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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 469 records · Page 26

Multipole correction of atomic monopole models of molecular charge distribution. I. Peptides

The defects in atomic monopole models of molecular charge distribution have been analyzed for several model-blocked peptides and compared with accurate quantum chemical values. The results indicate that the angular characteristics of the molecular electrostatic potential around functional groups capable of forming hydrogen bonds can be considerably distorted within various models relying upon isotropic atomic charges only. It is shown that these defects can be corrected by augmenting the atomic point charge models by cumulative atomic multipole moments (CAMMs). Alternatively, sets of off-center atomic point charges could be automatically derived from respective multipoles, providing approximately equivalent corrections. For the first time, correlated atomic multipoles have been calculated for N-acetyl, N'-methylamide-blocked derivatives of glycine, alanine, cysteine, threonine, leucine, lysine, and serine using the MP2 method. The role of the correlation effects in the peptide molecular charge distribution are discussed.

NASA Discipline Exobiology↗

Cometary atmospheres: Modeling the spatial distribution of observed neutral radicals

The analysis of observed brightness profiles for the C2 radical in comets with Haser's model implies that the parent scale length varies as the square of the heliocentric distance. The use of new Haser scale lengths for C2 and CN determined under this project appears to explain the apparent drop in the C2-to-CN ratio with increasing heliocentric distance.

Combi, M. R.↗

Cometary atmospheres: Modeling the spatial distribution of observed neutral radicals

An algorithm for the random walk problem of multiple elastic collisions between newly formed non-thermal neutral cometary radicals and the outflowing cometary molecules was incorporated into the Monte Carlo particle-trajectory model. Preliminary model analysis has shown that the effects of collision on the observed spatial distribution of cometary radicals becomes important for the larger bright comets, especially at smaller values of the helicocentric distance. The model and early results are discussed herein.

Combi, M. R.↗

The Rayleigh curve as a model for effort distribution over the life of medium scale software systems

It is noted that previous investigations into the applicability of Rayleigh curve model to medium scale software development efforts have met with mixed results. The results of these investigations are confirmed by analyses of runs and smoothing. The reasons for the models' failure are found in the subcycle effort data. There are four contributing factors: uniqueness of the environment studied, the influence of holidays, varying management techniques and differences in the data studied.

Picasso, G. O.↗

Modeling and control of distributed structures

An inherent incongruity in the modeling of controls for structures is discussed. Structures are basically distributed-parameter systems, described by partial differential equations, and control theory is concerned almost exclusively with discrete (in space) systems, described by ordinary differential equations. The standard approach to solving this dilemma is to discretize the system in space, which precludes the use of distributed controls. A different approach, known as the independent modal-space control method, is designed to eliminate the incongruity by bringing about a closer correspondence between modeling and control theory. The independent modal-space control method can treat distributed structures as well as discretized models and it permits design of both distributed and discrete-point controls.

Meirovitch, L.↗

Simulation of Vacuum Chamber Pressure Distribution with Surrogate Modeling and Uncertainty Quantification

A major challenge in understanding differences in electric propulsion performance in ground tests and in space operations concerns the pressure distribution within the test vacuum chamber. The chamber backpressure is much higher than experienced in space, modifying thruster performance and plume dynamics. Numerical simulation is a key element to determining the background conditions in non-ideal vacuum chamber environments. An important parameter for the accurate simulation of chamber backpressure is the probability that an atom will stick to a cryogenic panel used to pump away the plume gases. This quantity can be used to model vacuum pumps in particle-based kinetic numerical methods. In this work, a three-dimensional direct simulation Monte Carlo code is used to model neutral xenon atoms flowing from the anode of the H9 Hall Effect Thruster within the University of Michigan’s Large Vacuum Test Facility. Simulated pressures are compared with ion gauge pressure measurements to infer the effective sticking coefficient of the chamber’s vacuum pumps. A pressure predicting surrogate model is developed for inference of pump sticking coefficients and for uncertainty quantification. This information enables accurate and useful kinetic simulations of electric propulsion thruster plasma plumes in vacuum chambers.

DSMC↗

A Modular Framework for Modeling Hardware Elements in Distributed Engine Control Systems

Progress toward the implementation of distributed engine control in an aerospace application may be accelerated through the development of a hardware-in-the-loop (HIL) system for testing new control architectures and hardware outside of a physical test cell environment. One component required in an HIL simulation system is a high-fidelity model of the control platform: sensors, actuators, and the control law. The control system developed for the Commercial Modular Aero-Propulsion System Simulation 40k (C-MAPSS40k) provides a verifiable baseline for development of a model for simulating a distributed control architecture. This distributed controller model will contain enhanced hardware models, capturing the dynamics of the transducer and the effects of data processing, and a model of the controller network. A multilevel framework is presented that establishes three sets of interfaces in the control platform: communication with the engine (through sensors and actuators), communication between hardware and controller (over a network), and the physical connections within individual pieces of hardware. This introduces modularity at each level of the model, encouraging collaboration in the development and testing of various control schemes or hardware designs. At the hardware level, this modularity is leveraged through the creation of a Simulink(R) library containing blocks for constructing smart transducer models complying with the IEEE 1451 specification. These hardware models were incorporated in a distributed version of the baseline C-MAPSS40k controller and simulations were run to compare the performance of the two models. The overall tracking ability differed only due to quantization effects in the feedback measurements in the distributed controller. Additionally, it was also found that the added complexity of the smart transducer models did not prevent real-time operation of the distributed controller model, a requirement of an HIL system.

numerical simulation↗

A Modular Framework for Modeling Hardware Elements in Distributed Engine Control Systems

Progress toward the implementation of distributed engine control in an aerospace application may be accelerated through the development of a hardware-in-the-loop (HIL) system for testing new control architectures and hardware outside of a physical test cell environment. One component required in an HIL simulation system is a high-fidelity model of the control platform: sensors, actuators, and the control law. The control system developed for the Commercial Modular Aero-Propulsion System Simulation 40k (C-MAPSS40k) provides a verifiable baseline for development of a model for simulating a distributed control architecture. This distributed controller model will contain enhanced hardware models, capturing the dynamics of the transducer and the effects of data processing, and a model of the controller network. A multilevel framework is presented that establishes three sets of interfaces in the control platform: communication with the engine (through sensors and actuators), communication between hardware and controller (over a network), and the physical connections within individual pieces of hardware. This introduces modularity at each level of the model, encouraging collaboration in the development and testing of various control schemes or hardware designs. At the hardware level, this modularity is leveraged through the creation of a SimulinkR library containing blocks for constructing smart transducer models complying with the IEEE 1451 specification. These hardware models were incorporated in a distributed version of the baseline C-MAPSS40k controller and simulations were run to compare the performance of the two models. The overall tracking ability differed only due to quantization effects in the feedback measurements in the distributed controller. Additionally, it was also found that the added complexity of the smart transducer models did not prevent real-time operation of the distributed controller model, a requirement of an HIL system.

propulsion simulation↗

A Modular Framework for Modeling Hardware Elements in Distributed Engine Control Systems

Progress toward the implementation of distributed engine control in an aerospace application may be accelerated through the development of a hardware-in-the-loop (HIL) system for testing new control architectures and hardware outside of a physical test cell environment. One component required in an HIL simulation system is a high-fidelity model of the control platform: sensors, actuators, and the control law. The control system developed for the Commercial Modular Aero-Propulsion System Simulation 40k (40,000 pound force thrust) (C-MAPSS40k) provides a verifiable baseline for development of a model for simulating a distributed control architecture. This distributed controller model will contain enhanced hardware models, capturing the dynamics of the transducer and the effects of data processing, and a model of the controller network. A multilevel framework is presented that establishes three sets of interfaces in the control platform: communication with the engine (through sensors and actuators), communication between hardware and controller (over a network), and the physical connections within individual pieces of hardware. This introduces modularity at each level of the model, encouraging collaboration in the development and testing of various control schemes or hardware designs. At the hardware level, this modularity is leveraged through the creation of a Simulink (R) library containing blocks for constructing smart transducer models complying with the IEEE 1451 specification. These hardware models were incorporated in a distributed version of the baseline C-MAPSS40k controller and simulations were run to compare the performance of the two models. The overall tracking ability differed only due to quantization effects in the feedback measurements in the distributed controller. Additionally, it was also found that the added complexity of the smart transducer models did not prevent real-time operation of the distributed controller model, a requirement of an HIL system.

numerical simulation↗

A model for the distribution of material generating the soft X-ray background

The observational evidence relating to the soft X-ray diffuse background is discussed, and a simple model for its source and spatial structure is presented. In this simple model with one free parameter, the observed 1/4 keV X-ray intensity originates as thermal emission from a uniform hot plasma filling a cavity in the neutral material of the Galactic disk which contains the sun. Variations in the observed X-ray intensity are due to variations in the extent of the emission volume and therefore the emission measure of the plasma. The model reproduces the observed negative correlation between X-ray intensity and H I column density and predicts reasonable values for interstellar medium parameters.

Snowden, S. L.↗

Multiplicity distributions in interaction models used for cascade simulations

In cascade simulations, conservation of energy is of paramount importance. It is pointed out that it is possible to construct algorithms in which energies of secondaries are chosen from physically correct distributions in such a way as to conserve energy, and give physically correct multiplicity distributions without further adjustment. The resulting non-Poissonian nature of the distribution and the approximate KNO scaling are related to the large fluctuations in the energy available for pion production and to the detailed shape of the inclusive momentum distribution. Two multiparticle production algorithms are described which have these features. One is the algorithm used in the simulation of C jets, the other is for a hadron-nucleus interaction model used in the calculation of muon and neutrino fluxes.

Ellsworth, R. W.↗

Numerical experiments with a general circulation model concerning the distribution of ozone in the stratosphere

The distribution of ozone below 60 km altitude has been simulated in two experiments employing a nine-layer quasi-geostrophic spectral model and linear parameterization of ozone photochemistry, the first of which included thermal and orographic forcing of the planetary scale waves, while the second omitted it. The first experiment exhibited a high latitude winter ozone buildup which was due to a Brewer-Dodson circulation forced by large amplitude (planetary scale) waves in the winter lower stratosphere. Photochemistry was also found to be important down to lower altitudes (20 km) in the summer stratosphere than had previously been supposed.

Kurzeja, R. J.↗

Cometary atmospheres: Modeling the spatial distribution of observed neutral radicals

The dependencies on heliocentric velocity for the solar photodissociation lifetime and the solar fluorescence rate of the OH radical were incorporated into the Monte Carlo particle trajectory model for cometary radicals. For the case of CN a study was initiated on the effects of using several different adopted models on the calculation of production rates from filter photometry. Progress in these areas is discussed. A comparison of two different sets of scale length data for cometary C2 and CN is also presented.

Combi, M. R.↗

Sensitivity Analysis of the Bone Fracture Risk Model

Introduction: The probability of bone fracture during and after spaceflight is quantified to aid in mission planning, to determine required astronaut fitness standards and training requirements and to inform countermeasure research and design. Probability is quantified with a probabilistic modeling approach where distributions of model parameter values, instead of single deterministic values, capture the parameter variability within the astronaut population and fracture predictions are probability distributions with a mean value and an associated uncertainty. Because of this uncertainty, the model in its current state cannot discern an effect of countermeasures on fracture probability, for example between use and non-use of bisphosphonates or between spaceflight exercise performed with the Advanced Resistive Exercise Device (ARED) or on devices prior to installation of ARED on the International Space Station. This is thought to be due to the inability to measure key contributors to bone strength, for example, geometry and volumetric distributions of bone mass, with areal bone mineral density (BMD) measurement techniques. To further the applicability of model, we performed a parameter sensitivity study aimed at identifying those parameter uncertainties that most effect the model forecasts in order to determine what areas of the model needed enhancements for reducing uncertainty. Methods: The bone fracture risk model (BFxRM), originally published in (Nelson et al) is a probabilistic model that can assess the risk of astronaut bone fracture. This is accomplished by utilizing biomechanical models to assess the applied loads; utilizing models of spaceflight BMD loss in at-risk skeletal locations; quantifying bone strength through a relationship between areal BMD and bone failure load; and relating fracture risk index (FRI), the ratio of applied load to bone strength, to fracture probability. There are many factors associated with these calculations including environmental factors, factors associated with the fall event, mass and anthropometric values of the astronaut, BMD characteristics, characteristics of the relationship between BMD and bone strength and bone fracture characteristics. The uncertainty in these factors is captured through the use of parameter distributions and the fracture predictions are probability distributions with a mean value and an associated uncertainty. To determine parameter sensitivity, a correlation coefficient is found between the sample set of each model parameter and the calculated fracture probabilities. Each parameters contribution to the variance is found by squaring the correlation coefficients, dividing by the sum of the squared correlation coefficients, and multiplying by 100. Results: Sensitivity analyses of BFxRM simulations of preflight, 0 days post-flight and 365 days post-flight falls onto the hip revealed a subset of the twelve factors within the model which cause the most variation in the fracture predictions. These factors include the spring constant used in the hip biomechanical model, the midpoint FRI parameter within the equation used to convert FRI to fracture probability and preflight BMD values. Future work: Plans are underway to update the BFxRM by incorporating bone strength information from finite element models (FEM) into the bone strength portion of the BFxRM. Also, FEM bone strength information along with fracture outcome data will be incorporated into the FRI to fracture probability.

mathematical models↗

Comparison between sparsely distributed memory and Hopfield-type neural network models

The Sparsely Distributed Memory (SDM) model (Kanerva, 1984) is compared to Hopfield-type neural-network models. A mathematical framework for comparing the two is developed, and the capacity of each model is investigated. The capacity of the SDM can be increased independently of the dimension of the stored vectors, whereas the Hopfield capacity is limited to a fraction of this dimension. However, the total number of stored bits per matrix element is the same in the two models, as well as for extended models with higher order interactions. The models are also compared in their ability to store sequences of patterns. The SDM is extended to include time delays so that contextual information can be used to cover sequences. Finally, it is shown how a generalization of the SDM allows storage of correlated input pattern vectors.

Keeler, James D.↗

Fuzzy Modeling and Parallel Distributed Compensation for Aircraft Flight Control from Simulated Flight Data

A method is described that combines fuzzy system identification techniques with Parallel Distributed Compensation (PDC) to develop nonlinear control methods for aircraft using minimal a priori knowledge, as part of NASA’s Learn-to-Fly initiative. A fuzzy model was generated with simulated flight data, and consisted of a weighted average of multiple linear time invariant state-space cells having parameters estimated using the equation-error approach and a least-squares estimator. A compensator was designed for each subsystem using Linear Matrix Inequalities (LMI) to guarantee closed-loop stability and performance requirements. This approach is demonstrated using simulated flight data to automatically develop a fuzzy model and design control laws for a simplified longitudinal approximation of the F-16 nonlinear flight dynamics simulation. Results include a comparison of flight data with the estimated fuzzy models and simulations that illustrate the feasibility and utility of the combined fuzzy modeling and control approach.

Weinstein, Rose↗

Analytical model for the density distribution in the Io plasma torus

An analytical model is developed for the diffusive equilibrium plasma density distribution in the Io plasma torus. The model has been employed successfully to follow the ray path of plasma waves in the multi-ion Jovian magnetosphere; it would also be valuable for other studies of the Io torus that require a smooth and continuous description of the plasma density and its gradients. Validity of the analytical treatment requires that the temperature of thermal electrons be much lower than the ion temperature and that superthermal electrons be much less abundant than the thermal electrons; these two conditions are satisfied in the warm outer region of the Io torus from L = 6 to L = 10. The analytical solutions agree well with exact numerical calculations for the most dense portion of the Io torus within 30 deg of the equator.

Mei, YI↗

Magnetospherically trapped ions as a source of magnetosheath energetic ions

It has been suggested that energetic ions observed in the magnetosheath may be due to the direct leakage of trapped magnetospheric ions. To test this hypothesis, three-dimensional ion spectra from the energetic particle experiment on ISEE 1 for a magnetopause crossing on Nov. 10, 1977 are utilized to construct three-dimensional distribution functions in the magnetosphere and in the sheath. Using the observed magnetic field, a simple one-dimensional model of the magnetopause is developed. Ions are then followed in the model, starting in the magnetosphere, through the magnetopause and ending up in the sheath. Using Liouville's Theorem a model sheath distribution function is then built up by following the magnetospheric distribution function through the model fields. The model distribution is then compared with the observed sheath distribution. For this case it is found that the main features of the observed ions in the sheath are consistent with direct leakage and with no energization or de-energization processes, and an inward-pointing normal component is required. The energetic particles mapped in this case apparently follow a flux tube which does not penetrate the magnetopause where local tangential electric fields have been reported.

Speiser, T. W.↗