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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 235 records · Page 13

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NASA NTRS1987

Automating the parallel processing of fluid and structural dynamics calculations

The NASA Lewis Research Center is actively involved in the development of expert system technology to assist users in applying parallel processing to computational fluid and structural dynamic analysis. The goal of this effort is to eliminate the necessity for the physical scientist to become a computer scientist in order to effectively use the computer as a research tool. Programming and operating software utilities have previously been developed to solve systems of ordinary nonlinear differential equations on parallel scalar processors. Current efforts are aimed at extending these capabilties to systems of partial differential equations, that describe the complex behavior of fluids and structures within aerospace propulsion systems. This paper presents some important considerations in the redesign, in particular, the need for algorithms and software utilities that can automatically identify data flow patterns in the application program and partition and allocate calculations to the parallel processors. A library-oriented multiprocessing concept for integrating the hardware and software functions is described.

Arpasi, Dale J.↗

NASA NTRS1988

Nonconforming mortar element methods: Application to spectral discretizations

Spectral element methods are p-type weighted residual techniques for partial differential equations that combine the generality of finite element methods with the accuracy of spectral methods. Presented here is a new nonconforming discretization which greatly improves the flexibility of the spectral element approach as regards automatic mesh generation and non-propagating local mesh refinement. The method is based on the introduction of an auxiliary mortar trace space, and constitutes a new approach to discretization-driven domain decomposition characterized by a clean decoupling of the local, structure-preserving residual evaluations and the transmission of boundary and continuity conditions. The flexibility of the mortar method is illustrated by several nonconforming adaptive Navier-Stokes calculations in complex geometry.

Maday, Yvon↗

NASA NTRS1989

Systematic generation of multibody equations of motion suitable for recursive and parallel manipulation

The formulation of a method known as the joint coordinate method for automatic generation of the equations of motion for multibody systems is summarized. For systems containing open or closed kinematic loops, the equations of motion can be reduced systematically to a minimum number of second order differential equations. The application of recursive and nonrecursive algorithms to this formulation, computational considerations and the feasibility of implementing this formulation on multiprocessor computers are discussed.

Nikravesh, Parviz E.↗

NASA NTRS2000

High-Speed Research Surveillance Symbology Assessment Experiment

Ten pilots flew multiple approach and departure scenarios in a simulation experiment of the High-Speed Civil Transport to evaluate the utility of different airborne surveillance display concepts. The primary eXternal Visibility System (XVS) display and the Navigation Display (ND) were used to present tactical and strategic surveillance information, respectively, to the pilot. Three sensors, the Traffic Alert and Collision Avoidance System, radar, and the Automatic Dependent Surveillance-Broadcast system, were modeled for this simulation and the sensors surveillance information was presented in two different symbology sets to the pilot. One surveillance symbology set used unique symbol shapes to differentiate among the sensors, while the other set used common symbol shapes for the sensors. Surveillance information in the form of escape guidance from threatening traffic was also presented to the pilots. The surveillance information (sensors and escape guidance) was either presented head-up on the primary XVS display and head-down on the ND or head-down on the ND only. Both objective and subjective results demonstrated that the display concepts having surveillance information presented head-up and head-down have surveillance performance benefits over those concepts having surveillance information displayed head-down only. No significant symbology set differences were found for surveillance task performance.

Kramer, Lynda J.↗

DOE OSTI2025

Cartesian equivariant representations for learning and understanding molecular orbitals

Qualitative and quantitative orbital properties such as bonding/antibonding character, localization, and orbital energies are critical to how chemists understand reactivity, catalysis, and excited-state behavior. Despite this, representations of orbitals in deep learning models have been very underdeveloped relative to representations of molecular geometries and Hamiltonians. Here, we apply state-of-the-art equivariant deep learning architectures to the task of assigning global labels to orbitals, namely energies characterizations, given the molecular coefficients from Hartree–Fock or density functional theory. The architecture we have developed, the Cartesian Equivariant Orbital Network (CEONET), shows how molecular orbital coefficients are readily featurized as equivariant node features common to all graph-based machine-learned potentials. We find that CEONET performs well at predicting difficult quantitative labels such as the orbital energy and orbital entropy. Furthermore, we find that the CEONET representation provides an intuitive latent space for differentiating orbital character for the qualitative assignment of e.g. bonding or antibonding character. In addition to providing a useful representation for further integrating deep learning with electronic structure theory, we expect CEONET to be useful for automatizing and interpreting the results of advanced electronic structure methods such as complete active space self-consistent field theory. In particular, the ability of CEONET to infer multireference character via the orbital entropy paves the way toward the machine-learned selection of active spaces.

chemical reactions↗

DOE OSTI2026

Data and scripts associated with a manuscript modeling microbial regulation of priming effects

This data package is associated with the publication “Modeling Microbial Regulatory Feedback in Organic Matter Decomposition Identifies Copiotrophic Traits as Key Drivers of Positive Priming” published as a preprint on BioRXiv by Ahamed et al. (2026); https://doi.org/10.1101/2024.08.11.607483. The package contains MATLAB scripts and saved simulation outputs used to implement a cybernetic model of microbial regulation during complex organic matter (OM) decomposition governing priming effects. It includes models of (i) single microbial functional groups (copiotrophic or oligotrophic degraders) and (ii) binary consortia composed of degraders and non-degraders with contrasting or common growth traits. Simulation results were generated using Monte Carlo analyses, with randomized key model parameters across a range of environmental mixing fractions of complex and labile OM. The dataset was created to provide a transparent and reusable computational framework for systematically exploring how microbial growth traits, metabolic regulation, and community composition influence OM decomposition dynamics and priming effects. For details on how to navigate data packages generated by this project, see https://data.ess-dive.lbl.gov/portals/PNNLRiverCorridorSFA/About. In addition to a readme, this data package also includes a file-level metadata (FLMD) file that describes each file and a data dictionary (DD) that describes the variable definitions. This package includes: (1) annotated MATLAB code implementing the system of ordinary differential equations and cybernetic control laws; (2) saved output files containing data (e.g., biomass, substrates, enzyme levels, priming metrics); and (3) scripts for processing saved outputs and regenerating figures. Specifically, the data package contains three main MATLAB scripts: runPrimingModel.m, runPlotData.m, and runPlotSuppFigS1.m, along with this readme and supporting documentation. Users should begin with runPrimingModel.m, which contains the annotated code implementing the system of ordinary differential equations and cybernetic control laws. This script runs the Monte Carlo simulations of microbial OM decomposition and allows users to modify microbial trait definitions, adjust parameter distributions, or define new community configurations. Simulation outputs are automatically saved as .mat files in the folder named SavedData, which stores all pre-generated results included in this package. The second script, runPlotData.m, reads files from the SavedData folder and processes them to regenerate the figures presented in the manuscript. The third script, runPlotSuppFigS1.m, specifically generates Figure S1 in the Supplementary Material of the manuscript. The package also includes the aforementioned files in non-proprietary .txt format. If users intend to use them, they should first save the files in their respective .m or .mat formats prior to execution in MATLAB.

Biomass concentration↗

NASA NTRS1979

Measurement in multiphase reacting flows

A survey is presented of diagnostic techniques and measurements made in multiphase reacting flows. The special problems encountered by the presence of liquid droplets, soot and solid particles in high temperature chemically reacting turbulent environments are outlined. The principal measurement techniques that have been tested in spray flames are spark photography, laser anemometry, thermocouples and suction probes. Spark photography provides measurement of drop size, drop size distribution, drop velocity, and angle of flight. Photographs are analysed automatically by image analysers. Photographic techniques are reliable, inexpensive and proved. Laser anemometers have been developed for simultaneous measurement of velocity and size of individual particles in sprays under conditions of vaporization and combustion. Particle/gas velocity differentials, particle Reynolds numbers, local drag coefficients and direct measurement of vaporization rates can be made by laser anemometry. Gas temperature in sprays is determined by direct in situ measurement of time constants immediately prior to measurement with compensation and signal analysis by micro-processors. Gas concentration is measured by suction probes and gas phase chromatography. Measurements of particle size, particle velocity, gas temperature, and gas concentration made in airblast and pressure atomised liquid spray flames are presented.

Chigier, N. A.↗

NASA NTRS2011

Rapid Calculation of Spacecraft Trajectories Using Efficient Taylor Series Integration

A variable-order, variable-step Taylor series integration algorithm was implemented in NASA Glenn's SNAP (Spacecraft N-body Analysis Program) code. SNAP is a high-fidelity trajectory propagation program that can propagate the trajectory of a spacecraft about virtually any body in the solar system. The Taylor series algorithm's very high order accuracy and excellent stability properties lead to large reductions in computer time relative to the code's existing 8th order Runge-Kutta scheme. Head-to-head comparison on near-Earth, lunar, Mars, and Europa missions showed that Taylor series integration is 15.8 times faster than Runge- Kutta on average, and is more accurate. These speedups were obtained for calculations involving central body, other body, thrust, and drag forces. Similar speedups have been obtained for calculations that include J2 spherical harmonic for central body gravitation. The algorithm includes a step size selection method that directly calculates the step size and never requires a repeat step. High-order Taylor series integration algorithms have been shown to provide major reductions in computer time over conventional integration methods in numerous scientific applications. The objective here was to directly implement Taylor series integration in an existing trajectory analysis code and demonstrate that large reductions in computer time (order of magnitude) could be achieved while simultaneously maintaining high accuracy. This software greatly accelerates the calculation of spacecraft trajectories. At each time level, the spacecraft position, velocity, and mass are expanded in a high-order Taylor series whose coefficients are obtained through efficient differentiation arithmetic. This makes it possible to take very large time steps at minimal cost, resulting in large savings in computer time. The Taylor series algorithm is implemented primarily through three subroutines: (1) a driver routine that automatically introduces auxiliary variables and sets up initial conditions and integrates; (2) a routine that calculates system reduced derivatives using recurrence relations for quotients and products; and (3) a routine that determines the step size and sums the series. The order of accuracy used in a trajectory calculation is arbitrary and can be set by the user. The algorithm directly calculates the motion of other planetary bodies and does not require ephemeris files (except to start the calculation). The code also runs with Taylor series and Runge-Kutta used interchangeably for different phases of a mission.

Scott, James R.↗

NASA NTRS1980

Numerical solution of flow problems using body-fitted coordinate systems

The paper deals with numerically generated boundary-fitted coordinate systems. This procedure eliminates the shape of the boundaries as a complicating factor and allows the flow about arbitrary boundaries to be treated essentially as easily as that about simple boundaries. The technique of boundary-fitted coordinate systems is based on a method of automatic numerical generation of a general curvilinear coordinate system having a coordinate line coincident with each boundary of a general multiconnected region involving any number of arbitrarily shaped boundaries. Once the curvilinear coordinate system is generated, any partial differential system of interest may be solved on the coordinate system by transforming the equations and solving the resulting system in finite-difference approximation on the rectangular transformed plane. Attention is given to the types of boundary-fitted coordinate systems, coordinate system control, operation of the coordinate codes, solution of partial differential equations, application to free-surface flow, and other applications of interest.

Thompson, J. F.↗

NASA NTRS1985

Simulation study of an automatic trim system for reducing the control forces on a light twin after an engine failure

An automatic trim system for reducing the control forces after an engine failure on a light twin has been investigated on the Langley General Aviation Simulator. The system schedules open-loop trim tab deflections as a function of differential propeller slipstream dynamic pressure and freestream dynamic pressure. The system is described and the airplane-system static and dynamic characteristics are documented. Three NASA research pilots evaluated the effectiveness of the system for takeoff and landing maneuvers. A variety of off-nominal system characteristics were studied. The system was judged to be generally beneficial, providing a 2 to 3 point improvement in pilot rating for the tasks used in the evaluations.

Stewart, E. C.↗

NASA NTRS1986

Physical and numerical sources of computational inefficiency in integration of chemical kinetic rate equations: Etiology, treatment and prognosis

The design of a very fast, automatic black-box code for homogeneous, gas-phase chemical kinetics problems requires an understanding of the physical and numerical sources of computational inefficiency. Some major sources reviewed in this report are stiffness of the governing ordinary differential equations (ODE's) and its detection, choice of appropriate method (i.e., integration algorithm plus step-size control strategy), nonphysical initial conditions, and too frequent evaluation of thermochemical and kinetic properties. Specific techniques are recommended (and some advised against) for improving or overcoming the identified problem areas. It is argued that, because reactive species increase exponentially with time during induction, and all species exhibit asymptotic, exponential decay with time during equilibration, exponential-fitted integration algorithms are inherently more accurate for kinetics modeling than classical, polynomial-interpolant methods for the same computational work. But current codes using the exponential-fitted method lack the sophisticated stepsize-control logic of existing black-box ODE solver codes, such as EPISODE and LSODE. The ultimate chemical kinetics code does not exist yet, but the general characteristics of such a code are becoming apparent.

Pratt, D. T.↗

NASA NTRS1988

Interleaver design for trellis-coded differential 8-PSK modulation with non-coherent detection

The effect of finite interleaver size on bit error rate (BER) performance of coded 8-DPSK is determined by means of computer simulations. The losses evaluated in this way include the SNR degradation due to the timing and frequency errors of the symbol synchronizer and the automatic frequency control (AFC) of the receiver. BER measurements are presented using a conventional 2/3 rate convolutional 8-state trellis-code for typical Rayleigh and Rician fading channels. It is shown that for a Rician channel with a Rician parameter of 7 dB, a Doppler spread of 100 Hz and a data rate of 2400 bps, an interleaver with size 16 x 16 symbols performs nearly as well as a very large interleaver. It is also shown that for very fast Rayleigh channels, the BER-curves flatten out at large SNR.

Edbauer, Franz↗

NASA NTRS2001

Test Results for an Off-the-Shelf GPS/INS During Approach and Landing Testing of the X-40A

The X-37 is an unpiloted, reusable space vehicle that will be launched into space, orbit the Earth, reenter the atmosphere, and land autonomously. At the heart of the Guidance, Navigation and Control (GN&C) will be the Space Integrated GPS/INS (SIGI) system, an off the shelf navigation grade GPS/INS that has been enhanced for space and reentry environments. SIGI will provide both navigation and flight control data to the X-37's GN&C. The X-40A is an unpiloted experimental vehicle whose shape and performance are similar to the X-37's and was flown earlier this year to develop and test the approach and landing phase of X-37. On board the X-40A is the X-37's SIGI, which is riding along as an experiment. The X-40A SIGI experiment provided early characterization of SIGI operation and performance with differential GPS (Global Positioning System) during real world approach and landing. Characterization testing was geared toward assessment of reliability and performance of the system. The objectives were to demonstrate performance levels sufficient to meet the X-37 requirements for automatic, autonomous approach and landing, demonstrate reliability over repeated ground and flight tests, and reduce risk for integration of SIGI into the vehicle and support environment. This paper presents a summary of this testing and the results to date.

Childers, Dave↗

NASA NTRS1975

Use of numerically generated body-fitted coordinate systems for solution of the Navier-Stokes equations

A procedure for numerical solution of the time-dependent, two-dimensional incompressible Navier-Stokes equations that can treat the unsteady laminar flow about bodies of arbitrary shape, such as two-dimensional airfoils, multiple airfoils, and submerged hydrofoils, as naturally as it can deal with the flow about simple bodies. The solution is based on a method of automatic numerical generation of a general curvilinear coordinate system with coordinate lines coincident with all boundaries of a general multiconnected region containing any number of arbitrarily shaped bodies. The curvilinear coordinates are generated as the solution of two elliptical partial differential equations with Dirichlet boundary conditions, one coordinate being specified to be constant on each of the boundaries, and a distribution of the other being specified along the boundaries. The solution compares excellently with the Blasius boundary layer solution for the flow past a semiinfinite flat plate.

Thompson, J. F.↗

NASA NTRS1986

Fast algorithm for calculating chemical kinetics in turbulent reacting flow

This paper addresses the need for a fast batch chemistry solver to perform the kinetics part of a split operator formulation of turbulent reacting flows, with special attention focused on the solution of the ordinary differential equations governing a homogeneous gas-phase chemical reaction. For this purpose, a two-part predictor-corrector algorithm which incorporates an exponentially fitted trapezoidal method was developed. The algorithm performs filtering of ill-posed initial conditions, automatic step-size selection, and automatic selection of Jacobi-Newton or Newton-Raphson iteration for convergence to achieve maximum computational efficiency while observing a prescribed error tolerance. The new algorithm, termed CREK1D (combustion reaction kinetics, one-dimensional), compared favorably with the code LSODE when tested on two representative problems drawn from combustion kinetics, and is faster than LSODE.

Radhakrishnan, K.↗

NASA NTRS1995

A deterministic particle method for one-dimensional reaction-diffusion equations

We derive a deterministic particle method for the solution of nonlinear reaction-diffusion equations in one spatial dimension. This deterministic method is an analog of a Monte Carlo method for the solution of these problems that has been previously investigated by the author. The deterministic method leads to the consideration of a system of ordinary differential equations for the positions of suitably defined particles. We then consider the time explicit and implicit methods for this system of ordinary differential equations and we study a Picard and Newton iteration for the solution of the implicit system. Next we solve numerically this system and study the discretization error both analytically and numerically. Numerical computation shows that this deterministic method is automatically adaptive to large gradients in the solution.

Mascagni, Michael↗

NASA NTRS1974

LC-oscillator with automatic stabilized amplitude via bias current control

A stable excitation supply for measurement transducers is described. It consists of a single-transistor oscillator with a coil connected to the collector and a capacitor connected from the collector to the emitter. The output of the oscillator is rectified and the rectified signal acts as one input to a differential amplifier; the other input being a reference potential. The output of the amplifier is connected at a point between the emitter of the transistor and ground. When the rectified signal is greater than the reference signal, the differential amplifier produces a signal of polarity to reduce bias current and, consequently, amplification.

Hamlet, J. F.↗

NASA NTRS1979

Evaluating the reforested area for the municipality of Buri by automatic analysis of LANDSAT imagery

The author has identified the following significant results. The class of reforestation (Pinus, Eucalyptus, Araucaria) was defined using iterative image analysis (1-100) and LANDSAT MSS data. Estimates of class area by 1-100 were compared with data supplied by the forestry institute in Sao Paulo. LANDSAT channels 4 and 5 served to differentiate the Pinus, Eucalyptus, and Araucaria from the other trees. Channels 6 and 7 gave best results for differentiating between the classes. A good representative spectral response was obtained for Auraucaria on these two channels. The small relative differences obtained were +4.24% for Araucaria, -7.51% for Pinus, and -32.07% for Eucalyptus.

Dejesusparada, N.↗