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At least 811 records · Page 45

Atomistic Assessment of Solute-Solute Interactions during Grain Boundary Segregation

Grain boundary solute segregation is becoming increasingly common as a means of stabilizing nanocrystalline alloys. Thermodynamic models for grain boundary segregation have recently revealed the need for spectral information, i.e., the full distribution of environments available at the grain boundary during segregation, in order to capture the essential physics of the problem for complex systems like nanocrystalline materials. However, there has been only one proposed method of extending spectral segregation models beyond the dilute limit, and it is based on simple, fitted parameters that are not atomistically informed. In this work, we present a physically motived atomistic method to measure the full distribution of solute-solute interaction energies at the grain boundaries in a polycrystalline environment. We then cast the results into a simple thermodynamic model, analyze the Al(Mg) system as a case study, and demonstrate strong agreement with physically rigorous hybrid Monte Carlo/molecular statics simulations. This approach provides a means of rapidly measuring key interactions for non-dilute grain boundary segregation for any system with an interatomic potential.

36 MATERIALS SCIENCE↗

Python catemis package for DARHT Axis-II Dispenser-Cathode Emissivity and Temperature Analysis

The catemis python package includes the analysis methods used in paper "DARHT Axis-II Dispenser-Cathode Emissivity and Temperature", which was presented at the 2021 Weapons Engineering Symposium and Journal (WESJ) hosted by Los Alamos National Laboratory. The paper (LA-UR-21-25647) and presentation (LA-UR-21-28231) report on a temperature and emissivity model that has been developed and applied to data from diagnostics used to measure the surface temperature of the DARHT Axis-II hot dispenser cathode over more than a decade of operation. The catemis package provides all the methods used in reporting these results along with the data files used to create the plots and tables in the paper. This includes methods for loading and processing FAR spectral pyrometer data along with methods for temperature calibration of cathode images.

Koglin, Jason↗

Multiplexed ultrasonic system

A system which rapidly determines the elastic stiffness constants of materials in plate shape as well as characterize material flaws that are affecting these constants. Rapid (below a minute) nondestructive evaluation system allow for the determination of material stiffness constants, low noise data acquisition algorithm for measuring spectral data. A real time method of displaying leaky Lamb wave spectral data.

Bar-Cohen, Yoseph↗

Ground level reflectance measurement techniques - An evaluation with emphasis on the importance of spectral calibration

The bandpasses, overflight conditions, and sensor geometry that will provide optimum target discrimination in remote-sensing studies can be determined only from spectral reflectance measurements made for various sun-target-sensor geometries, supplemented by model calculations which can be checked against field data. The accurate measurement of ground reflectance properties is critical to the design of future sensors and to the determination of imaging conditions. The current investigation has the objective to review typical methods of measuring spectral reflectance, to point out some of the problems inherent to reflectance measuring techniques, and to present a method of checking measurement accuracy.

Duggin, M. J.↗

Optimizing spectral phase transfer in four-wave mixing with gas-filled capillaries

Four-wave mixing (FWM) in gas-filled hollow-core capillaries, a nonlinear optical process that mixes signal and pump photon frequencies to generate idler frequency photons, offers a method for precise spectral phase transfer from signal to idler at ultrashort timescales and extreme powers. However, this regime is challenged by competing linear and nonlinear dynamics, leading to significant trade-offs between spectral phase transfer and conversion efficiency. Our computational investigation focuses on the upconversion of femtosecond pulses from the infrared (IR) to the ultraviolet (UV), a range notoriously difficult to manipulate. We explore an intermediate energy regime that strikes an optimal balance between FWM-mediated phase-transfer fidelity and nonlinear conversion efficiency. By adjusting the energy ratios and spectral phase profiles of the input signal, we achieve conversion efficiencies of approximately 5-15% while maintaining an effective quasi-linear spectral phase transfer. These findings will contribute to establishing first-principles and scaling laws essential for applications such as high-precision imaging, spectroscopy, quantum transduction, and distributed entangled interconnects, facilitating advanced control of ultrafast photonic and electronic wavepackets in quantum materials with unprecedented spatial and temporal precision.

Zhang, Hao↗

Statistical method for the prediction of matching results in spectral file searching

In file-search techniques, the distribution of mismatches quantitatively measures the fit of a particular unknown against a given library. A simple theoretical method is developed to predict, a priori, this distribution. With this procedure, for any unknown code and library, the mean number of mismatches can be calculated exactly. For a given library and coding scheme, the mismatch distribution for most unknown codes closely follows a common curve which is easily calculated from statistical properties of the library. When this common curve is normalized to a constant mean, the observed matching behavior is well predicted. The theory should permit the user to more clearly assess the effects of errors on file search performance and suggest techniques by which recognition performance may be optimized.

Grotch, S. L.↗

(abstract) Cross with Your Spectra? Cross-Correlate Instead!

The use of cross-correlation for certain types of spectral analysis is discussed. Under certain circumstances, the use of cross-correlation between a real spectrum and either a model or another spectrum can provide a very powerful tool for spectral analysis. The method (and its limitations) will be described with concrete examples using ATMOS data.

spectrometry. cross-correlation spectra ATMOS spec↗

Surface slope probabilities from the spectra of weak radar echoes - Application to Mars

A method is described for stabilizing the inversion of the power spectra of comparatively weak radar echoes from Mars. It is noted that such stabilization is necessary for echoes with S/N power-spectral densities of order unity as well as for those with broad spectral distributions. The method is applied to the Martian surface, using two data sets obtained with radars of approximately 12.5-cm wavelength. The resulting slope probabilities are interpreted in terms of diffuse and quasi-specular scatter, and values of rms slope are calculated. The results for a sample of Martian locations clearly indicate extreme variations in the local nature of the surface and yield evidence for an apparent planetwide distribution of roughness that may be due to extreme slopes, surface or subsurface rock populations, or a combination of these.

Lipa, B.↗

Two-dimensional correlation analysis for x-ray photoelectron spectroscopy

Abstract X-ray photoelectron spectroscopy (XPS) measures the binding energy of core-level electrons, which are well-localised to specific atomic sites in a molecular system, providing valuable information on the local chemical environment. The technique relies on measuring the photoelectron spectrum upon x-ray photoionisation, and the resolution is often limited by the bandwidth of the ionising x-ray pulse. This is particularly problematic for time-resolved XPS, where the desired time resolution enforces a fundamental lower limit on the bandwidth of the x-ray source. In this work, we report a novel correlation analysis which exploits the correlation between the x-ray and photoelectron spectra to improve the resolution of XPS measurements. We show that with this correlation-based spectral-domain ghost imaging method we can achieve sub-bandwidth resolution in XPS measurements. This analysis method enables XPS for sources with large bandwidth or spectral jitter, previously considered unfeasible for XPS measurements.

47 OTHER INSTRUMENTATION↗

Applications of the Lattice Boltzmann Method to Complex and Turbulent Flows

We briefly review the method of the lattice Boltzmann equation (LBE). We show the three-dimensional LBE simulation results for a non-spherical particle in Couette flow and 16 particles in sedimentation in fluid. We compare the LBE simulation of the three-dimensional homogeneous isotropic turbulence flow in a periodic cubic box of the size 1283 with the pseudo-spectral simulation, and find that the two results agree well with each other but the LBE method is more dissipative than the pseudo-spectral method in small scales, as expected.

Luo, Li-Shi↗

Band analysis by spectral curve fitting

A method of estimating the values of the parameters in the models describing the positions, widths, and intensities of the lines in rotation-vibration bands of gases, without the need for line by line analysis, is described. To illustrate the technique, portions of the 1-0 bands of HCl and CO have been analyzed. The values of up to 27 parameters, their standard deviations, and the correlations between the parameters required to describe the spectra have been obtained.

Lin, C. L.↗

A formula for calculating theoretical photoelectron fluxes resulting from the He/+/ 304 A solar spectral line

A simplified method for the evaluation of theoretical photoelectron fluxes in the upper atmosphere resulting from the solar radiation at 304 A is presented. The calculation is based on considerations of primary and cascade (secondary) photoelectron production in the two-stream model, where photoelectron transport is described by two electron streams, one moving up and one moving down, and of loss rates due to collisions with neutral gases and thermal electrons. The calculation is illustrated for the case of photoelectrons at an energy of 24.5 eV, and it is noted that the 24.5-eV photoelectron flux may be used to monitor variations in the solar 304 A flux. Theoretical calculations based on various ionization and excitation cross sections of Banks et al. (1974) are shown to be in generally good agreement with AE-E measurements taken between 200 and 235 km, however the use of more recent, larger cross sections leads to photoelectron values a factor of two smaller than observations but in agreement with previous calculations. It is concluded that a final resolution of the photoelectron problem may depend on a reevaluation of the inelastic electron collision cross sections.

Richards, P. G.↗

Nonlinear magnetohydrodynamics by Galerkin-method computation

A fully spectral numerical code is used to explore the properties of voltage-driven dissipative magnetofluids inside a periodic cylinder with circular cross section. The trial functions are orthonormal eigenfunctions of the curl (Chandrasekhar-Kendall functions). Transitions are observed from axisymmetric resistive equilibria without flow to helically deformed laminar states with flow, and between pairs of helical laminar states with different pairs of poloidal and toroidal m and n numbers. States of minimum energy dissipation rate seem to be preferred. At high values of the pinch ratio, fully developed magnetohydrodynamic turbulence is observed.

Shan, Xiaowen↗

Method for hyperspectral imagery exploitation and pixel spectral unmixing

An efficiently hybrid approach to exploit hyperspectral imagery and unmix spectral pixels. This hybrid approach uses a genetic algorithm to solve the abundance vector for the first pixel of a hyperspectral image cube. This abundance vector is used as initial state in a robust filter to derive the abundance estimate for the next pixel. By using Kalman filter, the abundance estimate for a pixel can be obtained in one iteration procedure which is much fast than genetic algorithm. The output of the robust filter is fed to genetic algorithm again to derive accurate abundance estimate for the current pixel. The using of robust filter solution as starting point of the genetic algorithm speeds up the evolution of the genetic algorithm. After obtaining the accurate abundance estimate, the procedure goes to next pixel, and uses the output of genetic algorithm as the previous state estimate to derive abundance estimate for this pixel using robust filter. And again use the genetic algorithm to derive accurate abundance estimate efficiently based on the robust filter solution. This iteration continues until pixels in a hyperspectral image cube end.

Lin, Ching-Fang↗

Rainfall Estimation Over Tropical Oceans: Area Average Rain Rate - 1

Multichannel dual polarization microwave radiometer SSM/I observations over oceans do not contain sufficient information to differentiate quantitatively the rain from other hydrometeors on a scale comparable to the radiometer field of view (approx. 30 km). For this reason we have developed a method to retrieve average rain rate over a mesoscale grid box of approx. 300 x 300 sq km area over the TOGA COARE region where simultaneous radiometer and radar observations are available for four months (Nov. 92 to Feb. 93). The rain area in the grid box, inferred from the scattering depression due to hydrometeors in the 85 Ghz brightness temperature, constitutes a key parameter in this method. Then the spectral and polarization information contained in all the channels of the SSM/I is utilized to deduce a second parameter. This is the ratio S/E of scattering index S, and emission index E calculated from the SSM/I data. The rain rate retrieved from this method over the mesoscale area can reproduce the radar observed rain rate with a correlation coefficient of about 0.85. Furthermore monthly total rainfall estimated from this method over that area has an average error of about 15%.

Cuddapah, Prabhakara↗

Protecting qubit coherence by spectrally engineered driving of the spin environment

Abstract Modern quantum technologies rely crucially on techniques to mitigate quantum decoherence; these techniques can be either passive, achieved for example via materials engineering, or active, typically achieved via pulsed monochromatic driving fields applied to the qubit. Using a solid-state defect spin coupled to a microwave-driven spin bath, we experimentally demonstrate a decoherence mitigation method based on spectral engineering of the environmental noise with a polychromatic drive waveform, and show that it outperforms monochromatic techniques. Results are in agreement with quantitative modeling, and open the path to active decoherence protection using custom-designed waveforms applied to the environment rather than the qubit.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗