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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 451 records · Page 25
All sourcesNASA NTRSDOE OSTI
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TPSAS-NF1676L-32030-DND

Composite structures are often difficult to inspect due to the anisotropic nature of the material systems and the range of flaws and defects that can arise in the manufacturing process. NASA?s Advanced Composites Project, a public-private partnership between government, universities and industry, seeks to address improved methods, tools, and protocols to reduce the development and certification timeline for composite materials and structures. The rapid inspection of composites is one of the three focused research areas of the project. One deliverable of the project is to develop an NDE Methods and Capabilities Handbook. This Handbook provides a publically available guidance document that facilitates the selection of appropriate NDE techniques and provides recommended protocols for detecting and characterizing common flaw types in solid laminate polymer matrix composite (PMC) structures. The Handbook will reduce the time required to develop qualified inspection processes for composite aircraft structures during the development, certification, and manufacturing phases by providing a reference that helps minimize trial and error and provides guidance on best practices, techniques, and settings, for specific flaw types and geometries. The Handbook will include an NDE Guidance Matrix that provides an applicability rating for NDE techniques as they apply to given flaw types. NDE techniques will include, but is not limited to ultrasound, laser based ultrasound, infrared thermography, and x-ray CT. Flaw types will include, but are not limited to porosity, delamination, voids, AFP defects and impact damage. The Handbook will contain details that support the applicability rating including, but not limited to, specimen details, inspection parameters, data analysis techniques, inspection efficiency (speed & cost), and limitations. This presentation will describe key Handbook activities with examples of the techniques and flaw types examined by the Advanced Composite Consortium members.

Patricia A Howell↗
DOE OSTI2018

Matrix Methods for Solving Hartree-Fock Equations in Atomic Structure Calculations and Line Broadening

Atomic structure of N-electron atoms is often determined by solving the Hartree-Fock equations, which are a set of integro-differential equations. The integral part of the Hartree-Fock equations treats electron exchange, but the Hartree-Fock equations are not often treated as an integro-differential equation. The exchange term is often approximated as an inhomogeneous or an effective potential so that the Hartree-Fock equations become a set of ordinary differential equations (which can be solved using the usual shooting methods). Because the Hartree-Fock equations are an iterative-refinement method, the inhomogeneous term relies on the previous guess of the wavefunction. In addition, there are numerical complications associated with solving inhomogeneous differential equations. This work uses matrix methods to solve the Hartree-Fock equations as an integro-differential equation. It is well known that a derivative operator can be expressed as a matrix made of finite-difference coefficients; energy eigenvalues and eigenvectors can be obtained by using linear-algebra packages. The integral (exchange) part of the Hartree-Fock equation can be approximated as a sum and written as a matrix. The Hartree-Fock equations can be solved as a matrix that is the sum of the differential and integral matrices. We compare calculations using this method against experiment and standard atomic structure calculations. This matrix method can also be used to solve for free-electron wavefunctions, thus improving how the atoms and free electrons interact. This technique is important for spectral line broadening in two ways: it improves the atomic structure calculations, and it improves the motion of the plasma electrons that collide with the atom.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS2000

GENOA-PFA: Progressive Fracture in Composites Simulated Computationally

GENOA-PFA is a commercial version of the Composite Durability Structural Analysis (CODSTRAN) computer program that simulates the progression of damage ultimately leading to fracture in polymer-matrix-composite (PMC) material structures under various loading and environmental conditions. GENOA-PFA offers several capabilities not available in other programs developed for this purpose, making it preferable for use in analyzing the durability and damage tolerance of complex PMC structures in which the fiber reinforcements occur in two- and three-dimensional weaves and braids. GENOA-PFA implements a progressive-fracture methodology based on the idea that a structure fails when flaws that may initially be small (even microscopic) grow and/or coalesce to a critical dimension where the structure no longer has an adequate safety margin to avoid catastrophic global fracture. Damage is considered to progress through five stages: (1) initiation, (2) growth, (3) accumulation (coalescence of propagating flaws), (4) stable propagation (up to the critical dimension), and (5) unstable or very rapid propagation (beyond the critical dimension) to catastrophic failure. The computational simulation of progressive failure involves formal procedures for identifying the five different stages of damage and for relating the amount of damage at each stage to the overall behavior of the deteriorating structure. In GENOA-PFA, mathematical modeling of the composite physical behavior involves an integration of simulations at multiple, hierarchical scales ranging from the macroscopic (lamina, laminate, and structure) to the microscopic (fiber, matrix, and fiber/matrix interface), as shown in the figure. The code includes algorithms to simulate the progression of damage from various source defects, including (1) through-the-thickness cracks and (2) voids with edge, pocket, internal, or mixed-mode delaminations.

Murthy, Pappu L. N.↗
DOE OSTI2018

Structure and crystallography of martensite–austenite constituent in the intercritically reheated coarse-grained heat affected zone of a high strength pipeline steel

Highlights: • Structure and crystallography of M-A constituent in ICCGHAZ of X100 weld joint was studied via multi-scale characterization. • Majority of M-A constituent preferred to form lamellar lath structure, which primarily consisted of lath martensite (87%). • The retained austenite had K-S orientation relationship with its neighboring martensite. • Adjacent martensite laths within M-A had large misorientation but no fixed crystallographic orientation relationship. • Martensite laths within the M-A constituent did not inherit the crystallographic orientation of the parent matrix. - Abstract: The structure and crystallography of martensite-austenite (M-A) constituent in the intercritically reheated coarse-grained heat affected zone (ICCGHAZ) of X100 (690 MPa) pipeline steel weld joint was studied via multi-scale characterization. The results suggested that majority of the necklace-type M-A constituent in the ICCGHAZ preferred to form lamellar lath structure, which primarily consisted of lath martensite (87%). Only small fraction of retained austenite (9%) was found between martensite laths. The retained austenite had K-S orientation relationship with its neighboring martensite: (10-1){sub M} // (11-1){sub γ} and [111]{sub M} // [011]{sub γ}. Adjacent martensite laths within M-A constituent had large misorientation but no fixed crystallographic orientation relationship which implied that martensite laths may nucleate independently and encounter with each other during growth. M-A constituent and matrix microstructure belonged to different prior austenite grains. The martensite laths within the M-A constituent did not inherit the crystallographic orientation of the parent matrix during the intercritical reheating and subsequent cooling process of the second pass welding.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Predictive machine learning approaches for the microstructural behavior of multiphase zirconium alloys

Abstract Zirconium alloys are widely used in harsh environments characterized by high temperatures, corrosivity, and radiation exposure. These alloys, which have a hexagonal closed packed (h.c.p.) structure thermo-mechanically degrade, when exposed to severe operating environments due to hydride formation. These hydrides have a different crystalline structure, than the matrix, which results in a multiphase alloy. To accurately model these materials at the relevant physical scale, it is necessary to fully characterize them based on a microstructural fingerprint, which is defined here as a combination of features that include hydride geometry, parent and hydride texture and crystalline structure of these multiphase alloys. Hence, this investigation will develop a reduced order modeling approach, where this microstructural fingerprint is used to predict critical fracture stress levels that are physically consistent with microstructural deformation and fracture modes. Machine Learning (ML) methodologies based on Gaussian Process Regression, random forests, and multilayer perceptrons (MLP) were used to predict material fracture critical stress states. MLPs, or neural networks, had the highest accuracy on held-out test sets across three predetermined strain levels of interest. Hydride orientation, grain orientation or texture, and hydride volume fraction had the greatest effect on critical fracture stress levels and had partial dependencies that were highly significant, and in comparison hydride length and hydride spacing have less effects on fracture stresses. Furthermore, these models were also used accurately predicted material response to nominal applied strains as a function of the microstructural fingerprint.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Thermal fluctuations and carrier localization induced by dynamic disorder in MAPbI 3 described by first-principles based tight-binding model

Halide perovskites are strongly influenced by large amplitude anharmonic lattice fluctuations at room temperature. We develop a tight binding model for dynamically disordered MAPbI$_3$ based on density functional theory (DFT) calculations to calculate electronic structure for finite temperature crystal structures at the length scale of thermal disorder and carrier localization. The model predicts individual Hamiltonian matrix elements and band structures with high accuracy, owing to the inclusion of additional matrix elements and descriptors for non-Coulombic interactions. We apply this model to electronic structure at length and time scales inaccessible to first principles methods, finding an increase in band gap, carrier mass, and the sub-picosecond fluctuations in these quantities with increasing temperature as well as the onset of carrier localization in large supercells induced by thermal disorder at 300 K. Finally, we identify the length scale $L^*= 5$ nm as the onset of localization in the electronic structure, associated with associated with decreasing band edge fluctuations, increasing carrier mass, and Rashba splitting approaching zero.

36 MATERIALS SCIENCE↗
NASA NTRS1992

Sparse Matrices in MATLAB: Design and Implementation

The matrix computation language and environment MATLAB is extended to include sparse matrix storage and operations. The only change to the outward appearance of the MATLAB language is a pair of commands to create full or sparse matrices. Nearly all the operations of MATLAB now apply equally to full or sparse matrices, without any explicit action by the user. The sparse data structure represents a matrix in space proportional to the number of nonzero entries, and most of the operations compute sparse results in time proportional to the number of arithmetic operations on nonzeros.

Gilbert, John R.↗
NASA NTRS2021

Latent Cure Epoxy Resins for Reliable Joints in Secondary-Bonded Composite Structures

In high-performance polymer matrix composite assemblies, adhesive bonding is generally superior to mechanical fastening in structural performance and manufacturing efficiency. However, adhesive bonds are susceptible to minute levels of contamination accumulated during assembly that can lead to unpredictable, weak bonds. Current methods of measuring bond strength are all destructive mechanical tests. To overcome these challenges, redundant load paths (e.g., mechanical fasteners) are often implemented in secondary-bonded, primary-structures, which can greatly reduce structural performance. This study investigated reformulated aerospace epoxy matrix resins with stoichiometric offset to inhibit cure of the matrix resin prior to assembly. Inhibited resins can reflow and mix across the joint interface, which eliminates the material discontinuity and forms a homogenous joint with reliable fracture properties. The goal of this study was to develop and demonstrate secondary composite assemblies that are mechanically and microscopically indistinguishable from a co-cured composite joint. This article describes the development of latent epoxy resins, the fabrication of test articles, and the mechanical properties measured from experimental joints compared with conventional, co-cured laminates. Methods of in-line quality control using and infrared spectroscopy and post-assembly forensics are also described. The final mode-II fracture toughness measured from precracked AERoBOND specimens was similar to that measured from co-cured laminates indicating that later cure epoxy materials could be a suitable replacement for secondary bonding.

Polymer-matrix composites (PMCs)↗
DOE OSTI2019

Algorithms and algebraic solutions of decay chain differential equations for stable and unstable nuclide fractionation

Radioactive decay processes, such as alpha decay, produce decay chains where the mass numbers of nuclides decrease as larger nuclides expel energetic particles to form smaller nuclides. Under these conditions, the coefficient matrix that describes the differential rate expressions for radioactive decay can be made lower triangular. With this special structure, formulating an algebraic solution to the decay chains can be done by first formulating the eigenvectors that make up the coefficient matrix, which can then be solved using forward substitution for a lower triangular matrix. This work details the derivation of algebraic solutions for decay chains of any number of stable and unstable nuclides with any number of branching based on this eigenvector analysis. A prototype computational code was developed to validate and compare this methodology against a number of other methods for solving similar systems. A two-phase sorting algorithm yielding the lower triangular matrix structure was established to apply the developed algebraic solutions for decay chains involving beta-emitting radionuclides transformed into daughter nuclides without change in their mass number. In conclusion, the methodologies produced in this work provide an efficient way to estimate nuclide fractions from natural decay processes.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1995

The strength of a calcified tissue depends in part on the molecular structure and organization of its constituent mineral crystals in their organic matrix

High-voltage electron-microscopic tomographic (3D) studies of the ultrastructural interaction between mineral and organic matrix in a variety of calcified tissues reveal different crystal structural and organizational features in association with their respective organic matrices. In brittle or weak pathologic or ectopic calcifications, including examples of osteogenesis imperfecta, calciphylaxis, calcergy, and dermatomyositis, hydroxyapatite crystals occur in various sizes and shapes and are oriented and aligned with respect to collagen in a manner which is distinct from that found in normal calcified tissues. A model of collagen-mineral interaction is proposed which may account for the observed crystal structures and organization. The results indicate that the ultimate strength, support, and other mechanical properties provided by a calcified tissue are dependent in part upon the molecular structure and arrangement of its constituent mineral crystals within their organic matrix.

Non-NASA Center↗
DOE OSTI2016

Exopolysaccharide microchannels direct bacterial motility and organize multicellular behavior

The myxobacteria are a family of soil bacteria that form biofilms of complex architecture, aligned multilayered swarms or fruiting body structures that are simple or branched aggregates containing myxospores. Here, we examined the structural role of matrix exopolysaccharide (EPS) in the organization of these surface-dwelling bacterial cells. Using time-lapse light and fluorescence microscopy, as well as transmission electron microscopy and focused ion beam/scanning electron microscopy (FIB/SEM) electron microscopy, we found that Myxococcus xanthus cell organization in biofilms is dependent on the formation of EPS microchannels. Cells are highly organized within the three-dimensional structure of EPS microchannels that are required for cell alignment and advancement on surfaces. Mutants lacking EPS showed a lack of cell orientation and poor colony migration. Purified, cell-free EPS retains a channel-like structure, and can complement EPS - mutant motility defects. In addition, EPS provides the cooperative structure for fruiting body formation in both the simple mounds of M. xanthus and the complex, tree-like structures of Chondromyces crocatus . We furthermore investigated the possibility that EPS impacts community structure as a shared resource facilitating cooperative migration among closely related isolates of M. xanthus .

59 BASIC BIOLOGICAL SCIENCES↗
NASA NTRS1988

Structural analyses of engine wall cooling concepts and materials

The severe thermal environments under which hypersonic aircraft such as the National Aerospace Plane (NASP) will operate require cooling of the engine walls, especially in the combustor. A preliminary assessment is made of some candidate materials based on structural analyses for a number of convective cooling configurations. Three materials were studied: graphite/copper and tungsten/copper composite alloys with 50 percent fiber volume fractions and a wrought cobalt-base superalloy, Haynes 188. Anisotropic mechanical and thermal properties for the composites were obtained from a computer code, ICAN, which determines the composite material properties from the individual properties of the fiber and matrix materials. The structural analyses were performed by using the MARC nonlinear finite element code. Heat transfer analyses were conducted to calculate the metal temperature distributions.

Kaufman, Albert↗
NASA NTRS2016

Optimization of a Hot Structure Aeroshell and Nose Cap for Mars Atmospheric Entry

The National Aeronautics and Space Administration (NASA) is preparing to send humans beyond Low Earth Orbit and eventually to the surface of Mars. As part of the Evolvable Mars Campaign, different vehicle configurations are being designed and considered for delivering large payloads to the surface of Mars. Weight and packing volume are driving factors in the vehicle design, and the thermal protection system (TPS) for planetary entry is a technology area which can offer potential weight and volume savings. The feasibility and potential benefits of a ceramic matrix composite hot structure concept for different vehicle configurations are explored in this paper, including the nose cap for a Hypersonic Inflatable Aerodynamic Decelerator (HIAD) and an aeroshell for a mid lift-to-drag (Mid L/D) concept. The TPS of a planetary entry vehicle is a critical component required to survive the severe aerodynamic heating environment during atmospheric en- try. The current state-of-the-art is an ablative material to protect the vehicle from the heat load. The ablator is bonded to an underlying structure, which carries the mechanical loads associated with entry. The alternative hot structure design utilizes an advanced carbon-carbon material system on the outer surface of the vehicle, which is exposed to the severe heating and acts as a load carrying structure. The preliminary design using the hot structure concept and the ablative concept is determined for the spherical nose cap of the HIAD entry vehicle and the aeroshell of the Mid L/D entry vehicle. The results of the study indicate that the use of hot structures for both vehicle concepts leads to a feasible design with potential weight and volume savings benefits over current state-of-the-art TPS technology that could enable future missions.

Langston, Sarah L.↗
DOE OSTI2017

Fabrication of Au 25 (SG) 18 –ZIF-8 Nanocomposites: A Facile Strategy to Position Au 25 (SG) 18 Nanoclusters Inside and Outside ZIF-8

Multifunctional composite materials are currently highly desired for sustainable energy applications. A general strategy to integrate atomically precise Au 25 (SG) 18 with ZIF-8 (Zn(MeIm) 2 , MeIm = 2-methylimidazole), is developed in this paper via the typical Zn-carboxylate type of linkage. Au 25 (SG) 18 are uniformly encapsulated into a ZIF-8 framework (Au 25 (SG) 18 @ZIF-8) by coordination-assisted self-assembly. In contrast, Au 25 (SG) 18 integrated by simple impregnation is oriented along the outer surface of ZIF-8 (Au 25 (SG) 18 /ZIF-8). The porous structure and thermal stability of these nanocomposites are characterized by N 2 adsorption–desorption isothermal analysis and thermal gravimetric analysis. The distribution of Au 25 (SG) 18 in the two nanocomposites is confirmed by electron microscopy, and the accessibility of Au 25 (SG) 18 is evaluated by the 4-nitrophenol reduction reaction. The as-prepared nanocomposites retain the high porosity and thermal stability of the ZIF-8 matrix, while also exhibiting the desired catalytic and optical properties derived from the integrated Au 25 (SG) 18 nanoclusters (NCs). Au 25 (SG) 18 @ZIF-8 with isolated Au 25 sites is a promising heterogenous catalyst with size selectivity imparted by the ZIF-8 matrix. Finally, the structural distinction between Au 25 (SG) 18 @ZIF-8 and Au 25 (SG) 18 /ZIF-8 determines their different emission features, and provides a new strategy to adjust the optical behavior of Au 25 (SG) 18 for applications in bioimaging and biotherapy.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Mechanical and Thermal Properties of Irradiated SiC/SiC Composites: Bridge Continuum Models With Atomic-level Simulations

Due to their excellent high-temperature fracture, creep, corrosion, and thermal shock resistance in addition to their high thermo-chemical stability, reduced activation, and low radiation- induced after heat, silicon carbide-fiber/silicon carbide-matrix (SiC/SiC) composites are being developed as structural materials for first wall and breeder blanket applications in advanced fusion power plants. In such applications these materials will be subjected to a high heat flux that imposes extremely stringent requirements on the minimum thermal conductivity needed. Also, SiC offers a number of potential applications for both electron devices and structural components as an inert matrix for the transmutation of plutonium and as cladding material for gas-cooled fission reactor. There has been a rapid growth of activity in the experimental study and the modeling of energetic-beam interactions, such as those encountered in ion-beam processing or in irradiation environments, on the structure and properties of SiC. During the last decade, understanding the basics of ion-solid interaction and irradiation damage has led to significant developments in state-of-the-art atomic-level, meso-scale simulations and continuum models of mechanical and thermal property prediction, and these different scales studies have dramatically advanced the understanding of defect and defect processes in a number of materials, ranging from metals to semiconductors to insulators. Recent progress in multi-scale simulations of fundamental ion-solid interactions, defect generation and defect evolution in SiC, as well as its property degradation under irradiation, is reviewed, which will provide significant insights into the radiation resistance behavior of SiC and SiC/SiC composites. (authors)

36 MATERIALS SCIENCE↗
DOE OSTI2018

Stabilization of dinitrosyl iron complexes under matrix isolation conditions: solvent and polymer effects on the synthesis of composites based on poly(methyl methacrylate) and iron complexes [Fe{sub 2}(μ-NCS-R){sub 2}(NO){sub 4}]

Homogeneous composites based on poly(methyl methacrylate) and its copolymers with methacrylic acid and on the nitrosyl iron complexes with 2-mercaptobenzimidazole and 2-mercaptobenzthiazole were synthesized. An analysis of the experimental data obtained by the methods of small-angle X-ray diffraction and SQUID magnetometry in combination with the results of quantum chemical calculations showed that the nitrosyl complexes did not retain their initial binuclear structure under the matrix isolation conditions: some complexes decompose to mononuclear ones. The percentage ratio of the dimers and monomers depends on the fraction of the methacrylic acid copolymer in the polymeric matrix and is almost independent of the type of thiol ligand in the iron complex.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1989

Mini-mast dynamic analysis using the truss-beam model

The Mini-Mast is a generic space truss designed by Astro Aerospace Corp. A 210 meter truss located in the Structural Dynamics research Lab of NASA Langley is used in comprehensive active vibration control experiments on a realistic large space structure. Some predictions of the natural frequencies and mode shapes were made based on the Finite Element model. The purpose here is to use the Truss-Beam model developed by Elias G. Abu-Saba to predict the natural frequencies of the Mini-Mast and then compare the results with those obtained from the FE model. Imperfections of the joints are modeled, and joint contribution to the flexibility matrix of the structure is noted. The natural frequencies are obtained. An iterative procedure is used to enhance the Truss-Beam model by comparing these results with experimental ones.

Abu-Saba, Elias G.↗
DOE OSTI2026

Effects of Cooling Rates on Self-Reinforced Polyethylene Composites via Multiscale Experimental Characterizations

This study investigates cooling rate effects on self-reinforced polyethylene composites (PE-SRCs), focusing on macroscopic thermal and mechanical properties, and micro- to sub-micron morphologies. Unlike conventional fiber-reinforced composites (e.g., carbon and glass fiber based), cooling rate effects on SRCs remain less studied. PE-SRCs were fabricated from ultrahigh molecular weight polyethylene (UHMWPE) fabric and high-density polyethylene (HDPE) matrix with cooling rates from 0.76°C/min to 425°C/min. Tensile properties, including modulus (~9.5 GPa), strength (~360 MPa), and ultimate elongation (~6%), showed no significant cooling rate dependence. However, thermal analysis revealed melting temperature of HDPE matrix decreased from ~130°C to ~126.5°C with total crystallinity reducing from 84% to 75%. Wide-angle X-ray scattering confirmed decreasing crystallinity but at lower values (67%–59%), as thermal analysis might overestimate crystallinity. Small-angle X-ray scattering showed long period decreased from 24.3 to 17.4 nm, attributed to thinner lamellae and closer packing, suggesting limited crystal growth and faster nucleation. While cooling rates alter melting point and crystalline structures of HDPE matrix, these changes do not translate to substantial impact on macroscale mechanical properties of PE-SRCs. This insensitivity might be related to low interfacial shear strength at PE/PE interfaces, enabling process optimization while maintaining mechanical performance.

Cooling rate↗