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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 649 records · Page 36
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Effect of Part Size, Displacement Rate, and Aging on Compressive Properties of Elastomeric Parts of Different Unit Cell Topologies Formed by Vat Photopolymerization Additive Manufacturing

Due to its ability to achieve geometric complexity at high resolution and low length scales, additive manufacturing (AM) has increasingly been used for fabricating cellular structures (e.g., foams and lattices) for a variety of applications. Specifically, elastomeric cellular structures offer tunability of compliance as well as energy absorption and dissipation characteristics. However, there are limited data available on compression properties for printed elastomeric cellular structures of different designs and testing parameters. In this work, the authors evaluate how unit cell topology, part size, the rate of compression, and aging affect the compressive response of polyurethane-based simple cubic, body-centered, and gyroid structures formed by vat photopolymerization AM. Finite element simulations incorporating hyperelastic and viscoelastic models were used to describe the data, and the simulated results compared well with the experimental data. Of the designs tested, only the parts with the body-centered unit cell exhibited differences in stress–strain responses at different part sizes. Of the compression rates tested, the highest displacement rate (1000 mm/min) often caused stiffer compressive behavior, indicating deviation from the quasi-static assumption and approaching the intermediate rate response. The cellular structures did not change in compression properties across five weeks of aging time, which is desirable for cushioning applications. This work advances knowledge on the structure–property relationships of printed elastomeric cellular materials, which will enable more predictable compressive properties that can be traced to specific unit cell designs.

36 MATERIALS SCIENCE↗
NASA NTRS1985

Acoustic waves in the solar atmosphere. VII - Non-grey, non-LTE H(-) models

The propagation and shock formation of radiatively damped acoustic waves in the solar chromosphere are studied under the assumption that H(-) is the only absorber; the opacity is non-grey. Deviations from local thermodynamic equilibrium (LTE) are permitted. The results of numerical simulations show the depth dependence of the heating by the acoustic waves to be insensitive to the mean state of the atmosphere. After the waves have developed into shocks, their energy flux decays exponentially with a constant damping length of about 1.4 times the pressure scale height, independent of initial flux and wave period. Departures from LTE have a strong influence on the mean temperature structure in dynamical chromosphere models; this is even more pronounced in models with reduced particle density - simulating conditions in magnetic flux tubes - which show significantly increased temperatures in response to mechanical heating. When the energy dissipation of the waves is sufficiently large to dissociate most of the H(-) ions, a strong temperature rise is found that is reminiscent of the temperature structure in the transition zone between chromosphere and corona; the energy flux remaining in the waves then drives mass motions.

Schmitz, F.↗
NASA NTRS1988

Model consistency in large eddy simulation of turbulent channel flows

Combinations of filters and subgrid scale stress models for large eddy simulation of the Navier-Stokes equations are examined by a priori tests and numerical simulations. The structure of the subgrid scales is found to depend strongly on the type of filter used, and consistency between model and filter is essential to ensure accurate results. The implementation of consistent combinations of filter and model gives more accurate turbulence statistics than those obtained in previous investigations in which the models were chosen independently from the filter. Results and limitations of the a priori test are discussed. The effect of grid refinement is also examined.

Piomelli, Ugo↗
NASA NTRSDate not supplied

Model Assisted Probability of Detection for NASA Space Missions

Model assisted probability of detection (MAPOD) uses data from simulations to improve a traditional probability of detection (POD) study. This could include extending the parameter space to reduce uncertainty or substituting experimental data with simulated data to reduce the time and cost of a POD study. In the past MAPOD was difficult due to limited computational resources, but recent innovations in simulation tools and high-performance computing have made this type of high-degree-of-freedom modeling possible, and complex structures have made it necessary. This presentation will summarize the work done by the computational nondestructive evaluation (CNDE) specialists within the Nondestructive Evaluation Sciences branch at NASA Langley Research Center (LaRC) to complete a MAPOD study for phased array ultrasound testing (PAUT) of a friction stir welding (FSW) method to be used on Space Launch System (SLS) structures. The three critical needs for a MAPOD study are a validated and verified model of the inspection technique for the structure being inspected, some experimental POD data, and an uncertainty model for both the model and the experimental data. PAUT was simulated using Extende CIVA’s UT module. The model was validated using laboratory inspection data from NASA Marshall Space Flight Center (MSFC) for a Hit/Miss POD for FSW in 2219-T87 aluminum panels representative of those used in the SLS. This model was then used to simulate flaw sizes that were originally omitted from the original POD study. The results of this new MAPOD study will be presented along with a discussion of the methods and processes used to analyze the original data, selected simulation parameters, and development of the uncertainty model used for the statistical analysis. The goal of this effort is not just to improve the POD study but to demonstrate the value of MAPOD and provide a roadmap for application of MAPOD on future projects.

Elizabeth Gregory↗
NASA NTRSDate not supplied

Model Assisted Probability of Detection for NASA Space Missions

Model assisted probability of detection (MAPOD) uses data from simulations to improve a traditional probability of detection (POD) study. This could include extending the parameter space to reduce uncertainty or substituting experimental data with simulated data to reduce the time and cost of a POD study. In the past MAPOD was difficult due to limited computational resources, but recent innovations in simulation tools and high-performance computing have made this type of high-degree-of-freedom modelling possible, and complex structures have made it necessary. This presentation will summarize the work done by the computational nondestructive evaluation (CNDE) group at NASA Langley Research Center (LaRC) to complete a MAPOD study for phased array ultrasound testing (PAUT) of a friction stir welding (FSW) method to be used on Space Launch System (SLS) structures. The three critical needs for a MAPOD study are a validated and verified model of the inspection technique for the structure being inspected, some experimental POD data, and an uncertainty model for both the model and the experimental data. PAUT was simulated using Extende CIVA’s UT module. The model was validated using laboratory inspection data from NASA Marshall Space Flight Center (MSFC) for a Hit/Miss POD for FSW in 2219-T87 aluminum panels representative of those used in the SLS. This model was then used to simulate flaw sizes that were originally omitted from the original POD study. The results of this new MAPOD study will be presented along with a discussion of the methods and processes used to analyze the original data, selected simulation parameters, and development of the uncertainty model used for the statistical analysis. The goal of this effort is not just to improve the POD study but to demonstrate the value of MAPOD and provide a roadmap for application of MAPOD on future projects.

Elizabeth Gregory↗
NASA NTRS2004

Modeling and Design Analysis Methodology for Tailoring of Aircraft Structures with Composites

Composite materials provide design flexibility in that fiber placement and orientation can be specified and a variety of material forms and manufacturing processes are available. It is possible, therefore, to 'tailor' the structure to a high degree in order to meet specific design requirements in an optimum manner. Common industrial practices, however, have limited the choices designers make. One of the reasons for this is that there is a dearth of conceptual/preliminary design analysis tools specifically devoted to identifying structural concepts for composite airframe structures. Large scale finite element simulations are not suitable for such purposes. The present project has been devoted to creating modeling and design analysis methodology for use in the tailoring process of aircraft structures. Emphasis has been given to creating bend-twist elastic coupling in high aspect ratio wings or other lifting surfaces. The direction of our work was in concert with the overall NASA effort Twenty- First Century Aircraft Technology (TCAT). A multi-disciplinary team was assembled by Dr. Damodar Ambur to work on wing technology, which included our project.

Rehfield, Lawrence W.↗
NASA NTRS2003

Application of Probabilistic Analysis to Aircraft Impact Dynamics

Full-scale aircraft crash simulations performed with nonlinear, transient dynamic, finite element codes can incorporate structural complexities such as: geometrically accurate models; human occupant models; and advanced material models to include nonlinear stressstrain behaviors, laminated composites, and material failure. Validation of these crash simulations is difficult due to a lack of sufficient information to adequately determine the uncertainty in the experimental data and the appropriateness of modeling assumptions. This paper evaluates probabilistic approaches to quantify the uncertainty in the simulated responses. Several criteria are used to determine that a response surface method is the most appropriate probabilistic approach. The work is extended to compare optimization results with and without probabilistic constraints.

Lyle, Karen H.↗
DOE OSTI2026

Agentic framework for programmatic crystal structure generation using a fine-tuned worker–supervisor large language model

Platinum group metals (PGMs) underpin many catalytic technologies but face severe supply constraints, motivating the search for alternative materials and computational methods to accelerate discovery. While atomistic simulation tools such as Pymatgen and ASE have streamlined structure manipulation, they require detailed inputs, limiting accessibility for experimentalists and slowing early-stage exploration. Here, in this study, we present an AI-driven agentic framework that orchestrates worker–supervisor large language models (LLMs). The worker translates natural-language prompts of varying abstraction into valid crystallographic structures using a compact LLM fine-tuned with low-rank adaptation on a curated text–code–CIF dataset, emphasizing energy-efficient training. Benchmarking against the baseline CodeGen-350M-mono model shows that fine-tuning reduces hallucination rates from 100% to as low as 5% and improves structural match accuracy to up to 82% for fully specified inputs. Accuracy declines with decreasing prompt detail but remains nontrivial even when only stoichiometry and space group are provided, underscoring the LLM’s capacity for crystallographic inference. The supervisor Claude LLM evaluates the outputs and triggers iterative refinement through the worker’s built-in structure manipulation capabilities (e.g., supercell scaling, strain, vacancy, and substitution operations). We further demonstrate use cases for technologically relevant catalysts, including IrO 2 , pyrochlore Pb 2 Ir 2 O 7 , Ni 2 FeO 4 , and Ni 3 Mo, where the framework generates physically consistent structures that can be refined via geometry optimization. This work introduces a low-energy, language-driven pathway for integrating human and machine intelligence in materials design, paving the way for AI-assisted synthesis planning and high-throughput screening of complex oxides.

AI agent↗
NASA NTRS1991

Radar and microphysical characteristics of convective storms simulated from a numerical model using a new microphysical parameterization

The basic features of a new and improved bulk-microphysical parameterization capable of simulating the hydrometeor structure of convective systems in all types of large-scale environments (with minimal adjustment of coefficients) are studied. Reflectivities simulated from the model are compared with radar observations of an intense midlatitude convective system. Simulated reflectivities using the novel four-class ice scheme with a microphysical parameterization rain distribution at 105 min are illustrated. Preliminary results indicate that this new ice scheme works efficiently in simulating midlatitude continental storms.

Ferrier, Brad S.↗
NASA NTRS2011

Effects of Forest Disturbances on Forest Structural Parameters Retrieval from Lidar Waveform Data

The effect of forest disturbance on the lidar waveform and the forest biomass estimation was demonstrated by model simulation. The results show that the correlation between stand biomass and the lidar waveform indices changes when the stand spatial structure changes due to disturbances rather than the natural succession. This has to be considered in developing algorithms for regional or global mapping of biomass from lidar waveform data.

Ranson, K, Lon↗
NASA NTRS1999

Vertical Profiles of Latent Heat Release and Their Retrieval for TOGA COARE Convective Systems Using a Cloud Resolving Model, SSM/I, and Ship-borne Radar Data

Latent heating profiles associated with three (TOGA COARE) Tropical Ocean and Global Atmosphere Coupled Ocean Atmosphere Response Experiment active convective episodes (December 10-17 1992; December 19-27 1992; and February 9-13 1993) are examined using the Goddard Cumulus Ensemble (GCE) Model and retrieved by using the Goddard Convective and Stratiform Heating (CSH) algorithm . The following sources of rainfall information are input into the CSH algorithm: Special Sensor Microwave Imager (SSM/1), Radar and the GCE model. Diagnostically determined latent heating profiles calculated using 6 hourly soundings are used for validation. The GCE model simulated rainfall and latent heating profiles are in excellent agreement with those estimated by soundings. In addition, the typical convective and stratiform heating structures (or shapes) are well captured by the GCE model. Radar measured rainfall is smaller than that both estimated by the GCE model and SSM/I in all three different COARE IFA periods. SSM/I derived rainfall is more than the GCE model simulated for the December 19-27 and February 9-13 periods, but is in excellent agreement with the GCE model for the December 10-17 period. The GCE model estimated stratiform amount is about 50% for December 19-27, 42% for December 11-17 and 56% for the February 9-13 case. These results are consistent with large-scale analyses. The accurate estimates of stratiform amount is needed for good latent heating retrieval. A higher (lower) percentage of stratiform rain can imply a maximum heating rate at a higher (lower) altitude. The GCE model always simulates more stratiform rain (10 to 20%) than the radar for all three convective episodes. SSM/I derived stratiform amount is about 37% for December 19-27, 48% for December 11-17 and 41% for the February 9-13 case. Temporal variability of CSH algorithm retrieved latent heating profiles using either GCE model simulated or radar estimated rainfall and stratiform amount is in good agreement with that diagnostically determined for all three periods. However, less rainfall and a smaller stratiform percentage estimated by radar resulted in a weaker (underestimated) latent heating profile and a lower maximum latent heating level compared to those determined diagnostically. Rainfall information from SSM/I can not retrieve individual convective events due to poor temporal sampling. Nevertheless, this study suggests that a good 4r, rainfall retrieval from SSM/I for a convective event always leads to a good latent heating retrieval. Sensitivity testing has been performed and the results indicate that the SSM/I derived time averaged stratiform amount may be underestimated for December 19-27. Time averaged heating profiles derived from SSM/I, however, are not in bad agreement with those derived by soundings for the December 10-17 convective period. The heating retrievals may be more accurate for longer time scales provided there is no bias in the sampling.

Tao, Wei-Kuo↗
NASA NTRS2010

Computationally efficient modeling and simulation of large scale systems

A method of simulating operation of a VLSI interconnect structure having capacitive and inductive coupling between nodes thereof. A matrix X and a matrix Y containing different combinations of passive circuit element values for the interconnect structure are obtained where the element values for each matrix include inductance L and inverse capacitance P. An adjacency matrix A associated with the interconnect structure is obtained. Numerical integration is used to solve first and second equations, each including as a factor the product of the inverse matrix X.sup.1 and at least one other matrix, with first equation including X.sup.1Y, X.sup.1A, and X.sup.1P, and the second equation including X.sup.1A and X.sup.1P.

Jain, Jitesh↗
NASA NTRS2012

Computationally efficient modeling and simulation of large scale systems

A method of simulating operation of a VLSI interconnect structure having capacitive and inductive coupling between nodes thereof. A matrix X and a matrix Y containing different combinations of passive circuit element values for the interconnect structure are obtained where the element values for each matrix include inductance L and inverse capacitance P. An adjacency matrix A associated with the interconnect structure is obtained. Numerical integration is used to solve first and second equations, each including as a factor the product of the inverse matrix X.sup.-1 and at least one other matrix, with first equation including X.sup.-1Y, X.sup.-1A, and X.sup.-1P, and the second equation including X.sup.-1A and X.sup.-1P.

Jain, Jitesh↗
NASA NTRS2014

Computationally Efficient Modeling and Simulation of Large Scale Systems

A system for simulating operation of a VLSI interconnect structure having capacitive and inductive coupling between nodes thereof, including a processor, and a memory, the processor configured to perform obtaining a matrix X and a matrix Y containing different combinations of passive circuit element values for the interconnect structure, the element values for each matrix including inductance L and inverse capacitance P, obtaining an adjacency matrix A associated with the interconnect structure, storing the matrices X, Y, and A in the memory, and performing numerical integration to solve first and second equations.

Jain, Jitesh↗
NASA NTRS1996

The Influences of Lamination Angles on the Interior Noise Levels of an Aircraft

The feasibility of reducing the interior noise levels of an aircraft passenger cabin through optimization of the composite lay up of the fuselage is investigated. MSC/NASTRAN, a commercially available finite element code, is used to perform the dynamic analysis and subsequent optimization of the fuselage. The numerical calculation of sensitivity of acoustic pressure to lamination angle is verified using a simple thin, cylindrical shell with point force excitations as noise sources. The thin shell used represents a geometry similar to the fuselage and analytic solutions are available for the cylindrical thin shell equations of motion. Optimization of lamination angle for the reduction of interior noise is performed using a finite element model of an actual aircraft fuselage. The aircraft modeled for this study is the Beech Starship. Point forces simulate the structure borne noise produced by the engines and are applied to the fuselage at the wing mounting locations. These forces are the noise source for the optimization problem. The acoustic pressure response is reduced at a number of points in the fuselage and over a number of frequencies. The objective function is minimized with the constraint that it be larger than the maximum sound pressure level at the response points in the passenger cabin for all excitation frequencies in the range of interest. Results from the study of the fuselage model indicate that a reduction in interior noise levels is possible over a finite frequency range through optimal configuration of the lamination angles in the fuselage. Noise reductions of roughly 4 dB were attained. For frequencies outside the optimization range, the acoustic pressure response may increase after optimization. The effects of changing lamination angle on the overall structural integrity of the airframe are not considered in this study.

Fernholz, Christian M.↗
NASA NTRS2024

A Feasibility Study of 4-D Tomography of Soft X-ray Magnetosheath Emissivities Using Multi-Spacecraft Measurements

Upcoming heliophysics missions utilize state-of-the-art wide field-of-view (FOV) imaging technology to measure and investigate the space plasma environment on a global scale. At Earth, remote sensing of soft X-ray emissions, which are generated via the charge exchange interaction between heavy solar wind ions and exospheric neutral atoms, is a promising means to investigate the global magnetosheath structure, its response to varying solar wind conditions, and the spatiotemporal properties of the dayside magnetic reconnection. Data analysis techniques such as optical tomography can provide additional structural and time-varying information from the observed target and thus enhance the mission’s scientific return. In this work, we simulate multiple and simultaneous observations of the dayside magnetosphere using soft X-ray imagers located at long-distance vantage points to reconstruct the time-dependent, three-dimensional (3-D) structure of the magnetosheath using a dynamic tomographic approach. The OpenGCCM MHD model is used to simulate the time-varying response of the magnetosheath to solar wind conditions and, subsequently, generate synthetic soft X-ray images from multiple spacecraft vantage points separated along a common orbit. A detailed analysis is then performed to identify the nominal set of spacecraft that produces the highest fidelity tomographic reconstruction of the magnetopause. This work aims to (i) demonstrate, for the first time, the use of dynamic tomography to retrieve the time-varying magnetosheath structure and (ii) identify a nominal mission design for multi-spacecraft configurations aiming for optical tomography.

3-D/4_d tomography↗
NASA NTRS2014

Elastic Model Transitions: A Hybrid Approach Utilizing Quadratic Inequality Constrained Least Squares (LSQI) and Direct Shape Mapping (DSM)

A method for transitioning linear time invariant (LTI) models in time varying simulation is proposed that utilizes a hybrid approach for determining physical displacements by augmenting the original quadratically constrained least squares (LSQI) algorithm with Direct Shape Mapping (DSM) and modifying the energy constraints. The approach presented is applicable to simulation of the elastic behavior of launch vehicles and other structures that utilize discrete LTI finite element model (FEM) derived mode sets (eigenvalues and eigenvectors) that are propagated throughout time. The time invariant nature of the elastic data presents a problem of how to properly transition elastic states from the prior to the new model while preserving motion across the transition and ensuring there is no truncation or excitation of the system. A previous approach utilizes a LSQI algorithm with an energy constraint to effect smooth transitions between eigenvector sets with no requirement that the models be of similar dimension or have any correlation. This approach assumes energy is conserved across the transition, which results in significant non-physical transients due to changing quasi-steady state energy between mode sets, a phenomenon seen when utilizing a truncated mode set. The computational burden of simulating a full mode set is significant so a subset of modes is often selected to reduce run time. As a result of this truncation, energy between mode sets may not be constant and solutions across transitions could produce non-physical transients. In an effort to abate these transients an improved methodology was developed based on the aforementioned approach, but this new approach can handle significant changes in energy across mode set transitions. It is proposed that physical velocities due to elastic behavior be solved for using the LSQI algorithm, but solve for displacements using a two-step process that independently addresses the quasi-steady-state and non-steady-state contributions to the elastic displacement. For structures subject to large external forces, such as thrust or atmospheric drag, it is imperative to capture these forces when solving for elastic displacement. To simplify the mathematical formulation, assumptions are made regarding mass matrix normalization, constant external forcing, and constant viscous damping. These simplifications allow for direct solutions to the quasi-steady-state displacements through a process titled Direct Shape Mapping. DSM solves for the displacements using the eigenvalues of the elastic modes and the external forcing and returns a set of elastic displacements dictated by the eigenvectors of the post-transition mode set. For the non-steady-state contributions to displacement we formulate a LSQI problem that is constrained by energy of the non-steady state terms. The contributions from the quasi-steady-state and non-steady state solutions are then combined to obtain the physical displacements associated with the new set of eigenvectors. Results for the LSQI-DSM approach show significant reduction/complete removal of transients across mode set transitions while maintaining elastic motion from the prior state. For time propagation applications employing discrete elastic models that need to be transitioned in time and where running with full a full mode set is not feasible, the method developed offers a practical solution to simulating vehicle elasticity.

Hannan, Mike R.↗
DOE OSTI2025

A Perspective on Multiscale Modeling of Explicit Solvation-Enabled Simulations of Catalysis at Liquid–Solid Interfaces

Catalysis at liquid-solid interfaces is profoundly influenced by the interfacial solvent structure, which affects catalytic activity, selectivity, and reaction pathways. This perspective discusses state-of-the-art multiscale modeling methods that integrate quantum mechanics and molecular mechanics approaches to apply explicit solvent molecules to capture these interfacial phenomena. Specifically, the construction of multiscale models, the importance of capturing the interfacial solvent structure, and the computational strategies used to achieve this are explored, and the challenges in balancing chemical accuracy with computational expense are highlighted. Additionally, this perspective addresses the limitations of current methods. Opportunities for integrating machine learning are proposed. Here, by advancing the efficiency and user friendliness of multiscale modeling, it is argued that deeper insights into heterogeneous catalysis in liquid phases can be provided, which will ultimately contribute to the development of more efficient catalytic processes.

Ab initio molecular dynamics↗