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Results for “Mathematical optimization”

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 199 records · Page 11
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

DONKEY: A Flexible and Accurate Algorithm for Clustering

We propose an accurate clustering algorithm suitable for the varied and multidimensional data sets that correspond to temporal snapshots from on-the-fly nonadiabatic trajectory-based simulations of photoexcited dynamics. The algorithm approximates the underlying probability density function using variable kernel density estimation, with local maxima corresponding to cluster centers. Each data point is then assigned to one of the maxima by employing a maximization procedure. Finally, clusters artificially separated by minor fluctuations in the probability density are merged. The algorithm does not require parameter tuning, which ensures flexibility and reduces the risk of bias. It is tested on several synthetic data sets, where it consistently outperforms conventional clustering algorithms. As a final example, the algorithm is applied to the excited dynamics of the norbornadiene ⇌ quadricyclane (C 7 H 8 ) molecular photoswitch, demonstrating how distinct reaction pathways can be identified.

algorithms↗
DOE OSTI2024

EF-Hand Battle Royale: Hetero-ion Complexation in Lanmodulin

The lanmodulin (LanM) protein has emerged as an effective means for rare earth element (REE) extraction and separation from complex feedstocks without the use of organic solvents. Whereas the binding of LanM to individual REEs has been well characterized, little is known about the thermodynamics of mixed metal binding complexes (i.e., heterogeneous ion complexes), which limits the ability to accurately predict separation performance for a given metal ion mixture. In this paper, we employ the law of mass action to establish a theory of perfect cooperativity for LanM-REE complexation at the two highest-affinity binding sites. The theory is then used to derive an equation that explains the nonintuitive REE binding behavior of LanM, where separation factors for binary pairs of ions vary widely based on the ratio of ions in the aqueous phase, a phenomenon that is distinct from single-ion-binding chemical chelators. We then experimentally validate this theory and perform the first quantitative characterization of LanM complexation with heterogeneous ion pairs using resin-immobilized LanM. Importantly, the resulting homogeneous and heterogeneous constants enable accurate prediction of the equilibrium state of LanM in the presence of mixtures of up to 10 REEs, confirming that the perfect cooperativity model is an accurate mechanistic description of REE complexation by LanM. We further employ the model to simulate separation performance over a range of homogeneous and heterogeneous binding constants, revealing important insights into how mixed binding differentially impacts REE separations based on the relative positioning of the ion pairs within the lanthanide series. In addition to informing REE separation process optimization, these results provide mathematical and experimental insight into competition dynamics in other ubiquitous and medically relevant, cooperative binding proteins, such as calmodulin.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Dynamic Model Development of a Wind Power Plant Using Neural Net Method to Forecast Wind Power Output (CRADA Final Report)

This project is intended to model wind power plant based on monitored data at the wind power plant. This project will promote the university research in Renewable Energy area and trains the future highly qualified engineers. The dynamic model will be based on neural net model with the input from the two met towers (12 inputs), and the number of turbines in operation (one input). The overall input will be 13 inputs to drive the simulations. The output power at the point of interconnection will be used to tune the neural net weight coefficients. Two neural net concepts will be investigated (the back propagation neural net and the dynamic recurrent neural net with feedback).

17 WIND ENERGY↗
NASA NTRS1966

Preview control behavior and optimal control norms

Model based on optimal control theory for characterizing human operator in preview control task to provide reference frame for studying performance value and learning in manual control

HUMAN PERFORMANCE↗
NASA NTRS1979

Codes for a priority queue on a parallel data bus

Some codes for arbitration of priorities among subsystem computers or peripheral device controllers connected to a parallel data bus are described. At arbitration time, several subsystems present wire-OR, parallel code words to the bus, and the central computer can identify the subsystem of highest priority and determine which of two or more transmission services the subsystem requires. A mathematical discussion of the optimality of the codes with regard to the number of subsystems that may participate in the scheme for a given number of wires is presented along with the number of services that each subsystem may request.

Wallis, D. E.↗
NASA NTRS1989

Nonlinear control of a supermaneuverable aircraft

This paper describes a technique which may be used to design the flight control system for a highly maneuverable aircraft. The control system was provided to stabilize the dynamics of the aircraft model and allow it to fly simulated, poststall 'supermaneuvers'. Although the aircraft dynamics are highly nonlinear under these conditions, the gain-scheduled, flight control system was designed using basically linear techniques. A manuever generator was implemented to pilot the mathematical model through prescribed optimal trajectories. The control system design performed well while executing maneuvers involving small angular rates where the governing dynamics could be considered linear. However, the performance deteriorated once the model was subjected to high angular rates at high angle of attack.

Snell, S. Antony↗
NASA NTRS1992

The Enabler: A reevaluation of design concepts and construction of a scaled model

The basic objective of the student's work this quarter was to make an in depth examination of the design concepts used on the lunar vehicle 'The Enabler'. Several changes were made to the vehicle including a redesigned wheel, a more compact boom and a reduced articulation angle. The vehicle's final dimensions were determined through an optimization process by defining mathematical equations for several of the vehicle's defined objectives. These included the ability to scale a one meter object, traverse a one meter crevice, and maintain a wheel-to-wheel clearance of three inches while at maximum articulation. The final dimensions of the vehicle were used to construct an approximate 1/4 scale model of the chassis and wheels. The boom, however, was constructed on a 1/5 scale (from the original design). This was due to the redesign of the boom and the limitations of the constructing material and PVC fittings.

Bess, David↗
NASA NTRS1998

Three Program Architecture for Design Optimization

In this presentation, I would like to review historical perspective on the program architecture used to build design optimization capabilities based on mathematical programming and other numerical search techniques. It is rather straightforward to classify the program architecture in three categories as shown above. However, the relative importance of each of the three approaches has not been static, instead dynamically changing as the capabilities of available computational resource increases. For example, we considered that the direct coupling architecture would never be used for practical problems, but availability of such computer systems as multi-processor. In this presentation, I would like to review the roles of three architecture from historical as well as current and future perspective. There may also be some possibility for emergence of hybrid architecture. I hope to provide some seeds for active discussion where we are heading to in the very dynamic environment for high speed computing and communication.

Miura, Hirokazu↗
NASA NTRS2019

Trajectory Design of the Lucy Mission to Explore the Diversity of the Jupiter Trojans

Lucy, NASA’s next Discovery-class mission, will explore the diversity of the Jupiter Trojan asteroids. The Jupiter Trojans are thought to be remnants of the early solar system that were scattered inward when the gas giants migrated to their current positions as described in the Nice model. There are two stable subpopulations, or “swarms,” captured at the Sun-Jupiter L4 and L5 regions. These objects are the most accessible samples of what the outer solar system may have originally looked like. Lucy will launch in 2021 and will visit five Trojans, including one binary system. This paper discusses the target selection process, including a description of “alternate Lucys” that were ultimately passed over in favor of the final design. The mathematics of the trajectory optimization are also discussed.

Lucy↗
NASA NTRS2021

Learning spatial response functions from large multi-sensor AIRS and MODIS datasets

We use large datasets from the Atmospheric Infrared Sounder (AIRS) and the Moderate Resolution Imaging Spectroradiometer (MODIS) to derive AIRS spatial response functions and study their potential variations over the mission. The new reconstructed spatial response functions can be used to reduce errors in the radiances in non-uniform scenes and improve products generated using both AIRS and MODIS data. AIRS spatial response functions are distinct for each of its 2378 channels and each of its 90 scan angles. We develop the mathematical model and the optimization framework for deriving spatial response functions for two AIRS channels with low water vapor absorption and various scan angles. We quantify uncertainties in the derived reconstructions and study how they differ from pre-flight spatial response functions. We show that our approach generates reconstructions that agree with the data more accurately compared to pre-flight spatial responses. We derive spatial response functions using data collected during successive dates in order to ascertain the repeatability of the reconstructed spatial response functions. We also compare the derived spatial response functions based on data collected in the beginning, the middle, and at the current state of the mission in order to study changes in reconstructions over time.

Vese, Luminita↗
DOE OSTI2024

Practical and Optimal Sequential Bayesian Experimental Design for Complex Systems Incorporating Human Experimenter Preferences (Final Scientific/Technical Report)

Experiments are indispensable for developing models of complex systems. Carefully designed experiments can provide substantial savings for these expensive data-acquisition opportunities. However, designs based on heuristics are often suboptimal for systems with multiphysics, nonlinear dynamics, and uncertain and noisy environments. Optimal experimental design, while leveraging predictive models, seeks to systematically quantify and maximize the value of experiments. In this project, we focused on the design of multiple experiments, where current approaches are largely suboptimal: batch-design does not adapt to new data acquired during the experiment campaign (no feedback), and greedy/myopic design ignores future dynamics and consequences (no lookahead). We developed the mathematical framework and computational methods for sequential optimal experimental design (sOED) for complex systems. We enabled tractable model-based sOED in a rigorous manner through novel algorithms based on reinforcement learning, and investigated the effects of human experimenters on the design process. Our methods are fully Bayesian, able to quantify and update uncertainty in a principled manner. The traits aimed by our approach—mathematical rigor and optimality, human effects and uncertainty quantification, computational practicality—are crucial for elevating the standards of artificial intelligence (AI) to support decision-making in scientific domains, and contribute toward trust and realistic adoption of AI in experimental design practice.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS2001

Robust Airfoil Optimization to Achieve Consistent Drag Reduction Over a Mach Range

We prove mathematically that in order to avoid point-optimization at the sampled design points for multipoint airfoil optimization, the number of design points must be greater than the number of free-design variables. To overcome point-optimization at the sampled design points, a robust airfoil optimization method (called the profile optimization method) is developed and analyzed. This optimization method aims at a consistent drag reduction over a given Mach range and has three advantages: (a) it prevents severe degradation in the off-design performance by using a smart descent direction in each optimization iteration, (b) there is no random airfoil shape distortion for any iterate it generates, and (c) it allows a designer to make a trade-off between a truly optimized airfoil and the amount of computing time consumed. For illustration purposes, we use the profile optimization method to solve a lift-constrained drag minimization problem for 2-D airfoil in Euler flow with 20 free-design variables. A comparison with other airfoil optimization methods is also included.

Li, Wu↗
NASA NTRS1987

Optimal cure cycle design of a resin-fiber composite laminate

A unified computed aided design method was studied for the cure cycle design that incorporates an optimal design technique with the analytical model of a composite cure process. The preliminary results of using this proposed method for optimal cure cycle design are reported and discussed. The cure process of interest is the compression molding of a polyester which is described by a diffusion reaction system. The finite element method is employed to convert the initial boundary value problem into a set of first order differential equations which are solved simultaneously by the DE program. The equations for thermal design sensitivities are derived by using the direct differentiation method and are solved by the DE program. A recursive quadratic programming algorithm with an active set strategy called a linearization method is used to optimally design the cure cycle, subjected to the given design performance requirements. The difficulty of casting the cure cycle design process into a proper mathematical form is recognized. Various optimal design problems are formulated to address theses aspects. The optimal solutions of these formulations are compared and discussed.

Hou, Jean W.↗
NASA NTRS1997

Optimization of Air-Breathing Propulsion Engine Concepts

Air-breathing propulsion engines play an important role in the development of both civil and military aircraft Design optimization of such engines can lead to higher power, or more thrust for less fuel consumption. A multimission propulsion engine design can be modeled mathematically as a multivariable global optimization problem, with a sequence of subproblems, which are specific to the mission events defined through Mach number, altitude, and power setting combinations.

Patnaik, Surya N.↗
NASA NTRS1984

NASA/Howard University Large Space Structures Institute

Basic research on the engineering behavior of large space structures is presented. Methods of structural analysis, control, and optimization of large flexible systems are examined. Topics of investigation include the Load Correction Method (LCM) modeling technique, stabilization of flexible bodies by feedback control, mathematical refinement of analysis equations, optimization of the design of structural components, deployment dynamics, and the use of microprocessors in attitude and shape control of large space structures. Information on key personnel, budgeting, support plans and conferences is included.

Broome, T. H., Jr.↗
NASA NTRS1988

The Sizing and Optimization Language, (SOL): Computer language for design problems

The Sizing and Optimization Language, (SOL), a new high level, special purpose computer language was developed to expedite application of numerical optimization to design problems and to make the process less error prone. SOL utilizes the ADS optimization software and provides a clear, concise syntax for describing an optimization problem, the OPTIMIZE description, which closely parallels the mathematical description of the problem. SOL offers language statements which can be used to model a design mathematically, with subroutines or code logic, and with existing FORTRAN routines. In addition, SOL provides error checking and clear output of the optimization results. Because of these language features, SOL is best suited to model and optimize a design concept when the model consits of mathematical expressions written in SOL. For such cases, SOL's unique syntax and error checking can be fully utilized. SOL is presently available for DEC VAX/VMS systems. A SOL package is available which includes the SOL compiler, runtime library routines, and a SOL reference manual.

Lucas, Stephen H.↗