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At least 217 records · Page 12
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Modeling thin layers of analytes on substrates for spectral analysis: use of solid/liquid n and k values to model reflectance spectra

Since solids are only sometimes seen en masse in a pure bulk form, and for liquids other than water almost never, a capability to model reflectance spectra from analytes deposited on various substrates would be highly advantageous. If available, the real, n ( ν ) , and imaginary, k ( ν ) , components of the complex refractive index, n n + i k , can be used to simulate infrared spectra, accounting for reflection, refraction, and absorption phenomena as a function of wavelength. We focus on using the Pacific Northwest National Laboratory (PNNL) derived n / k vectors for solid and liquid analytes deposited as thin layers on different types of substrates including conductors, such as aluminum, and inorganic dielectrics, such as glass. The model is an adaptation of the Monte Carlo ray trace modeling program, TracePro, extended through the use of its macrolanguage. The model is tested using thin films of organic liquids including silicone oil and no. 2 diesel fuel, as well as organic solids such as caffeine and acetaminophen on aluminum and glass. The predicted spectra for the solid films were compared to experimental hemispherical reflectance data measured using a Fourier transform spectrometer with an integrating sphere. The thickness of the calculated layer is a parameter for predicting the (transflectance) spectra and is obtained using the areal density measured from gravimetric methods to generate the thin-layer samples. Comparison of the calculated spectra with experimental hemispherical reflectance data shows excellent agreement, indicating promise for the use of measured n / k data to synthesize reference spectral data. In particular, accounting for the inhomogeneity of the deposits greatly improved the match with experimental data. Finally, the theoretical modeling shows that for thicker layers (ca. 20 to 100 μm) of typical organics possessing moderately strong k values, the longwave infrared features are often saturated and better spectral contrast is obtained from the overtone/combination bands in the shortwave infrared.

42 ENGINEERING↗
DOE OSTI2020

Incorporating new evaluation on angular distributions and energy spectra of neutron-induced charged particle reactions into the next ENDF library release (Technical Progress Report)

This project aims to provide the improved Evaluated Nuclear Data File (ENDF) using the newly measured data as well as the latest nuclear reaction model for calculating angular distributions and energy spectra on neutron-induced charged particle reactions through the collaboration of Korea Atomic Energy Research Institute (KAERI) and Los Alamos National Laboratory (LANL). The LANL group will provide the experimental data for angular distributions and spectra of (n,p) and (n,α) on several structural materials such as Fe, Ni and Zn isotopes using the Low Energy Neutron-induced Charged-particle (Z) Chamber (LENZ) instrument at Los Alamos Neutron Science Center (LANSCE). The KAERI group will provide the improved evaluated nuclear library which is based on the LANL experimental data, and further will predict angular distributions and spectra of (n,p) and (n,α) reactions on unmeasured nuclides, such as Cr, Mn, Co, Cu and so on. For the first year of this project, we planned to analyze (n,p) and (n,α) reactions for 54,56 Fe and perform new measurements on those reactions for 58,60 Ni isotopes with the LENZ instrument at LANSCE. For improving our evaluation quality, we have studied reaction models to reproduce LANL’s experimental angular distributions and energy spectra using the full Hauser-Feshbach model code, CoH3 with no approximations used. As the first year’s deliverables, we provided the experimental (n,p) and (n,α) reaction cross sections for 54,56 Fe and incorporate new evaluation on angular distributions and energy spectra of neutron-induced charged particle reactions into the current ENDF/B-VIII.0.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2023

New Dimensions in the Theory of Excited States and X-ray Spectra (Final Report)

This Final Technical Report briefly summarizes the achievements during the lifetime of our DOE BES grant DE-FG02-97ER45623. The long-term goal of this project has been the development of quantitative theories of the interaction between radiation and matter, with a focus on x-ray spectroscopies. X-ray spectra have long been among the most important probes of atomic-scale structure and properties of matter, ranging from atoms and molecular systems to condensed matter and exotic states. These spectroscopies are widely used in investigations at the major DOE synchrotron x-ray facilities and related centers world-wide. In addition to fundamental theory, a major goal of our project has been the development of computational software that implements the theory for calculations of x-ray spectra of various materials throughout the periodic table. Due to the complex nature of x-ray spectra, quantitative theory is essential for its interpretation. The theory is challenging since it involves excited state electronic structure and many-body correlation effects that go beyond independent particle approximations like DFT or Hartree-Fock. Moreover, the experimental investigations typically involve a broad range of energy, time, and temperature scales, from the UV-Vis to hard x-ray energies of order 10 4 eV, and temperatures T from ambient up to the warm-dense-matter regime where the Fermi energy kBTF is of order a few eV, i.e., temperatures of order 105 Kelvin. This broad range of experimental conditions has fostered many novel theoretical approaches and computational techniques, many of which we have developed systematically over the duration of the grant. In contrast to the traditional wave-function approach of quantum theory and electronic structure methods, our theoretical approach is based on modern Green's function techniques. This approach is better suited for aperiodic structures, excited states, and broad spectral ranges, since it avoids the computational bottlenecks of sum-over-states approaches, as in the Fermi golden rule. This theoretical framework has been incorporated into efficient, user-friendly x-ray spectroscopy software which is now used routinely worldwide to simulate and analyze spectra. These theoretical tools provide an essential complement to synchrotron and next-generation light sources, which are used to investigate complex materials with ever increasing precision. Moreover, the synergism between theory, computation and experiment contributed by our research enhances scientific understanding and creates opportunities for innovations in materials and energy science and in many fields. As documented in this Report, this research grant has been remarkably successful in achieving these goals. In particular, this grant has supported the development of the x-ray spectroscopy software suite known as FEFF (named for an effective scattering amplitude f eff in the theory). The FEFF codes have become one of the premier tools for quantitative simulations of x-ray spectra as documented by many thousands of citations in the Web of Science and Google-Scholar.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Deep Learning of Dark Energy Spectroscopic Instrument Mock Spectra to Find Damped Lyα Systems

We have updated and applied a convolutional neural network (CNN) machine-learning model to discover and characterize damped Ly α systems (DLAs) based on Dark Energy Spectroscopic Instrument (DESI) mock spectra. We have optimized the training process and constructed a CNN model that yields a DLA classification accuracy above 99% for spectra that have signal-to-noise ratios (S/N) above 5 per pixel. The classification accuracy is the rate of correct classifications. This accuracy remains above 97% for lower S/N ≈1 spectra. This CNN model provides estimations for redshift and H i column density with standard deviations of 0.002 and 0.17 dex for spectra with S/N above 3 pixel -1 . Also, this DLA finder is able to identify overlapping DLAs and sub-DLAs. Further, the impact of different DLA catalogs on the measurement of baryon acoustic oscillations (BAO) is investigated. The cosmological fitting parameter result for BAO has less than 0.61% difference compared to analysis of the mock results with perfect knowledge of DLAs. This difference is lower than the statistical error for the first year estimated from the mock spectra: above 1.7%. We also compared the performances of the CNN and Gaussian Process (GP) models. Our improved CNN model has moderately 14% higher purity and 7% higher completeness than an older version of the GP code, for S/N > 3. Both codes provide good DLA redshift estimates, but the GP produces a better column density estimate by 24% less standard deviation. A credible DLA catalog for the DESI main survey can be provided by combining these two algorithms.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2023

Particle inertial effects on radar Doppler spectra simulation

Abstract. Radar Doppler spectra observations provide a wealth of information about cloud and precipitation microphysics and dynamics. The interpretation of these measurements depends on our ability to simulate these observations accurately using a forward model. The effect of small-scale turbulence on the radar Doppler spectra shape has been traditionally treated by implementing the convolution process on the hydrometeor reflectivity spectrum and environmental turbulence. This approach assumes that all the particles in the radar sampling volume respond the same to turbulent-scale velocity fluctuations and neglects the particle inertial effect. Here, we investigate the inertial effects of liquid-phase particles on the forward modeled radar Doppler spectra. A physics-based simulation (PBS) is developed to demonstrate that big droplets, with large inertia, are unable to follow the rapid change of the velocity field in a turbulent environment. These findings are incorporated into a new radar Doppler spectra simulator. Comparison between the traditional and newly formulated radar Doppler spectra simulators indicates that the conventional simulator leads to an unrealistic broadening of the spectrum, especially in a strong turbulent environment. This study provides clear evidence to illustrate the droplet inertial effect on radar Doppler spectrum and develops a physics-based simulator framework to accurately emulate the Doppler spectrum for a given droplet size distribution (DSD) in a turbulence field. The proposed simulator has various potential applications for the cloud and precipitation studies, and it provides a valuable tool to decode the cloud microphysical and dynamical properties from Doppler radar observation.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1973

Remote sensing of stream flow rates - Correlation of meander and discharge spectra

Results of a study of river meander patterns and discharges, in which attempt was made to correlate the discharge spectrum of a river with the river meander power spectrum determined from aerial and satellite imagery. Some significant characteristics of both the discharge and the meander spectra have been discovered. Discharge frequency spectra based on long-term records of daily streamflow are found to have an inverse power-law dependence on discharge. This is shown to reflect the short-term decay of individual floods which are found to have an inverse power-law dependence on time. Meander power spectra for a number of river reaches, digitized from aerial photography, also show significant structure, the power spectral density having an inverse power-law dependence on wave number over one or more portions of the spectrum with breaks in the spectra at characteristic wave numbers. A number of examples of typical discharge and meander spectra are shown.

Lingenfelter, R. E.↗
NASA NTRS1977

Air radiation in photographic meteor spectra

Air radiation (N, O, N2) is present in major amounts in the spectra of three high-geocentric-velocity photographic meteor spectra. These spectra are high-definition spectra with over 50 identifiable features in each. These meteor spectra are compared with N2 radiation from a Geissler tube and with calculated N2 first-positive band intensities. An 'effective vibrational temperature' of about 20,000 K is obtained from the nitrogen first-positive band relative intensities. Electron excitation is indicated as the primary excitation process.

Harvey, G. A.↗
NASA NTRS1977

Spectra of turbulent static pressure fluctuations in jet mixing layers

Spectral similarity laws are derived for the power spectra of turbulent static pressure fluctuations by application of dimensional analysis in the limit of large turbulent Reynolds number. The theory predicts that pressure spectra are generated by three distinct types of interaction in the velocity fields: a fourth order interaction between fluctuating velocities, an interaction between the first order mean shear and the third order velocity fluctuations, and an interaction between the second order mean shear rate and the second order fluctuating velocity. Measurements of one-dimensional power spectra of the turbulent static pressure fluctuations in the driven mixing layer of a subsonic, circular jet are presented, and the spectra are examined for evidence of spectral similarity. Spectral similarity is found for the low wavenumber range when the large scale flow on the centerline of the mixing layer is self-preserving. The data are also consistent with the existence of universal inertial subranges for the spectra of each interaction mode.

Jones, B. G.↗
NASA NTRS1978

Synthetic atmospheric transmittance spectra near 15 and 4.3 microns

Synthetic monochromatic atmospheric transmittance spectra are presented for infrared intervals in the vicinity of the 15 and 4.3 microns CO2 bands. The intervals are nominally 20 kaysers in width, and the spectra partition the intervals 560, 780 kayser and 2180, 2400 kayser, respectively. The spectra are for a vertical atmospheric path. A given spectrum is presented at that pressure for which the mean weighting function is a maximum. In order to indicate the molecular origin of the features in a given spectrum, separate spectra are also presented for those species which make center line contributions to the absorption over the interval. The transmittance model for the calculations is described. In addition to the representation of spectral features for intervals which comprise these two CO2 bands, the spectra afford a utility in the design of high precision satellite temperature radiometers.

Susskind, J.↗
NASA NTRS1978

XUV spectra of the 1973 June 15 solar flare observed from Skylab. III - A list of spectral lines from 1000 to 1940 A

A wavelength list of spectral lines between 1000 and 1940 A is presented for the solar flare that occurred on June 15, 1973. The spectra were recorded by the NRL spectrograph on Skylab. The spectral resolution is 0.06 A. Intensities, identifications, and estimates of line widths are given. The intensity of the continuum is also given at 50-A intervals between 1400 and 1900 A. The wavelength list includes about 1400 lines; about 30% of these lines are not indentified. Because of the high wavelength resolution, this line list will be useful as a source of identification for some stellar as well as solar spectra. In particular, the list should be a useful aid in the identification of lines in the spectra of stars with classifications close to that of the sun. Spectra of such stars may be obtained from the recently launched IUE spacecraft. It is also interesting to compare the list with some of the spectra of early-type stars recorded by Copernicus.

Cohen, L.↗
NASA NTRS1980

Spectra from nuclear-excited plasmas

The paper discusses the spectra taken from He-3(n,p)H-3 nuclear-induced plasmas under high thermal neutron flux, lasing conditions. Also, initial spectra are presented for U-235F6 generated plasmas. From an evaluation of these spectra, important atomic and molecular processes that occur in the plasma can be inferred. The spectra presented are the first to be generated by He-3 and U-235F6 nuclear reactions under high neutron flux, lasing conditions. The U-235(n,ff)FF reaction, which liberates 165 MeV of fission-fragment kinetic energy, creates plasmas that are of great interest, since at sufficiently high densities of U-235F6 the gas becomes self-critical; thus, there is no need for an external driving reactor (source of neutrons). The spectra from mixtures of He-3 and Ar, Xe, Kr, Ne, Cl2, F2 and N2 indicate little difference between high-pressure nuclear-induced plasmas and high-pressure electrically pulsed afterglow plasmas for noble-gas systems

De Young, R. J.↗
NASA NTRS1981

Mars - Far-infrared spectra and thermal-emission models

Spectra of Mars from 100 to 360 kaysers were obtained during three different observation periods from NASA's Kuiper Airborne Observatory. Also, a new thermal model was constructed for the surface of Mars, and synthetic spectra were computed from the models to compare with the observations. The models include the effects of a dusty atmosphere which absorbs, scatters, and reradiates energy. The synthetic spectra show significant effects on disk-averaged brightness temperatures, as well as absorption features due to silicate dust. The spectra of Mars, which are ratios of Mars to the moon, do not fit the synthetic spectra unless the surface emissivities of Mars and the moon have different dependencies on wavelength. A possible explanation for this behavior is a difference in soil particle-size distributions between Mars and the moon, with Mars being depleted in large particles compared to the moon. Small particles are consistent with clay minerals which have been suggested elsewhere as constituents of the Martian surface.

Simpson, J. P.↗
NASA NTRS1982

Observations of silicate reststrahlen bands in lunar infrared spectra

Thermal emission spectra of three lunar sites (Apollo 11, Descartes Formation, and Tycho central peak) are measured in the 8-14 micron spectral range. Transmission and instrument effects are accounted for by forming ratios of the Descartes and Tycho spectra to the Apollo 11 spectrum. The ratio spectra are compared with ratios of published laboratory spectra of returned lunar samples and also with ratio spectra calculated using the Aronson-Emslie (1975) model. The comparisons show pyroxene bands in the Descartes ratio spectrum and plagioclase bands in the Tycho ratio spectrum. The Tycho spectrum is found to be consistent with the existence of fine plagioclase dust (approximately 1 micron) at the rock surface and a higher-than-usual sodium content of the plagioclase.

Potter, A. E., Jr.↗
NASA NTRS1982

Chemistry of cometary meteoroids from video-tape records of meteor spectra

The chemistry of the cometary meteoroids was studied by closed circuit television observing systems. Vidicon cameras produce basic data on standard video tape and enable the recording of the spectra of faint shower meteors, consequently the chemical study is extended to smaller particles and we have a larger data bank than is available from the more conventional method of recording meteor spectra by photography. The two main problems in using video tape meteor spectrum records are: (1) the video tape recording has a much lower resolution than the photographic technique; (2) video tape is relatively new type of data storage in astronomy and the methods of quantitative photometry have not yet been fully developed in the various fields where video tape is used. The use of the most detailed photographic meteor spectra to calibrate the video tape records and to make positive identification of the more prominent chemical elements appearing in the spectra may solve the low resolution problem. Progress in the development of standard photometric techniques for the analysis of video tape records of meteor spectra is reported.

Millman, P. M.↗
NASA NTRS1983

Crustal geomagnetic field - Two-dimensional intermediate-wavelength spatial power spectra

Two-dimensional Fourier spatial power spectra of equivalent magnetization values are presented for a region that includes a large portion of the western United States. The magnetization values were determined by inversion of POGO satellite data, assuming a magnetic crust 40 km thick, and were located on an 11 x 10 array with 300 km grid spacing. The spectra appear to be in good agreement with values of the crustal geomagnetic field spatial power spectra given by McLeod and Coleman (1980) and with the crustal field model given by Serson and Hannaford (1957). The spectra show evidence of noise at low frequencies in the direction along the satellite orbital track (N-S). indicating that for this particular data set additional filtering would probably be desirable. These findings illustrate the value of two-dimensional spatial power spectra both for describing the geomagnetic field statistically and as a guide for diagnosing possible noise sources.

Mcleod, M. G.↗
NASA NTRS1984

The energy spectra of solar energetic particles

A survey of recent results on the shapes and relative slopes of the spectra of various solar energetic particle populations is presented, with emphasis on the more extensive results currently available for protons, alphas and electrons. From previous work, it is found that proton spectra 0.8 to more than 400 MeV and alpha spectra 1.4 to 80 MeV/nucleon are best characterized, on average, by a functional form involving a Bessel function in momentum/nucleon. However, proton and alpha spectral slopes using this form are not equal, and there is significant variation from event to event. From other studies, electrons 0.02 to 20 MeV are also found to have curved spectra, but seem to be better fit with a double power law in energy. The spectral properties in both cases correlate with other measures of solar particle acceleration; e.g. gamma-ray line production, hard X-ray burst spectra and microwave fluxes.

Mcguire, R. E.↗
NASA NTRS1985

ROWS estimates of wave height, wind speed, and directional wave spectra for SIR-B underflights off Chile, October 11 and 12, 1984

An account is given of the successful operation of the Goddard Ku-band Radar Ocean Wave Spectrometer (ROWS) on four out of five of the NASA Wallops' P-3 underflights of the Shuttle Imaging Radar-B (SIR-B) off the coast of southern Chile during the period of October 7-12, 1984. ROWS provided surface wind speed, wave height, and directional wave height spectrum estimates from the instrument's nadir altimeter mode and off-nadir spectrometer mode. ROWS estimates of the directional spectra of 300-400-m wavelength swell-dominated 3-5 m seas on October 11 and 12 are presented and compared to SCR (Surface Contour Radar), SIR-B, and Navy GSOWM spectra. Good agreement is found with SCR height spectra for the 12th (when the SCR was operable). Also, surprisingly good agreement is found between ROWS slope spectra and SIR-B image spectra for both the 11th and 12th for both swell and local wind-sea components. ROWS altimeter mode estimates of maximum winds of about 10 m/s on the 11th and 12th are seen to be consistent with the ROWS spectrometer mode observed local wind-sea peak frequencies of about 0.12-0.14 Hz.

Jackson, F. C.↗
NASA NTRS1985

Ultraviolet spectra of N, R, and S stars

Ultraviolet IUE spectra of N, R, and S stars are displayed and discussed. Carbon stars of type N have IUE spectra similar to M stars except that the Mg II lines are much weaker and low-excitation lines from neutral metals are stronger. Spectra of early R stars (R0-R3) closely resemble those of late G or early K in both lines and continuum with no significant emission lines. Late R stars (R5-R8) show spectra like late K or early M stars except that lines from low levels of excitation are stronger. Ultraviolet spectra of S stars show a wide variation in the strength of Mg II lines.

Johnson, H. R.↗