displacement theory↗
NASA NTRS2018

Curvilinear Displacement Transfer Functions for Deformed Shape Predictions of Curved Structures Using Distributed Surface Strains

Curvilinear Displacement Transfer Functions were formulated for deformed shape predictions of different curved structures using surface strains. The embedded curved beam (depth-wise cross section of a curved structure along a surface strain-sensing line) was discretized into multiple small domains, with domain junctures matching the strain-sensing stations. Thus, the surface strain distribution can be described with a piecewise linear or a piecewise nonlinear function. The discrete approach enabled piecewise integrations of a curvature-strain differential equation for the embedded curved beam to yield closed-form Curvilinear Displacement Transfer Functions, which are written in terms of embedded curved-beam geometrical parameters and surface strains. By inputting the surface strain data, the Curvilinear Displacement Transfer Functions can transform surface strains into deflections along each embedded curved beam for mapping out the overall structural deformed shapes. The finite-element method was used to analytically generate the surface strains of the curved beams. The deformed shape prediction accuracies were then determined by comparing the theoretical deflections with the finite-element-generated deflections, which were used as yardsticks. By introducing the correction factors in simple mathematical forms, the Curvilinear Displacement Transfer Functions can be quite accurate for shape predictions of different curved-beam structures ranging from limit case of straight beam up to semicircular curved beam.

Ko, William L.↗
NASA NTRS1994

Accurate interlaminar stress recovery from finite element analysis

The accuracy and robustness of a two-dimensional smoothing methodology is examined for the problem of recovering accurate interlaminar shear stress distributions in laminated composite and sandwich plates. The smoothing methodology is based on a variational formulation which combines discrete least-squares and penalty-constraint functionals in a single variational form. The smoothing analysis utilizes optimal strains computed at discrete locations in a finite element analysis. These discrete strain data are smoothed with a smoothing element discretization, producing superior accuracy strains and their first gradients. The approach enables the resulting smooth strain field to be practically C1-continuous throughout the domain of smoothing, exhibiting superconvergent properties of the smoothed quantity. The continuous strain gradients are also obtained directly from the solution. The recovered strain gradients are subsequently employed in the integration o equilibrium equations to obtain accurate interlaminar shear stresses. The problem is a simply-supported rectangular plate under a doubly sinusoidal load. The problem has an exact analytic solution which serves as a measure of goodness of the recovered interlaminar shear stresses. The method has the versatility of being applicable to the analysis of rather general and complex structures built of distinct components and materials, such as found in aircraft design. For these types of structures, the smoothing is achieved with 'patches', each patch covering the domain in which the smoothed quantity is physically continuous.

Tessler, Alexander↗