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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 1,063 records · Page 59
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

When band convergence is not beneficial for thermoelectrics

Abstract Band convergence is considered a clear benefit to thermoelectric performance because it increases the charge carrier concentration for a given Fermi level, which typically enhances charge conductivity while preserving the Seebeck coefficient. However, this advantage hinges on the assumption that interband scattering of carriers is weak or insignificant. With first-principles treatment of electron-phonon scattering in the CaMg 2 Sb 2 -CaZn 2 Sb 2 Zintl system and full Heusler Sr 2 SbAu, we demonstrate that the benefit of band convergence can be intrinsically negated by interband scattering depending on the manner in which bands converge. In the Zintl alloy, band convergence does not improve weighted mobility or the density-of-states effective mass. We trace the underlying reason to the fact that the bands converge at a one k-point, which induces strong interband scattering of both the deformation-potential and the polar-optical kinds. The case contrasts with band convergence at distant k-points (as in the full Heusler), which better preserves the single-band scattering behavior thereby successfully leading to improved performance. Therefore, we suggest that band convergence as thermoelectric design principle is best suited to cases in which it occurs at distant k-points.

42 ENGINEERING↗
DOE OSTI2021

High resolution x-ray emission spectrometer for multiple hard x-ray emission lines: Demonstration for Cu Kα and Kβ emissions

In this work, we present a compact 3D printed x-ray emission spectrometer based on the von Hamos geometry that represents a significant upgrade to the existing von Hamos geometry-based miniature x-ray emission spectrometer (miniXES). The upgrades include the incorporation of a higher pixel density 500K detector for improved energy resolution and an enlarged sample area to accommodate a wider range of sample formats. The versatile spectrometer houses removable crystal holders that can be easily exchanged, as well as movable alignment eyelets that give flexibility in Bragg angle selection. Designed for ease of manufacture, all the components, except for the apertures, can be 3D printed and readily assembled. We describe its implementation in measurements of resonant and non-resonant Cu Kα and Kβ x-ray emission and report the theoretical and measured energy resolution and collected solid angle of the emission.

3D printing↗
DOE OSTI2022

Production of high fluence laser beams using ion wave plasma optics

Optical components for laser beams with high peak and averaged powers are being developed worldwide using stimulated plasma scattering that occurs when plasmas interact with intense, coherent light. After decades of pursuit of pulse compressors, mirrors, and other plasma based components that can be created by stimulated scattering from electron density perturbations forming on ultra-short time scales (e.g., via Stimulated Raman Scattering), more recent work has produced optical components on longer time scales allowing ion motion as well [via Stimulated Brillouin Scattering (SBS)]. In the most recent work, ion wave plasma optics have had success in producing pulses of focusable coherent light with high energy and fluence by operating on ns time scales and now promise to enable numerous applications. Experiments have further shown that in some parameter regimes, even simple plasma response models can describe the output of such optics with sufficient accuracy that they can be used as engineering tools to design plasma optics for future applications, as is already being done to control power deposition in fusion targets. In addition, the development of more sophisticated models promises to enable still higher performance from SBS driven plasma optical components under a wider range of conditions. The present status and most promising directions for future development of ion wave plasma optic techniques are discussed here.

47 OTHER INSTRUMENTATION↗
DOE OSTI2023

Even lighter particle dark matter

We report on recent progress in the search for dark matter particles with masses from 1 Mev c ^{-2} − 2 to 1 Gev c ^{-2} − 2 . Several dark matter candidates in this mass range are expected to generate measurable electronic-recoil signals in direct-detection experiments. We focus on dark matter particles scattering with electrons in semiconductor detectors since they have fundamentally the highest sensitivity due to their low ionization threshold. Charge-coupled device (CCD) silicon detectors are the leading technology, with significant progress expected in the coming years. We present the status of the CCD program and briefly report on other efforts.

Chavarria, Alvaro E.↗
NASA NTRS1989

Measuring Transmission Efficiencies Of Mass Spectrometers

Coincidence counts yield absolute efficiencies. System measures mass-dependent transmission efficiencies of mass spectrometers, using coincidence-counting techniques reminiscent of those used for many years in calibration of detectors for subatomic particles. Coincidences between detected ions and electrons producing them counted during operation of mass spectrometer. Under certain assumptions regarding inelastic scattering of electrons, electron/ion-coincidence count is direct measure of transmission efficiency of spectrometer. When fully developed, system compact, portable, and used routinely to calibrate mass spectrometers.

Srivastava, Santosh K.↗
NASA NTRS1995

A BATSE investigation of radiation belt electrons precipitated by VLF waves

The Compton Observatory commonly encounters fluxes of energetic electrons which have been scattered from the inner radiation belt to the path of the satellite by resonant interactions with VLF waves from powerful man-made transmitters. The present investigation was motivated by the fact that in the Fall of 1993, the Gamma Ray Observatory was boosted from a 650 km altitude circular orbit to a 750 km altitude circular orbit. This was an opportunity, for the first time, to make observations at two different altitudes using the same instrument. We have examined DISCLA data from the Burst & Transient Source Experiment (BATSE) experiment from 1 Sep. 1993 to 29 Jan. 1994. During the period of study we identified 48 instances of the satellite encountering a cloud of energetic electrons which had been scattered by VLF transmitters. We find that boosting the altitude of the circular orbit from 650 km to 750 km increased the intensity of cyclotron resonance scattered electrons by a factor of two. To search for long term changes in the cyclotron resonance precipitation, we have compared the approx. 750 km altitude data from 106 days at the end of 1993 with data at the same altitudes and time of year in 1991. The cyclotron resonance events in 1991 were three times more frequent and 25% of those cases were more intense than any seen in the 1993 data. We attribute this difference to increased level of geomagnetic activity in 1991 near the Solar Maximum.

Datlowe, Dayton W.↗
NASA NTRS1995

A BATSE investigation of radiation belt electrons precipitated by VLF waves

The Compton Observatory commonly encounters fluxes of energetic electrons which have been scattered from the inner radiation belt to the path of the satellite by resonant interactions with VLF waves from powerful man-made transmitters. The present investigation was motivated by the fact that in the Fall of 1993, the Gamma Ray Observatory was boosted from a 650 km altitude circular orbit to a 750 km altitude circular orbit. This was an opportunity, for the first time, to make observations at two different altitudes using the same instrument. We have examined DISCLA data from the Burst & Transient Source Experiment (BATSE) experiment from 1 Sep. 1993 to 29 Jan. 1994. During the period of study we identified 48 instances of the satellite encountering a cloud of energetic electrons which had been scattered by VLF transmitters. We find that boosting the altitude of the circular orbit from 650 km to 750 km increased the intensity of cyclotron resonance scattered electrons by a factor of two. To search for long term changes in the cyclotron resonance precipitation, we have compared the approx. 750 km altitude data from 106 days at the end of 1993 with data at the same altitudes and time of year in 1991. The cyclotron resonance events in 1991 were three times more frequent and 25% of those cases were more intense than any seen in the 1993 data. We attribute this difference to increased level of geomagnetic activity in 1991 near the Solar Maximum.

Datlowe, Dayton W.↗
NASA NTRS2004

Electron-H P-Wave Elastic Scattering

In previous papers [Bhatia and Temkin, Phys. Rev. A 64, 032709-1 (2001), Phys. Rev. A 66, 064702 (2002)], electron-hydrogen and electron-He(+) S-wave scattering phase shifts were calculated using the optical potential approach. This method is now extended to the singlet and triplet electron-H P-wave scattering in the elastic region. Phase shifts are calculated using Hylleraas-type correlation functions with up to 220 terms. Results are rigorous lower bounds to the exact phase shifts and they are compared to phase shifts obtained from previous calculations.

Bhatia, A. K.↗
NASA NTRS1972

Effect of charge polarization on inelastic scattering - Differential and integral cross sections for excitation of the 2/super 1/S state of helium by electron impact.

Experimental differential scattering cross sections for excitation of helium by electron impact from its ground state to its 2(super 1)S state are presented at four incident electron energies in the range from 26 to 55.5 eV for scattering angles between 10 and 70 deg and at 81.6 eV for scattering angles between 10 and 80 deg. These cross sections are normalized and compared with results predicted by the Born approximation, the polarized Born approximation, and several other first-order approximations in which direct excitation is calculated in the Born approximation and exchange scattering in various Ochkur-like approximations.

Rice, J. K.↗
NASA NTRS1979

Astrophysical gamma-ray production by inverse Compton interactions of relativistic electrons

The inverse Compton scattering of background photon gases by relativistic electrons is a good candidate for the production of high-energy gamma rays in the diffuse interstellar medium as well as in discrete sources. By discussing the special case of the scattering of the diffuse starlight in the interstellar medium by cosmic ray electrons, we demonstrate that previous derivations of the gamma ray source function for this process on the basis of the Thomson limit of the Klein-Nishina cross section lead to incorrect values for gamma-ray energies above 100 MeV. It is shown that the Thomson limit is not applicable for the calculation of gamma-ray source functions in astrophysical circumstances in which target photons with energies greater than 1 eV are scattered by relativistic electrons.

Schlickeiser, R.↗
NASA NTRS2003

Where is scattering important in nanotransistors?

This viewgraph presentation provides an overview of scattering in nanotransistors. Topics covered include: scattering mechanisms, devices used and series resistance. The authors conclude: (1) the influence of electron-photon scattering on the on-current of dual gate MOSFET's using the non-equilibrium Green's function method and (2) the influence of the drain extension region can no longer be modeled as a series resistance.

Anantram, M. P.↗
DOE OSTI2024

Digital twins and deep learning segmentation of defects in monolayer MX 2 phases

Developing methods to understand and control defect formation in nanomaterials offers a promising route for materials discovery. Monolayer MX 2 phases represent a particularly compelling case for defect engineering of nanomaterials due to the large variability in their physical properties as different defects are introduced into their structure. However, effective identification and quantification of defects remain a challenge even as high-throughput scanning transmission electron microscopy methods improve. This study highlights the benefits of employing first principles calculations to produce digital twins for training deep learning segmentation models for defect identification in monolayer MX 2 phases. Around 600 defect structures were obtained using density functional theory calculations, with each monolayer MX 2 structure being subjected to multislice simulations for the purpose of generating the digital twins. Several deep learning segmentation architectures were trained on this dataset, and their performances evaluated under a variety of conditions such as recognizing defects in the presence of unidentified impurities, beam damage, grain boundaries, and with reduced image quality from low electron doses. Further, this digital twin approach allows benchmarking different deep learning architectures on a theory dataset, which enables the study of defect classification under a broad array of finely controlled conditions. It thus opens the door to resolving the underpinning physical reasons for model shortcomings and potentially chart paths forward for automated discovery of materials defect phases in experiments.

36 MATERIALS SCIENCE↗
NASA NTRS1988

An electrostatically and a magnetically confined electron gun lens system

Focal properties, electron trajectory calculations, and geometries are given for two electron 'gun' lens systems that have a variety of applications in, for example, electron-neutral and electron-ion scattering experiments. One nine-lens system utilizes only electrostatic confinement and is capable of focusing electrons onto a fixed target with extremely small divergence angles, over a range of final energies 1-790 eV. The second gun lens system is a simpler three-lens system suitable for use in a uniform, solenoidal magnetic field. While the focusing properties of such a magnetically confined lens systenm are simpler to deal with, the system does illustrate features of electron extraction and Brillouin flow that have not been suitably emphasized in the literature.

Bernius, Mark T.↗
DOE OSTI2020

Surface Enhanced Raman Scattering Selectivity in Proteins Arises from Electron Capture and Resonant Enhancement of Radical Species

Plasmon-enhanced Raman scattering is a powerful approach to detecting and characterizing proteins in live and dynamic biological systems. However, the selective detection/enhancement of specific residues as well as spectral diffusion and fluctuations have complicated the interpretation of enhanced Raman spectra and images of biological matter. In this paper, we therefore demonstrate that the amino acid tryptophan (Trp) can capture an electron from an excited plasmon, which generates a radical anion that is resonantly enhanced: a visible excited electronic state slides into resonance upon charging. This surface enhanced resonance Raman scattering (SERRS) mechanism explains the persistence of Trp signatures in the SERS and TERS spectra of proteins. Evidence for this picture includes the observation of visible resonances in the UV-Vis extinction spectrum, changes in the ground state vibrational spectrum, and plasmon-resonance dependent behavior. DFT calculations support the experimental observations. The behavior observed from the free Trp molecule is shown to explain the SERS spectrum of the Trp-cage protein. In effect, resonant Raman scattering from radicals formed through plasmonic excitation represents an under-investigated mechanism that may be exploited for chemical sensing applications. This work was supported by the National Institutes of Health Award R01-GM109988. The authors thank Hannah Shafaat for helpful discussions and providing an azurin sample for comparison. The authors also thank Joel Harris for providing constructive comments on our manuscript.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗