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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 847 records · Page 47
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

Synthetic diagnostics platform for fusion plasmas (invited)

A Synthetic Diagnostics Platform (SDP) for fusion plasmas has been developed which provides state of the art synthetic reflectometry, beam emission spectroscopy, and Electron Cyclotron Emission (ECE) diagnostics. Interfaces to the plasma simulation codes GTC, XGC-1, GTS, and M3D-C{sup 1} are provided, enabling detailed validation of these codes. In this paper, we give an overview of SDP’s capabilities, and introduce the synthetic diagnostic modules. A recently developed synthetic ECE Imaging module which self-consistently includes refraction, diffraction, emission, and absorption effects is discussed in detail. Its capabilities are demonstrated on two model plasmas. The importance of synthetic diagnostics in validation is shown by applying the SDP to M3D-C{sup 1} output and comparing it with measurements from an edge harmonic oscillation mode on DIII-D.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2025

X-ray diffraction strains in laser-ablated aluminum, nickel, sodium, and invar: Pressures to 475 GPa

Dynamically compressed materials in longitudinal waves are described by two physical models: hydrostatic pressure, with equal, normal, principal stresses or material uniaxially strained in the wave propagation direction. These models are disparate, so experimental comparisons and evaluations are important. Polycrystalline material in a state of hydrostatic pressure will have no eccentricity of x-ray-diffracted Debye–Scherrer rings. A general three-dimensional solution of Bragg diffracted x rays based on principal crystallographic strains in the compression wave was found. The distortion of x-ray diffraction beams has been used for strain measurements; the analysis developed incorporates a strained reciprocal lattice and the incident x-ray beam. Strain-distorted Polanyi surfaces form an annulus of compression with an ellipsoid of revolution in reciprocal space, which is intersected by Ewald's sphere for Bragg diffraction. The in situ measurements for strain describe nanosecond diffraction evaluated using two planes, (hkl) and (h′k′l′), both in the same crystallographic phase. Diffraction from Al, Ni, Na, and Invar quantifies the compression axial strains in these materials: The compression axial ratios are 0.65, 1.05, 0.88, and 1.58 at pressures of 291, 402, 409, and 367 GPa for the respective materials. Crystal structure transformations with homogeneous pressurized stresses, mandating equal normal strains, should not be anticipated to agree with heterogeneous, uniaxially strained, and sheared crystalline phases. Measurements support in-plane strains increasing with pressure, p , in fcc and hcp aluminum as ε 22 = −0.21 p /TPa.

Alloys↗
NASA NTRS2019

Advanced Diffractive MetaFilm Sailcraft

A fast-tracked multifaceted approach that integrated NASA, industry, and academia was successfully executed to advance the novel concept of radiation pressure by means of a thin diffractive film. This pioneering new approach to light sailing was found to offer advantages over reflective sails - especially for missions that include close orbits or a close fly-by of the sun.The research effort included experiments, numerical modeling, and an "incubator meeting" that brought together over 35 researchers and stakeholders to uncover some of the most feasible means of advancing both the TRL and mission capabilities of diffractive sailcraft. One of the outcomes of the incubator meeting was to focus this Phase I research on a solar polar orbiter mission for heliophysics experiments. NASA decadal surveys and other reports have repeatedly pointed out that scientists have only a paucity of information about the sun beyond the ecliptic plane. The TRL has been advanced from 1 to 3 during this Phase I research with the help of experiments that have verified the predicted force and mechanical control afforded by diffractive sails. Knowledge gained from the experiments and numerical models was not only disseminated in peer reviewed publications and conferences, but it also resulted in a patent disclosure.

Diffractive↗
DOE OSTI2024

Data-driven discovery of dynamics from time-resolved coherent scattering

Coherent X-ray scattering (CXS) techniques are capable of interrogating dynamics of nano- to mesoscale materials systems at time scales spanning several orders of magnitude. However, obtaining accurate theoretical descriptions of complex dynamics is often limited by one or more factors—the ability to visualize dynamics in real space, computational cost of high-fidelity simulations, and effectiveness of approximate or phenomenological models. In this work, we develop a data-driven framework to uncover mechanistic models of dynamics directly from time-resolved CXS measurements without solving the phase reconstruction problem for the entire time series of diffraction patterns. Our approach uses neural differential equations to parameterize unknown real-space dynamics and implements a computational scattering forward model to relate real-space predictions to reciprocal-space observations. This method is shown to recover the dynamics of several computational model systems under various simulated conditions of measurement resolution and noise. Moreover, the trained model enables estimation of long-term dynamics well beyond the maximum observation time, which can be used to inform and refine experimental parameters in practice. Finally, we demonstrate an experimental proof-of-concept by applying our framework to recover the probe trajectory from a ptychographic scan. Our proposed framework bridges the wide existing gap between approximate models and complex data.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Slip localization behavior at triple junctions in nickel-base superalloys

Incipient slip localization in the vicinity of hundreds of grain boundary triple junctions (TJs) in a lightly deformed nickel-base superalloy IN718 is studied using a combination of three-dimensional (3D) crystal plasticity finite element (CPFE) modeling, high resolution digital image correlation (HR-DIC) and 3D electron back-scatter diffraction tomography (3D EBSD). A 3D reconstruction method enables identification of thousands of TJs and correspondence of any observed slip bands with their originating TJ lines below the specimen surface. Here, we present a large-scale CPFE model of the experimental 3D microstructure composed of high-fidelity representation of the TJ lines and the boundaries and interiors of the parent grains and use it to calculate the local micromechanical response and slip activity of all TJs at the onset of macroscopic yielding. Statistical analysis of the calculated quantities reveal TJs develop larger stress concentration and grain-average re-orientation than grain interiors and grain boundaries, however no substantial differences in cumulative slip were found among these microstructural regions. We find that TJs with observed slip bands generate lower grain-average re-orientation, fewer active slip systems, and more localized slip on a single system than those without. The distinctions in the reorientation and slip activity are stronger in TJs that experience more intense slip.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Analysis of microstructural facet fatigue failure in ultra-fine grained powder metallurgy Ti-6Al-4V produced through hydrogen sintering

The hydrogen sintering and phase transformation (HSPT) process is a powder metallurgy method that produces Ti-6Al-4V with fatigue properties rivaling wrought processed Ti-6Al-4V. Previous fatigue work on HSPT Ti-6Al-4V has shown failure to be frequently caused by microstructural facets, which were believed to be grain boundary (GB) α phase. This belief conflicts with other reports as fatigue failure typically occurs across α colonies or primary α grains, not GB α. In this work, electron backscattered diffraction is used to identify these facets as GB α. Furthermore, a simple geometric model predicting the effective slip length of GB α is presented.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Formation of solitary zonal structures via the modulational instability of drift waves

{\rtf1\ansi\ansicpg1252\cocoartf1561\cocoasubrtf600{\fonttbl\f0\fswiss\fcharset0 Helvetica;}{\colortbl;\red255\green255\blue255;\red0\green0\blue0;}{\*\expandedcolortbl;;\cssrgb\c0\c0\c0;}\margl1440\margr1440\vieww10800\viewh8400\viewkind0\pard\tx887\tx1775\tx2662\tx3550\tx4438\tx5325\tx6213\tx7101\tx7988\tx8876\tx9764\tx10651\tx11539\tx12427\tx13314\tx14202\tx15090\tx15977\tx16865\tx17753\tx18640\tx19528\tx20416\tx21303\tx22191\tx23079\tx23966\tx24854\tx25742\tx26629\tx27517\tx28405\tx29292\tx30180\tx31067\tx31955\tx32843\tx33730\tx34618\tx35506\tx36393\tx37281\tx38169\tx39056\tx39944\tx40832\tx41719\tx42607\tx43495\tx44382\tx45270\tx46158\tx47045\tx47933\tx48821\tx49708\tx50596\tx51484\tx52371\tx53259\tx54147\tx55034\tx55922\tx56810\tx57697\tx58585\tx59472\tx60360\tx61248\tx62135\tx63023\tx63911\tx64798\tx65686\tx66574\tx67461\tx68349\tx69237\tx70124\tx71012\tx71900\tx72787\tx73675\tx74563\tx75450\tx76338\tx77226\tx78113\tx79001\tx79889\tx80776\tx81664\tx82552\tx83439\tx84327\tx85215\tx86102\tx86990\tx87877\tx88765\slleading20\pardirnatural\partightenfactor0\f0\fs38 \cf2 The dynamics of the radial envelope of a weak coherent drift wave is approximately governed by a nonlinear Schr\'f6dinger equation, which emerges as a limit of the modified Hasegawa\'97Mima equation. The nonlinear Schr\'f6dinger equation has well-known soliton solutions, and its modulational instability can naturally generate solitary structures. In this paper, we demonstrate that this simple model can adequately describe the formation of solitary zonal structures in the modified Hasegawa\'97Mima equation, but only when the amplitude of the coherent drift wave is relatively small. At larger amplitudes, the modulational instability produces stationary zonal structures instead. Furthermore, we find that incoherent drift waves with beam-like spectra can also be modulationally unstable to the formation of solitary or stationary zonal structures, depending on the beam intensity. Notably, we show that these drift waves can be modeled as quantumlike particles (\'93driftons\'94) within a recently developed phase-space (Wigner\'97Moyal) formulation, which intuitively depicts the solitary zonal structures as quasi-monochromatic drifton condensates. Quantumlike effects, such as diffraction, are essential to these condensates; hence, the latter cannot be described by wave-kinetic models that are based on the ray approximation.\}

Solitons↗
NASA NTRS2024

CODEX Optical Design and Alignment

The COronal Diagnostic EXperiment (CODEX) is a Heliophysics mission to measure the density, temperature, and velocity of the electrons in the solar corona with the primary goal of improving our understanding of the physical conditions of the solar wind in the acceleration region. The temperature and velocity measurement requires much higher signal-to-noise ratio than the density measurements. In solar coronagraphs, the diffraction of the solar disk light due to the occulting element is the dominant source of noise. Therefore, to further suppress the diffracted sun light with respect to the existing coronagraphs is a critical element of the CODEX design. To minimize the stray light due to diffraction, the selected optical design is a two-stage standard coronagraph with an external occulter, an internal occulter, and a Lyot stop. What is unique for this design is that a focal mask was inserted at the telescope focal plane. It works together with the field lens suppressing the stray light down by ~ another order of magnitude as compared to a traditional three-stage approach. During the optical design, a Fourier Transform based beam propagation software, i.e., GLAD, was used to model the beam path through the full coronagraph, from the external occulter to the detector array. All diffraction sensitive elements: external occulter, internal occulter, focal mask, and Lyot stop were carefully modeled and optimized. As a result, the requirement of achieving a stray light level which is one order of magnitude lower than F-corona was satisfied. On the other hand, to achieve the final suppression, a precision optical alignment is another must. This paper also presents our creative alignment procedure: using the combination of metrology, precision alignment equipment, and real time diffraction ring monitoring to minimize the diffraction. The final test results show that the suppression ratio (B/B 0 ) reaches 10 -11 level, which is equivalent to one order of magnitude lower than F-corona.

CODEX optical design and alignment↗
DOE OSTI2016

Waveform inversion of acoustic waves for explosion yield estimation

We present a new waveform inversion technique to estimate the energy of near-surface explosions using atmospheric acoustic waves. Conventional methods often employ air blast models based on a homogeneous atmosphere, where the acoustic wave propagation effects (e.g., refraction and diffraction) are not taken into account, and therefore, their accuracy decreases with increasing source-receiver distance. In this study, three-dimensional acoustic simulations are performed with a finite difference method in realistic atmospheres and topography, and the modeled acoustic Green's functions are incorporated into the waveform inversion for the acoustic source time functions. The strength of the acoustic source is related to explosion yield based on a standard air blast model. The technique was applied to local explosions (<10 km) and provided reasonable yield estimates (<~30% error) in the presence of realistic topography and atmospheric structure. In conclusion, the presented method can be extended to explosions recorded at far distance provided proper meteorological specifications.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗
DOE OSTI2020

Lattice strains and diffraction elastic constants of cubic polycrystals

In situ synchrotron X-ray and neutron diffraction experiments provide a powerful approach to measure lattice strains in bulk polycrystalline materials. They are being increasingly used for quantitative characterization of microscale deformation within and between grains and phases. Here we use a self-consistent micromechanics model to obtain a general analytic solution of the grain-level lattice strains and diffraction elastic constants for a broad class of elastically isotropic polycrystals with cubic crystal symmetry. This analytic solution reveals a direct linear relationship between the reciprocal of the elastic diffraction constant and the orientation index parameter along the direction of any diffraction vector, including tensile loading and transverse directions. The straightforward numerical implementation of this solution provides diffraction elastic constants for 26 representative cubic polycrystals. Finally, analytic solutions of this kind can serve to benchmark in situ diffraction measurements of lattice strains and also facilitate high-throughput studies of microscale stresses and diffraction elastic constants in polycrystalline materials.

36 MATERIALS SCIENCE↗
NASA NTRS1986

Analysis and measurement of electromagnetic scattering by pyramidal and wedge absorbers

By modifying the reflection coefficients in the Uniform Geometrical Theory of Diffraction a solution that approximates the scattering from a dielectric wedge is found. This solution agrees closely with the exact solution of Rawlins which is only valid for a few minor cases. This modification is then applied to the corner diffraction coefficient and combined with an equivalent current and geometrical optics solutions to model scattering from pyramid and wedge absorbers. Measured results from 12 inch pyramid absorbers from 2 to 18 GHz are compared to calculations assuming the returns add incoherently and assuming the returns add coherently. The measured results tend to be between the two curves. Measured results from the 8 inch wedge absorber are also compared to calculations with the return being dominated by the wedge diffraction. The procedures for measuring and specifying absorber performance are discussed and calibration equations are derived to calculate a reflection coefficient or a reflectivity using a reference sphere. Shaping changes to the present absorber designs are introduced to improve performance based on both high and low frequency analysis. Some prototypes were built and tested.

Dewitt, B. T.↗
DOE OSTI2021

Magnetic and electronic structures of antiferromagnetic topological material candidate EuMg 2 Bi 2

In this work, EuMg 2 Bi 2 has been investigated to understand the electronic and magnetic behaviors as an antiferromagnetic (AFM) topological semimetal candidate. High-quality single crystals of EuMg 2 Bi 2 were grown via a Bi flux and, subsequently, characterized to be consistent with the previously reported bulk magnetic and resistivity properties. A ferromagnetic interaction is indicated by the positive Curie–Weiss temperature obtained through fitting the bulk magnetic susceptibility data. The bulk resistivity measurements reveal an interesting electronic behavior that is potentially influenced by a competing antiferromagnetic and ferromagnetic interaction in and out of the ab plane. From the resulting refinement of the neutron diffraction data, EuMg 2 Bi 2 was found to exhibit an A-type magnetic structure with Eu 2+ moments ferromagnetically aligned in the plane and antiferromagnetically stacked between neighbor ferromagnetic Eu layers. The power law fitting magnetic ordering parameter below TN~8 K agrees with the 2D Heisenberg model, indicating a weak interlayer antiferromagnetic interaction. Considering the magnetic structure determined by neutron diffraction, the surface state calculation suggests that EuMg 2 Bi 2 is an AFM topological insulator candidate. Linearly dispersed Dirac surface states were also observed in our angle-resolved photoemission spectroscopy measurements, consistent with the calculation.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Coherent 3D nanostructure of γ-Al{sub 2}O{sub 3}: Simulation of whole X-ray powder diffraction pattern

The structure and nanostructure features of nanocrystalline γ-Al{sub 2}O{sub 3} obtained by dehydration of boehmite with anisotropic platelet-shaped particles were investigated. The original models of 3D coherent nanostructure of γ-Al{sub 2}O{sub 3} were constructed. The models of nanostructured γ-Al{sub 2}O{sub 3} particles were first confirmed by a direct simulation of powder X–Ray diffraction (XRD) patterns using the Debye Scattering Equation (DSE) with assistance of high-resolution transmission electron microscopy (HRTEM) study. The average crystal structure of γ-Al{sub 2}O{sub 3} was shown to be tetragonally distorted. The experimental results revealed that thin γ-Al{sub 2}O{sub 3} platelets were heterogeneous on a nanometer scale and nanometer-sized building blocks were separated by partially coherent interfaces. The XRD simulation results showed that a specific packing of the primary crystalline blocks in the nanostructured γ-Al{sub 2}O{sub 3} particles with formation of planar defects on (001), (100), and (101) planes nicely accounted for pronounced diffuse scattering, anisotropic peak broadening and peak shifts in the experimental XRD pattern. The identified planar defects in cation sublattice seem to be described as filling cation non-spinel sites in existing crystallographic models of γ-Al{sub 2}O{sub 3} structure. The overall findings provided an insight into the complex nanostructure, which is intrinsic to the metastable γ-Al{sub 2}O{sub 3} oxide. - Highlights: • Thin plate-like crystallites of γ-Al{sub 2}O{sub 3} were obtained. • Models of 3D coherent nanostructure of γ-Al{sub 2}O{sub 3} were constructed. • Models were verified by simulating XRD patterns using the Debye Scattering Equation. • Specific broadening of XRD peaks was explained in terms of planar defects. • Primary crystalline blocks in γ-Al{sub 2}O{sub 3} are separated by partially coherent interfaces.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

Scattering of radio frequency waves by blobs in tokamak plasmas

The density fluctuations and blobs present in the edge region of magnetic fusion devices can scatter radio frequency (RF) waves through refraction, reflection, diffraction, and coupling to other plasma waves. This, in turn, affects the spectrum of the RF waves and the electromagnetic power that reaches the core of the plasma. The usual geometric optics analysis of RF scattering by density blobs accounts for only refractive effects. It is valid when the amplitude of the fluctuations is small, of the order of 10%, compared to the background density. In experiments, density fluctuations with much larger amplitudes are routinely observed, so that a more general treatment of the scattering process is needed. In this paper, a full-wave model for the scattering of RF waves by a blob is developed. The full-wave approach extends the range of validity well beyond that of geometric optics; however, it is theoretically and computationally much more challenging. The theoretical procedure, although similar to that followed for the Mie solution of Maxwell's equations, is generalized to plasmas in a magnetic field. Besides diffraction and reflection, the model includes coupling to a different plasma wave than the one imposed by the external antenna structure. In the model, it is assumed that the RF waves interact with a spherical blob. The plasma inside and around the blob is cold, homogeneous, and imbedded in a uniform magnetic field. After formulating the complete analytical theory, the effect of the blob on short wavelength electron cyclotron waves and longer wavelength lower hybrid waves is studied numerically.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2014

Higher fullerenes: Compositional analysis by EDXD and molecular dynamics

A carbon soot of higher fullerenes was studied by Energy Dispersive X-ray Diffraction (EDXD) aiming at defining the overall structure as accurately as possible to define the overall structure, without lengthy separation and purification procedures. EDXD pattern was compared with model curves obtained for single homogeneous fullerenes already crystallized and for the hypothesized C180. All fullerenes contribute to the overall experimental curve to different extents, with C96 giving the best agreement. The presence of even higher fullerenes is very likely, since the hypothesized C180 gives a very good match as well.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Crystal Plasticity Simulation of Magnesium and Its Alloys: A Review of Recent Advances

Slip and extension twinning are the dominant deformation mechanisms in Magnesium (Mg) and its alloys. Crystal plasticity is a powerful tool to study these deformation mechanisms. Different schemes have incorporated crystal plasticity models to capture different properties, which vary from the simple homogenization Taylor model to the full-scale crystal plasticity finite element model. In the current study, a review of works available in the literature that addresses different properties of Mg and its alloys using crystal plasticity modes is presented. In addition to slip and twinning, detwinning is another deformation mechanism that is activated in Mg and its alloys. The different models that capture detwinning will also be addressed here. Finally, the recent experimental frameworks, such as in-situ neutron diffraction, 3D high energy synchrotron X-ray techniques, and digital image correlation under scanning electron microscopy (SEM-DIC), which are incorporated along crystal plasticity models to investigate the properties of Mg and its alloys, are addressed. Future research directions towards improving the deformation response of Mg and its alloys are identified, which can lead to increased deployment of the lightest structural metal in engineering applications.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Considerations for quantitative in situ X-ray powder diffraction studies of solid-state reactions

The importance of sample preparation in collecting high-fidelity powder diffraction data suitable for quantitative structure and phase analysis is well established. Such powder diffraction experiments are increasingly being appliedin situ, during reactions, to explore solid-state reactivity. When appliedin situ, X-ray diffraction is widely used to gain insight into the mechanism and kinetics, and to identify dynamic intermediate states. Here, using a model ion-exchange reaction (NaFeO 2 + LiCl → LiFeO 2 + NaCl), we show that sample preparation not only influences the fidelity of powder diffraction analysis but also impacts the observed reaction progress. Specifically, we found that the observed reaction progress can differ by ∼50% depending on the capillary sample preparation. Thus, forin situdiffraction studies of solid-state reactions, packing fraction is an important and previously unrecognized consideration that impacts reproducibility and fidelity of the reaction study.

Chemistry↗
DOE OSTI2015

High-resolution neutron diffraction study of microstructural changes in nanocrystalline ball-milled niobium carbide NbC{sub 0.93}

High resolution neutron diffraction was applied for elucidating of the microstructural evolution of nanocrystalline niobium carbide NbC{sub 0.93} powders subjected to high-energy ball milling. The diffraction patterns were collected with the high resolution Fourier diffractometer HRFD by using the reverse time-of-flight (RTOF) mode of data acquisition. The traditional single diffraction line analysis, the Rietveld method and more advanced Whole Powder Pattern Modeling technique were applied for the data analysis. The comparison of these techniques was performed. It is established that short-time milling produces a non-uniform powder, in which two distinct fractions with differing microstructure can be identified. Part of the material is in fact milled efficiently, with a reduction in grain size, an increase in the quantity of defects, and a corresponding tendency to decarburize reaching a composition NbC{sub 0.80} after 15 h of milling. The rest of the powder is less efficiently processed and preserves its composition and lower defect content. Larger milling times should have homogenized the system by increasing the efficiently milled fraction, but the material is unable to reach a uniform and homogeneous state. It is definitely shown that RTOF neutron diffraction patterns can provide the very accurate data for microstructure analysis of nanocrystalline powders. - Highlights: • The NbC{sub 0.93} powder was processed by high-energy ball milling. • The microstrain and dislocation density increase with milling time increase. • The corresponding decrease in crystallite size with milling time was observed. • The material exhibits the presence of two fractions after ball milling. • The RTOF neutron diffraction data are suitable for accurate microstructure analysis.

36 MATERIALS SCIENCE↗