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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 145 records · Page 8
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

Nonlinear Raman forward scattering driven by a short laser pulse in a collisional transversely magnetized plasma with nonextensive distribution

Nonlinear Raman forward scattering of an intense short laser pulse with a duration shorter than the plasma period propagating through a homogenous collisional nonextensive distributed plasma in the presence of a uniform magnetic field perpendicular to both the direction of propagation and electric vector of the radiation field is investigated theoretically when ponderomotive, relativistic, and collisional nonlinearities are taken into account. The governing equations for nonlinear wave in the context of nonextensive statistics are given, the nonextensive coupled equations describing the nonlinear Raman forward scattering instability are solved by the Fourier transformation method, and the growth rate of the nonlinear Raman forward scattering instability is obtained. The results in the case q → 1 are consistent with those in the framework of the Maxwellian distribution. It is found that the instability growth rate first decreases on increasing electron thermal velocity, minimizes at a critical thermal velocity, and then increases steeply; the critical temperature dependents on the nonextensive parameter, and the greater nonextensive parameter, correspond to the greater critical temperature; when the thermal velocity of electron is less than the critical speed, the instability growth rate is found to be enhanced as the nonextensive parameter increases; but when the thermal velocity is greater than the critical speed, the instability growth rate decreases on increasing the nonextensive parameter.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Low-energy scattering properties of ground-state and excited-state positronium collisions

Low-energy elastic and inelastic scattering in the Ps(1s)-Ps(2s) channel is treated in a four-body hyperspherical coordinate calculation. Adiabatic potentials are calculated for triplet-triplet, singlet-singlet, and singlet-triplet spin symmetries in the spin representation of coupled electrons and coupled positrons, with total angular momentum L = 0 and parity equal to +1. The s-wave scattering lengths for the asymptotic Ps(1s)-Ps(2s) channel are calculated for each spin configuration. Results obtained for the s-wave scattering lengths are a TT = 7.3(2)a 0 – i0.02(1) a 0 , a SS = 13.2(2) a 0 – i0.9 (2) a 0 , and a ST = 9.7(2) a 0 for each spin configuration. Spin recoupling is implemented to extract the scattering lengths for collisions of Ps in different spin configurations through properly symmetrized unitary transformations. Furthermore, calculations of experimentally relevant scattering lengths and cross sections are carried out for Ps atoms initially prepared in different uncoupled spin states.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2024

Detection and Signal Processing for Near-Field Nanoscale Fourier Transform Infrared Spectroscopy

Researchers from a broad spectrum of scientific and engineering disciplines are increasingly using scattering-type near-field infrared spectroscopic techniques to characterize materials non-destructively with nanoscale spatial resolution. However, a sub-optimal understanding of a technique's implementation can complicate data interpretation and act as a barrier to entering the field. Here the key detection and processing steps involved in producing scattering-type near-field nanoscale Fourier transform infrared spectra (nano-FTIR) are outlined. The self-contained mathematical and experimental work derives and explains: i) how normalized complex-valued nano-FTIR spectra are generated, ii) why the real and imaginary components of spectra qualitatively relate to dispersion and absorption respectively, iii) a new and generally valid equation for spectra which can be used as a springboard for additional modeling of the scattering processes, and iv) an algebraic expression that can be used to extract an approximation to the sample's local extinction coefficient from nano-FTIR. The algebraic model for weak oscillators is validated with nano-FTIR and attenuated total reflectance Fourier transform infrared (ATR-FTIR) spectra on samples of polystyrene and Kapton and further provides a pedagogical pathway to cementing some of the technique's key qualitative attributes.

36 MATERIALS SCIENCE↗
DOE OSTI2021

An explicitly solvable energy-conserving algorithm for pitch-angle scattering in magnetized plasmas

In this work, we develop an Explicitly Solvable Energy-Conserving (ESEC) algorithm for the Stochastic Differential Equation (SDE) describing the pitch-angle scattering process in magnetized plasmas. The Cayley transform is used to calculate both the deterministic gyromotion and stochastic scattering, affording the algorithm to be explicitly solvable and exactly energy conserving. An unusual property of the SDE for pitch-angle scattering is that its coefficients diverge at the zero velocity and do not satisfy the global Lipschitz condition. Consequently, when standard numerical methods, such as the Euler-Maruyama (EM), are applied, numerical convergence is difficult to establish. For the proposed ESEC algorithm, its energy-preserving property enables us to overcome this obstacle. We rigorously prove that the ESEC algorithm is order 1/2 strongly convergent. This result is confirmed by detailed numerical studies. For the case of pitch-angle scattering in a magnetized plasma with a constant magnetic field, the numerical solution is benchmarked against the analytical solution, and excellent agreements are found.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1993

Rough surface scattering from moving ocean surfaces as an indicator of scattering mechanisms

Ever since Crombie used the Doppler spectrum of RF signals scattered from the ocean surface to provide conclusive evidence for Bragg resonant scattering, scattering from the ocean surface has served as a testing ground for the identification of governing scattering mechanisms in rough surface scattering. The moving ocean surface has the advantage for rough surface scattering that, being a dispersive medium, features with different spatial scales the tendency to travel at different speeds. Thus, by looking at the temporal signature of the scattered field, one can try to isolate the scattering mechanism. This feature has been exploited by various authors. To give a recent example, we cite the work of Plant, who examined the Doppler spectrum of the return signal to infer the presence of two-scale scattering in scattering at medium incidence angles. The problem with restricting oneself to the examination of the Doppler spectrum, as has been done traditionally, is that one restricts the phenomena under investigation to temporally homogeneous phenomena: transient phenomena, which are localized in time, are not localized in frequency space. There is increasing evidence that this type of phenomena, due to specular scattering or breaking waves, may also play an important role in determining the scattering mechanism in ocean-like surfaces. To overcome this problem, we introduce the use of the Wavelet Transform to study the frequency-temporal signatures of the scattered field from moving ocean waves. We calculate this signature using various analytic scattering theories and show that the Wavelet Transform provides a useful tool for separating the different scattering mechanisms operating in scattering in ocean-like surfaces. Next we simulate realistic nonlinear moving ocean waves and calculate the temporal scattered field signature by using the method of moments and the stop-start approximation: the surface is assumed stationary during a scattering event, but moves between incident EM pulses. We compute and compare the Doppler frequency spectrum and the Wavelet Transform of the resulting signal for various types of surfaces and show how different scattering mechanisms may be isolated by this technique. Finally, we compare these numerical results against the analytical predictions in order to obtain the domain of applicability of various scattering theories for moving ocean surfaces which may include wave breaking and specular glints.

Rodriguez, Ernesto↗
DOE OSTI2026

An algebraic convolution formulation for multiple-scattering correction in small-angle neutron scattering

Multiple scattering in small-angle neutron scattering (SANS) redistributes spectral weight and distorts structural interpretation, particularly for thick or strongly scattering samples. We develop a finite-dimensional spectral desmearing framework that corrects multiple scattering without resorting to integral transforms or model-dependent extrapolation. The primary intensity is expanded in an orthonormal basis adapted to the isotropic transverse-momentum measure, under which convolution reduces to a recursive tensor contraction, allowing the Poisson-weighted multiple-scattering series to be evaluated directly in a finite-dimensional basis representation. This formulation yields a stable forward–inverse mapping between apparent and primary spectra. Numerical tests demonstrate convergence under repeated convolution and accurate recovery of the single-scattering intensity. Application to SANS measurements collected at multiple neutron facilities, including the Spallation Neutron Source, the High Flux Isotope Reactor, and the Institut Laue-Langevin, shows the quantitative reconstruction of the underlying primary spectrum across a wide range of transmission conditions, including strongly attenuating samples. Here, the method provides a stable, model-agnostic framework for multiple-scattering correction in SANS and enables consistent structural interpretation across instruments and scattering regimes.

Tung, Chi-Huan [Oak Ridge National Laboratory (ORN↗
DOE OSTI2019

Anomalous Hall Effect in Epitaxial Ni–Mn–Ga Thin Films Grown on MgO(001) Substrate during the Martensitic Transformation

Epitaxial Ni–Mn–Ga thin films had been grown on MgO (001) by DC magnetron sputtering. And the anomalous Hall effect (AHE), microstructures, magnetism, and magnetoresistance (MR) were investigated. The AHE was measured in the film of Ni{sub 47.8}Mn{sub 30.8}Ga{sub 21.4} during the martensitic transformation. Meanwhile, the mechanism of the AHE was explained which indicates that the hall resistivity measured in our sample is primarily determined by AHE. The microstructures of the austenite phase and 7M martensite plates at room temperature had been observed on the film of Ni{sub 46.7}Mn{sub 31.7}Ga{sub 21.6} and Ni{sub 47.8}Mn{sub 30.8}Ga{sub 21.4}, respectively. Magnetic measurements reveal that all films possessed the martensitic transformation during the heating and cooling processes. In addition, the MR showed a negative value during the martensitic transformation which is mainly due to the reduction of spin-dependent scattering.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Collective neutrino oscillations in supernovae

In a dense neutrino medium neutrinos can experience collective flavor transformation through the neutrino-neutrino forward scattering. In this talk we present some basic features of collective neutrino flavor transformation in the context in core-collapse supernovae. We also give some qualitative arguments for why and when this interesting phenomenon may occur and how it may affect supernova nucleosynthesis.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2025

Structure–Activity Relationships for Ethanol Dehydrogenation to Acetaldehyde by Silica-Supported Zinc Oxide Catalysts

Silica-supported ZnO efficiently catalyzes the nonoxidative dehydrogenation of ethanol to acetaldehyde, which is relevant for production of 1,3-butadiene from bioethanol. Characterization with in situ spectroscopies under dehydrated conditions (high sensitivity-low energy ion scattering (HS-LEIS), diffuse reflectance (DR) UV–vis, X-ray absorption spectroscopy (XAS), diffuse reflectance Fourier transform infrared spectroscopy (DRIFTS), inelastic neutron scattering (INS), and UV Raman), and ammonia adsorption probed by temperature-programmed desorption followed by DRIFTS and mass spectrometry (DRIFTS-MS NH 3 -TPD), and DFT calculations revealed that the supported ZnO x phase was present as isolated surface ZnO x sites on SiO 2 , with the vast majority coordinated by two siloxane bonds and one silicon atom with two nonbridging oxygens ((≡SiO) 2 Zn 2+ O 2 Si=), anchored at 4-, 5-, and 6-membered siloxane rings. A minor fraction of surface ZnO x sites possessed Lewis acidity, and even fewer sites possessed a Bro̷nsted acidic Zn(OH) + Si moiety. Ethanol temperature-programmed surface reaction-mass spectrometry (TPSR-MS) with various oxidative or ethanol reaction pretreatments indicated that only sites with Lewis and Bro̷nsted acidic character (Zn(OH) + Si) were active for ethanol dehydrogenation, while the majority surface (≡SiO) 2 Zn 2+ O 2 Si= sites were inactive. Greater heterogeneity among all surface ZnO x sites, as assessed by in situ DR UV–vis spectroscopy, was associated with a greater number of ZnO x sites that were active for ethanol dehydrogenation as well as lower enthalpic barriers for acetaldehyde production among the most active surface ZnO x sites. Turnover frequencies and the apparent activation energy for ethanol dehydrogenation were determined from steady-state kinetics. Together, these findings suggested that anchoring inactive surface (≡SiO) 2 Zn 2+ O 2 Si= sites on the silica support caused a greater number of active surface ZnO x sites to adopt a more strained configuration, promoting ethanol dehydrogenation catalysis. Pretreatments and catalysts that promoted desorption of ethanol during TPSR, taken as a marker of surface dehydroxylation, were associated with an increased number of the most active surface (Zn(OH) + Si) sites. Such findings suggested that inactive surface ZnO x sites were activated for ethanol dehydrogenation by dehydroxylation of the support and/or decreased coordination to hemilabile siloxane ligands.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Development of combined microstructure and structure characterization facility for in situ and operando studies at the Advanced Photon Source

Following many years of evolutionary development, first at the National Synchrotron Light Source, Brookhaven National Laboratory, and then at the Advanced Photon Source (APS), Argonne National Laboratory, the APS ultra-small-angle X-ray scattering (USAXS) facility has been transformed by several new developments. These comprise a conversion to higher-order crystal optics and higher X-ray energies as the standard operating mode, rapid fly scan measurements also as a standard operational mode, automated contiguous pinhole small-angle X-ray scattering (SAXS) measurements at intermediate scattering vectors, and associated rapid wide-angle X-ray scattering (WAXS) measurements for X-ray diffraction without disturbing the sample geometry. With each mode using the USAXS incident beam optics upstream of the sample, USAXS/SAXS/WAXS measurements can now be made within 5 min, allowing in situ and operando measurement capabilities with great flexibility under a wide range of sample conditions. Furthermore, these developments are described, together with examples of their application to investigate materials phenomena of technological importance. Developments of two novel USAXS applications, USAXS-based X-ray photon correlation spectroscopy and USAXS imaging, are also briefly reviewed.

47 OTHER INSTRUMENTATION↗
NASA NTRS1977

High-resolution spectropolarimetry - A new atmospheric remote sensor

Polarimetry within a spectral line or band is proposed as a new atmospheric remote sensor, particularly for clouds and hazes. The limitations of conventional absorption/emission spectroscopy and photopolarimetry are discussed. The selective formation and behavior of intensity and polarization lines is analyzed under a variety of atmospheric and scattering conditions. The technique, limitations and advantages of Fourier Transform Spectroscopy are reviewed as a prelude to the proposed approach. Experimental results obtained at the telescope for the planet Venus are presented as evidence for the existence, behavior and effects of line polarization. Fourier Transform Spectropolarimetry provides means for separating the effects of scattering from those of absorption, probing the internal properties of clouds and hazes, and studying the detailed wavelength dependence of polarization with variable spectral resolutions from low to high.

Fymat, A. L.↗
DOE OSTI2021

Molecular dynamics simulations of inelastic x-ray scattering from shocked copper

By taking the spatial and temporal Fourier transforms of the coordinates of the atoms in molecular dynamics simulations conducted using an embedded-atom-method potential, we calculate the inelastic scattering of x rays from copper single crystals shocked along [001] to pressures of up to 70 GPa. Above the Hugoniot elastic limit, we find that the copious stacking faults generated at the shock front introduce strong quasi-elastic scattering (QES) that competes with the inelastic scattering signal, which remains discernible within the first Brillouin zone; for specific directions in reciprocal space outside the first zone, the QES dominates the inelastic signal overwhelmingly. The synthetic scattering spectra we generate from our Fourier transforms suggest that energy resolutions of order 10 meV would be required to distinguish inelastic from quasi-elastic scattering within the first Brillouin zone of shock-loaded copper. We further note that high-resolution inelastic scattering also affords the possibility of directly measuring particle velocities via the Doppler shift. These simulations are of relevance to future planned inelastic scattering experiments at x-ray Free Electron Laser facilities.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2023

Neutron Scattering (NS) Spectroscopy

A wide range of advanced experimental methods has been used in catalysis science to understand chemical transformations at molecular level. Among these, neutron scattering not only gives catalytic information that is highly complementary to other microscopic scattering techniques such as electrons (microscopy and diffraction) and photons from visible light to synchrotron X-rays but also often provides unique insights into catalysis. This chapter aims to provide a general overview of neutron scattering and its applications for heterogeneous catalysis, emphasizing chemistry at the gas/solid interface. It starts with an introduction to the theory of neutron scattering, with pros and cons for catalyst research, followed by a description of three main neutron scattering techniques: neutron diffraction (ND), inelastic neutron spectroscopy (INS), and quasi-elastic neutron scattering (QENS). It includes recent applications in each technique and then a short introduction of other neutron techniques that are less frequently used in the catalysis field. It ends with a summary and a future outlook.

Braatz, Jisue↗
NASA NTRS1992

Symmetry properties in polarimetric remote sensing

This paper presents the relations among polarimetric backscattering coefficients from the viewpoint of symmetry groups. Symmetry of geophysical media encountered in remote sensing due to reflection, rotation, azimuthal, and centrical symmetry groups is considered for both reciprocal and nonreciprocal cases. On the basis of the invariance under symmetry transformations in the linear polarization basis, the scattering coefficients are related by a set of equations which restrict the number of independent parameters in the polarimetric covariance matrix. The properties derived under these transformations are general and apply to all scattering mechanisms in a given symmetrical configuration. The scattering coefficients calculated from theoretical models for layer random media and rough surfaces are shown to obey the derived symmetry relations. Use of symmetry properties in remote sensing of structural and environmental responses of scattering media is discussed. As a practical application, the results from this paper provide new methods for the external calibration of polarimetric radars without the deployment of man-made calibration targets.

Nghiem, S. V.↗
DOE OSTI2019

Frustration Properties of the 1D Ising Model

We analyze frustration properties of the Ising model for a 1D monatomic equidistant lattice in an external uniform magnetic field considering exchange interactions of atomic spins at the sites of the first (nearest) and second neighbors. Exact analytic expressions for thermodynamic and magnetic characteristics of the system, as well as for the Fourier transform of the pair spin–spin correlation function and magnetic diffused scattering wavevectors, were obtained by the method of the Kramers–Wannier transfer matrix considering the exchange interaction between spins at the nearest-neighbor sites in an external magnetic field, as well as the exchange interaction between spins at the second-neighbor sites in zero magnetic field. The criteria for the emergence of magnetic frustration in the presence of competition not only between exchange-interaction energies, but also between these energies and the external magnetic field energy are formulated. The frustration points and the values of frustration magnetic fields depending on the magnitudes and signs of the exchange interaction are determined. The distinguishing features of this model in the frustration regime and its vicinity are analyzed. The set of characteristic features inherent in observables for systems with magnetic frustrations is considered and analyzed. It is shown that the inclusion of competing exchange interactions at the first- and second-neighbor sites makes it possible to describe the behavior of the magnetic diffused scattering wavevector for commensurate, incommensurate, and lock-in structures.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2021

Data Mining of Polymer Phase Transitions upon Temperature Changes by Small and Wide-Angle X-ray Scattering Combined with Raman Spectroscopy

The complex physical transformations of polymers upon external thermodynamic changes are related to the molecular length of the polymer and its associated multifaceted energetic balance. The understanding of subtle transitions or multistep phase transformation requires real-time phenomenological studies using a multi-technique approach that covers several length-scales and chemical states. A combination of X-ray scattering techniques with Raman spectroscopy and Differential Scanning Calorimetry was conducted to correlate the structural changes from the conformational chain to the polymer crystal and mesoscale organization. Current research applications and the experimental combination of Raman spectroscopy with simultaneous SAXS/WAXS measurements coupled to a DSC is discussed. In particular, we show that in order to obtain the maximum benefit from simultaneously obtained high-quality data sets from different techniques, one should look beyond traditional analysis techniques and instead apply multivariate analysis. Data mining strategies can be applied to develop methods to control polymer processing in an industrial context. Crystallization studies of a PVDF blend with a fluoroelastomer, known to feature complex phase transitions, were used to validate the combined approach and further analyzed by MVA.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Maskelynite formation via solid-state transformation: Evidence of infrared and x-ray anisotropy

We present optical microscopy, micro-Raman spectroscopy, nuclear magnetic resonance (NMR) spectroscopy, high-energy X-ray total scattering experiments, and micro-Fourier transform infrared (micro-FTIR) spectroscopy on shocked labradorite from the Lonar Crater, India. We show that maskelynite of shock class 2 is structurally more similar to fused glass than to crystalline plagioclase. However, there are slight but significant differences – preservation of original pre-impact igneous zoning, anisotropy at Infrared wavelengths, X-ray anisotropy, and preservation of some intermediate range order – which are all consistent with a solid-state transformation formation of maskelynite.

36 MATERIALS SCIENCE↗