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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 55 records · Page 3

Surface Segregation of Liquid Metal Plasma-Facing Component Alloys: A ReaxFF Investigation

Engineering liquid metal alloys offers a transformative pathway for plasma-facing components by enabling chemically tailored surfaces that can simultaneously optimize plasma-material interactions, reduce divertor heat flux, and enhance core plasma confinement, thereby advancing the commercial viability of nuclear fusion power plants. This study, employing an atomistic simulation approach, provides direct evidence that incorporating nonmetal surface-active agents (such as O and H, or their combination) enables strong surface segregation. This capability makes tin−aluminum (Sn−Al) and tin−lithium (Sn−Li) alloys, with suitable compositions, good candidates for PFC applications. Specifically, the presence of low-Z solutes (Li, Al) leads to preferential surface enrichment, which imparts low-Z sputtering characteristics, while the Sn solvent maintains thermophysical stability. To systematically examine this behavior, we developed a ReaxFF force field spanning the full Sn/Al/Li/O/H chemistry, validated it against formation energies and elastic constants, and applied it in reactive molecular dynamics simulations at fusion-relevant temperatures. We also introduced an overlapbased segregation index that captures interfacial compositional separation directly from atomistic density distributions. Here, this metric reveals a clear hierarchy of segregation regimes and provides a unified view across all systems studied. Together, these findings establish a mechanistic link between nonmetal chemistry and interfacial structure, providing a predictive framework for designing self-adaptive, low-sputtering liquid metal alloys for fusion applications.

Alloys↗

High-Voltage Sodium–Metal Batteries with Asymmetric Fluoroalkoxylated Organoborate Anion Chemistry

The high reactivity of sodium (Na) metal restricts its compatibility to ether-based electrolytes, while the poor oxidative stability of ethers precludes their coupling to high-voltage cathodes, fundamentally limiting the operating voltage and energy density of sodium–metal batteries (SMBs). We present here a coordination-asymmetry strategy to reconcile this thermodynamic mismatch by generating in situ an asymmetric fluoroalkoxylated organoborate anion, [FB(OCH(CF 3 ) 2 ) 3 ] − (BOF – ), via a Lewis acid–base adduct reaction in ether electrolyte. The asymmetric ligand architecture differentiates oxidative and fluorination pathways: oxidizable B–O moieties mediate controlled interfacial reconstruction, whereas the terminal B–F units supply fluorine for chemical passivation. This self-adaptive chemistry yields nanoscale, conformal, compositionally graded interphases: a boron-oxide/boron-oxycarbide-rich cathode-electrolyte interphase (CEI) that mitigates ether oxidation and a bilayered inorganic–organic solid–electrolyte interphase (SEI) that regulates Na deposition. The nanostructured interphases enable highly reversible Na plating/stripping with an average Coulombic efficiency (CE) of 99.98% and sustain stable 4.3 V operation of anode-free SMBs in oxidation-prone ether electrolytes. Furthermore, this work establishes asymmetric boron coordination as a molecular-level design principle for creating chemically adaptive interphases that overcome the redox asymmetry in energy-dense electrochemical systems.

Anions↗

Applications of remote sensing to stream discharge predictions

A feasibility study has been initiated on the use of remote earth observations for augmenting stream discharge prediction for the design and/or operation of major reservoir systems, pumping systems and irrigation systems. The near-term objectives are the interpolation of sparsely instrumented precipitation surveillance networks and the direct measurement of water loss by evaporation. The first steps of the study covered a survey of existing reservoir systems, stream discharge prediction methods, gage networks and the development of a self-adaptive variation of the Kentucky Watershed model, SNOPSET, that includes snowmelt. As a result of these studies, a special three channel scanner is being built for a small aircraft, which should provide snow, temperature and water vapor maps for the spatial and temporal interpolation of stream gages.

Krause, F. R.↗

Aircraft cybernetics

The use of computers for aircraft control, flight simulation, and inertial navigation is explored. The man-machine relation problem in aviation is addressed. Simple and self-adapting autopilots are described and the assets and liabilities of digital navigation techniques are assessed.

Source record↗

Digital adaptive control laws for VTOL aircraft

Honeywell has designed a digital self-adaptive flight control system for flight test in the VALT Research Aircraft (a modified CH-47). The final design resulted from a comparison of two different adaptive concepts: one based on explicit parameter estimates from a real-time maximum likelihood estimation algorithm and the other based on an implicit model reference adaptive system. The two designs are compared on the basis of performance and complexity.

Hartmann, G. L.↗

Digital adaptive controllers for VTOL vehicles. Volume 1: Concept evaluation

A digital self-adaptive flight control system was developed for flight test in the VTOL approach and landing technology (VALT) research aircraft (a modified CH-47 helicopter). The control laws accept commands from an automatic on-board guidance system. The primary objective of the control laws is to provide good command-following with a minimum cross-axis response. Three attitudes and vertical velocity are separately commanded. Adaptation of the control laws is based on information from rate and attitude gyros and a vertical velocity measurement. The final design resulted from a comparison of two different adaptive concepts--one based on explicit parameter estimates from a real-time maximum-likelihood estimation algorithm, the other based on an implicit model reference adaptive system. The two designs were compared on the basis of performance and complexity.

Hartmann, G. L.↗

Digital adaptive controllers for VTOL vehicles. Volume 2: Software documentation

The VTOL approach and landing test (VALT) adaptive software is documented. Two self-adaptive algorithms, one based on an implicit model reference design and the other on an explicit parameter estimation technique were evaluated. The organization of the software, user options, and a nominal set of input data are presented along with a flow chart and program listing of each algorithm.

Hartmann, G. L.↗

On the solution of elastic-plastic static and dynamic postbuckling collapse of general structure

Many investigations have considered structural collapse from strictly the transient point of view. While such an approach is ideally correct, certain difficulties have to be overcome in its implementation. The present investigation is concerned with the development of self-adaptive algorithms which make it possible to conduct the analysis of both static elastic and elastic-plastic postbuckling, as well as static loading to the onset of buckling followed by subsequent dynamic postbuckling. The approach employed to solve the static portion of loading is to extend the constrained Incremental Newton-Raphson (INR) algorithm by incorporating elastic-plastic constitutive characterizations. Large deformation moderate strain theory is adopted to establish the overall strategy. Attention is given to governing field equations, aspects of algorithmic development, and numerical experiments conducted to illustrate the efficiency and stability of the developed schemes.

Padovan, J.↗

Research and development program for the development of advanced time-temperature dependent constitutive relationships. Volume 1: Theoretical discussion

The results of a 10-month research and development program for the development of advanced time-temperature constitutive relationships are presented. The program included (1) the effect of rate of change of temperature, (2) the development of a term to include time independent effects, and (3) improvements in computational efficiency. It was shown that rate of change of temperature could have a substantial effect on the predicted material response. A modification to include time-independent effects, applicable to many viscoplastic constitutive theories, was shown to reduce to classical plasticity. The computation time can be reduced by a factor of two if self-adaptive integration is used when compared to an integration using ordinary forward differences. During the course of the investigation, it was demonstrated that the most important single factor affecting the theoretical accuracy was the choice of material parameters.

Cassenti, B. N.↗

The evaluation of a semi-automated procedure for classifying corn and soybeans without ground data

Since the launch of Landsat 1 in 1973, research has been conducted with the objective to develop technology which would make it possible to achieve large area crop estimates on the basis of Landsat Multispectral Sensor (MSS) data without the benefit of ground observed training data. The present investigation is concerned with the evaluation of a technology which was developed to produce estimates of corn and soybean acreage in the central U.S. Corn Belt (Iowa, Illinois, and Indiana). A description of the employed technique is provided and details regarding the test of the developed technology are discussed. The obtained results show that considerable progress has been made toward creating an automatic, self-adapting procedure which has favorable bias and variance characteristics.

Metzler, M. D.↗

Random element method for numerical modeling of diffusional processes

The random element method is a generalization of the random vortex method that was developed for the numerical modeling of momentum transport processes as expressed in terms of the Navier-Stokes equations. The method is based on the concept that random walk, as exemplified by Brownian motion, is the stochastic manifestation of diffusional processes. The algorithm based on this method is grid-free and does not require the diffusion equation to be discritized over a mesh, it is thus devoid of numerical diffusion associated with finite difference methods. Moreover, the algorithm is self-adaptive in space and explicit in time, resulting in an improved numerical resolution of gradients as well as a simple and efficient computational procedure. The method is applied here to an assortment of problems of diffusion of momentum and energy in one-dimension as well as heat conduction in two-dimensions in order to assess its validity and accuracy. The numerical solutions obtained are found to be in good agreement with exact solution except for a statistical error introduced by using a finite number of elements, the error can be reduced by increasing the number of elements or by using ensemble averaging over a number of solutions.

Ghoniem, A. F.↗

Component-specific modeling

The ability to accurately structurally analyze engine components to assure that they can survive for their designed lifetime in an increasingly harsh environment is discussed. Under the HOST (HOt Section Technology) program, advanced component-specific modeling methods, with built-in analysis capability, will be developed separately for burner liners, turbine blades and vanes. These modeling methods will make maximum use of, but will not rely solely on, existing analysis methods and techniques, to analyze the three identified components. Nor will the complete structural analysis of a component necessarily be performed as a single analysis. The approach to be taken will develop complete software analysis packages with internal, component-specific, self-adaptive solution strategies. Each package will contain a set of modeling and analysis tools. The selection and order of specific methods and techniques within the set to be applied will depend on the specific-component, the current thermo-mechanical loading, and the current state of the component. All modeling and analysis decisions will be made internally based on developed decision criteria within the solution strategies; minimal user intervention will be required.

Hirschbein, M. S.↗

Cyclic creep analysis from elastic finite-element solutions

A uniaxial approach was developed for calculating cyclic creep and stress relaxation at the critical location of a structure subjected to cyclic thermomechanical loading. This approach was incorporated into a simplified analytical procedure for predicting the stress-strain history at a crack initiation site for life prediction purposes. An elastic finite-element solution for the problem was used as input for the simplified procedure. The creep analysis includes a self-adaptive time incrementing scheme. Cumulative creep is the sum of the initial creep, the recovery from the stress relaxation and the incremental creep. The simplified analysis was exercised for four cases involving a benchmark notched plate problem. Comparisons were made with elastic-plastic-creep solutions for these cases using the MARC nonlinear finite-element computer code.

Kaufman, A.↗

Analysis of potential helicopter vibration reduction concepts

Several recent helicopter vibration reduction research programs are described. Results of studies of blade design parameters in rotor vibratory response and of an advanced blade design for reduced vibration are examined. An optimization approach to develop a general automated procedure for rotor blade design is described, and analytical results for an articulated rotor operating at a steady 160 kt flight condition are reported. The use of a self-adaptive controller to implement higher harmonic control in closed-loop fashion is addressed, and a computer simulation used to evaluate and compare the performance of alternative algorithms included in the generic active controller is discussed. Results are presented for steady level flight conditions, short-duration maneuvers, blade stresses and rotor performance, blade-appended aeroelastic devices, vibratory airloads, wake-induced blade airloads, and airloads from blade motions, the interaction of rotor and fuselage, and the interaction of rotor and empennage.

Landgrebe, A. J.↗

Grid-free simulation of diffusion using random walk methods

The simulation of the diffusion of a continuum field by the random walk (RW) displacement of a set of particles is considered. Elements of the gradients of the diffusive concentration are transported by computational particles. It is demonstrated that, by the use of concentration gradients in the RW process, statistical errors are reduced and each realization of the numerical solution is a representation of the exact solution. The algorithm is grid-free, and the computational elements move to follow the gradients; hence, the algorithm is self-adaptive, and uniform resolution is achieved for all times.

Ghoniem, A. F.↗

Multiply scaled constrained nonlinear equation solvers

To improve the numerical stability of nonlinear equation solvers, a partitioned multiply scaled constraint scheme is developed. This scheme enables hierarchical levels of control for nonlinear equation solvers. To complement the procedure, partitioned convergence checks are established along with self-adaptive partitioning schemes. Overall, such procedures greatly enhance the numerical stability of the original solvers. To demonstrate and motivate the development of the scheme, the problem of nonlinear heat conduction is considered. In this context the main emphasis is given to successive substitution-type schemes. To verify the improved numerical characteristics associated with partitioned multiply scaled solvers, results are presented for several benchmark examples.

Padovan, Joe↗

From PINNs to PIKANs: recent advances in physics-informed machine learning

Physics-Informed Neural Networks (PINNs) have emerged as a key tool in Scientific Machine Learning since their introduction in 2017, enabling the efficient solution of ordinary and partial differential equations using sparse measurements. Over the past few years, significant advancements have been made in the training and optimization of PINNs, covering aspects such as network architectures, adaptive refinement, domain decomposition, and the use of adaptive weights and activation functions. A notable recent development is the Physics-Informed Kolmogorov-Arnold Networks (PIKANS), which leverage a representation model originally proposed by Kolmogorov in 1957, offering a promising alternative to traditional PINNs. In this review, we provide a comprehensive overview of the latest advancements in PINNs, focusing on improvements in network design, feature expansion, optimization techniques, uncertainty quantification, and theoretical insights. We also survey key applications across a range of fields, including biomedicine, fluid and solid mechanics, geophysics, dynamical systems, heat transfer, chemical engineering, and beyond. Lastly, we review computational frameworks and software tools developed by both academia and industry to support PINN research and applications.

Kolmogorov-Arnold networks↗