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All sourcesNASA NTRSDOE OSTI
NASA NTRS1992

Comparison of the Brueckner and coupled-cluster approaches to electron correlation

The coupled-cluster and Brueckner electron correlation methods are used to determine the equilibrium structures, dipole moments, harmonic vibrational frequencies, and IR intensities of NH3, FON, Be3, BeC2, and BeO2. The singles and doubles coupled-cluster and Brueckner doubles methods are employed, and the corresponding methods that include a perturbational estimate of connected triple excitations are also investigated. The T sub 1 diagnostic is found to provide a good indication of the magnitude of the difference between the results obtained with the coupled-cluster and Brueckner methods. For NH3, the T sub 1 diagnostic is small and so the differences between results obtained from coupled-cluster and Brueckner theories are quite small. It is found for all of the molecules under consideration that inclusion of the contribution from connected triple excitations is more important than the differences between the Brueckner and coupled-cluster correlation methods.

Lee, Timothy J.↗
NASA NTRS1993

A test of the applicability of independent scattering to high albedo planetary regoliths

We show that 'independent scattering' is a useful approximation for high albedo particles whose size and packing density are similar to typical particles in the lunar regolith. Laboratory measurements of the intensity and linear polarization of light scattered from a laboratory sample of glass spheres of know size and composition are compared to radiative transfer calculations of the same observable quantities. Mie scattering is integrated over the size distribution of the particles to determine the mean phase and polarization functions, or phase matrix, of the particle. Assuming that the particles scatter independently, the 'doubling method' is used to rigorously calculate multiple scattering in an optically thick layer of these anisotropically scattering particles. All of the major features 'predicted' in the calculated intensity (double peaks at small phase angles) and polarization (negative branch at small phase angles, large positive peak near 20 degrees phase, and small polarization elsewhere) are observed in the laboratory measurements, with good quantitative agreement indicated at phase angles less than 90 degrees. Even though the particles are supported by physical contact with each other in the sample, as are the particles in planetary regoliths, the independent scattering calculation yields a good approximation to both the intensity and polarization. The physical parameters input to the calculation are only the size distribution of the particles and their complex index of refraction (composition). Significant advantages of this approach are that the phase matrix is calculated from basic physical principles and both the intensity and polarization are determined simultaneously. This model may have broad applications to the interpretation of photometry, spectroscopy, and polarimetry of the icy regoliths of high albedo satellites. The intent of this effort is to perform a controlled experiment that tests the utility of the independent scattering assumption

Goguen, J. D.↗
NASA NTRS2014

Experimental and Theoretical Study of Thermodynamics of the Reaction of Titania and Water at High Temperatures

The transpiration method was used to determine the volatility of titanium dioxide (TiO2) in water vapor-containing environments at temperatures between 1473 and 1673 K. Water contents ranged from 0 to 76 mole % in oxygen or argon carrier gases for 20 to 250 hr exposure times. Results indicate that oxygen is not a key contributor to volatilization and the primary reaction for volatilization in this temperature range is: TiO2(s) + H2O(g) = TiO(OH)2(g). Data were analyzed with both the second and third law methods to extract an enthalpy and entropy of formation. The geometry and vibrational frequencies of TiO(OH)2(g) were computed using B3LYP density functional theory, and the enthalpy of formation was computed using the coupled-cluster singles and doubles method with a perturbative correction for connected triple substitutions [CCSD(T)]. Thermal functions are calculated using both a structure with bent and linear hydroxyl groups. Calculated second and third heats show closer agreement with the linear hydroxyl group, suggesting more experimental and computational spectroscopic and structural work is needed on this system.

equilibrium↗
NASA NTRS1976

The delta-Eddington approximation for radiative flux transfer

Simple approximations, like the Eddington, are often incapable of coping with the highly asymmetric phase functions typical of particulate scattering. A simple yet accurate method called the delta-Eddington approximation is proposed for determining monochromatic radiative fluxes in an absorbing-scattering atmosphere. In this method, the governing phase function is approximated by a Dirac delta function forward scatter peak and a two-term expansion of the phase function. The fraction of scattering into the truncated forward peak is taken proportional to the square of the phase function asymmetry factor, which distinguishes the delta-Eddington approximation from others of similar nature. The transmission, reflection, and absorption predicted by the delta-Eddington approximation are compared with doubling method calculations for realistic ranges of optical depth, single-scattering albedo, surface albedo, sun angle and asymmetry factor. The approximation is shown to provide an accurate and analytically simple parameterization of radiation to replace the empirism currently encountered in many general circulation and climate models.

Joseph, J. H.↗
NASA NTRS1994

Permanent superconducting magnets for space applications

Work has been done to develop superconducting trapped field magnets (TFM's) and to apply them to a bumper-tether device for magnetic docking of spacecraft. The quality parameters for TFM's are J(c), the critical current of the superconductor, and d, the diameter of the superconducting tile. During this year we have doubled d, for production models, from 1 cm to 2 cm. This was done by means of seeding, an improved temperature profile in processing, and the addition of 1 percent Pt to the superconductor chemistry. Using these tiles we have set increasing records for the fields' permanent magnets. Magnets fabricated from old 1 cm tiles trapped 1.52 Tesla at 77K, 4.0T at 65K and 7.0T at 55K. The second of these fields broke a 17 year old record set at Stanford. The third field broke our own record. More recently using 2 cm tiles, we have trapped 2.3T at 77K, and 5.3T at 65K. We expect to trap lOT at 55K in this magnet in the near future. We have also achieved increases in J(c) using a method we developed for seeding U-235, and subsequently bombarding with neutrons. This method doubles J(c). We have not yet fabricated magnets from these tiles. During this year we have increased production yields from 15 percent to 95 percent. We have explored the properties of a magnetic bumper-tether for spacecraft. We have measured the bumper forces, and their dependence on time, distance, and the field of the ordinary ferromagnet (used together with a TFM). We have accounted for 85 percent of the collision energy, and its transformation to magnetic energy and heat energy. We have learned to control the relative bumper and tether forces by controlling TFM and ferromagnetic field strengths.

Weinstein, Roy↗
NASA NTRS1971

Multiple scattering of polarized light in planetary atmospheres. II - Sunlight reflected by terrestrial water clouds.

The intensity and polarization of sunlight reflected by terrestrial water clouds are computed with the doubling method. The calculations illustrate that this method can be effectively used in problems involving strongly anisotropic phase matrices. The method can, therefore, be used to derive information about planetary clouds, including those of the earth, from polarimetric observations. The results of the computations indicate that the polarization is more sensitive than the intensity to cloud microstructure, such as particle size and shape.

Hansen, J. E.↗
NASA NTRS1978

Saturn's rings: Particle composition and size distribution as constrained by microwave observations. I - Radar observations

The radar backscattering characteristics of compositional and structural models of Saturn's rings are calculated and compared with observations of the absolute value, wavelength dependence, and degree of depolarization of the rings' radar cross section (reflectivity). The doubling method is used to calculate reflectivities for systems that are many particles thick using optical depths derived from observations at visible wavelengths. If the rings are many particles thick, irregular centimeter- to meter-sized particles composed primarily of water ice attain sufficiently high albedos and scattering efficiencies to explain the radar observations. In that case, the wavelength independence of radar reflectivity implies the existence of a broad particle size distribution; a narrower size distribution is also a possibility. Particles of primarily silicate composition are ruled out by the radar observations. Purely metallic particles may not be ruled out on the basis of existing radar observations. A monolayer of very large ice 'particles' that exhibit multiple internal scattering may not yet be ruled out.

Cuzzi, J. N.↗
NASA NTRS1984

A scatter model for vegetation up to Ku-band

A scatter model is developed based on the matrix doubling method for volume scattering and the Kirchhoff method in rough surface scattering. Scattering from vegetation is assumed to be dominated by leaves and a single leaf is modeled by a thin dielectric disk. In developing the phase matrix for the disk, field within the disk is taken to be constant over the disk thickness, but phase changes across the surface of the disk are accounted for. Comparisons of this scatter model with radar measurements indicate good agreements in polarization, angular trends, and frequency up to Ku-band. This represents a considerable improvement over low-frequency scatter models which are valid up to S-band.

Eom, H. J.↗
NASA NTRS1986

Comparative accuracy of the Albedo, transmission and absorption for selected radiative transfer approximations

Illustrations of both the relative and absolute accuracy of eight different radiative transfer approximations as a function of optical thickness, solar zenith angle and single scattering albedo are given. Computational results for the plane albedo, total transmission and fractional absorption were obtained for plane-parallel atmospheres composed of cloud particles. These computations, which were obtained using the doubling method, are compared with comparable results obtained using selected radiative transfer approximations. Comparisons were made between asymptotic theory for thick layers and the following widely used two stream approximations: Coakley-Chylek's models 1 and 2, Meador-Weaver, Eddington, delta-Eddington, PIFM and delta-discrete ordinates.

King, M. D.↗
NASA NTRS1986

Comparative accuracy of selected multiple scattering approximations

Doubling method computational results which have yielded plane albedo, total transmission and fractional absorption for plane-parallel atmospheres composed of cloud droplets are presently compared with data obtained with selected radiative transfer approximations. The relative and absolute accuracies of asymptotic theory for thick layers and delta-Eddington, Meador-Weaver (1980) and Coakley-Chylek (1975) approximations are compared as a function of optical thickness, solar zenith angle, and single scattering albedo. The delta-Eddington approximation is the most accurate for conservative scattering when the solar zenith angle is small, while Meador-Weaver is the most accurate for nonconservative scattering.

King, M. D.↗
NASA NTRS1993

Comparative accuracy of diffuse radiative properties computed using selected multiple scattering approximations

Computational results have been obtained for the spherical albedo, global transmission, and global absorption of plane-parallel layers composed of cloud droplets. These computations, obtained using the doubling method for the entire range of single scattering albedos and for optical depths between 0.1 and 100, are compared with corresponding results obtained using selected multiple scattering approximations. The spherical albedo and global absorption computed using asymptotic theory are found to be accurate to better than 5 percent for all values of the single scattering albedo, provided the optical thickness exceeds about 2. The diffuse two-stream approximations have relative accuracies that are much worse than 5 percent for the spherical albedo over most of the parameter space, yet are accurate to within 5 percent in the global absorption when the absorption is significant. The integrated delta-Eddington scheme appears to be the most suitable model over the entire range of variables, generally producing relative errors of less than 5 percent in both the spherical albedo and global absorption.

HARSHVARDHAN↗
NASA NTRS1997

New Methods for Improved Double Circular-Arc Helical Gears

The authors have extended the application of double circular-arc helical gears for internal gear drives. The geometry of the pinion and gear tooth surfaces has been determined. The influence of errors of alignment on the transmission errors and the shift of the bearing contact have been investigated. Application of a predesigned parabolic function for the reduction of transmission errors was proposed. Methods of grinding of the pinion-gear tooth surfaces by a disk-shaped tool and a grinding worm were proposed.

Litvin, Faydor L.↗
NASA NTRS1981

Double-beam optical method and apparatus for measuring thermal diffusivity and other molecular dynamic processes in utilizing the transient thermal lens effect

A sample material was irradiated by relatively high power, short pulses from a dye laser. Energy from the pulses was absorbed by the sample material, thereby forming a thermal lens in the area of absorption. The pulse repetition rate was chosen so that the thermal lens is substantially dissipated by the time the next pulse reaches the sample material. A probe light beam, which in a specific embodiment is a relatively low power, continuous wave (cw) laser beam, irradiated the thermal lens formed in the sample material. The intensity characteristics of the probe light beam subsequent to irradiation of the thermal lens is related to changes in the refractive index of the sample material as the thermal lens is formed and dissipated.

Moacanin, J.↗
NASA NTRS2017

Method of Fabricating Double Sided Si(Ge)/Sapphire/III-Nitride Hybrid Structure

One aspect of the present invention is a double sided hybrid crystal structure including a trigonal Sapphire wafer containing a (0001) C-plane and having front and rear sides. The Sapphire wafer is substantially transparent to light in the visible and infrared spectra, and also provides insulation with respect to electromagnetic radio frequency noise. A layer of crystalline Si material having a cubic diamond structure aligned with the cubic <111> direction on the (0001) C-plane and strained as rhombohedron to thereby enable continuous integration of a selected (SiGe) device onto the rear side of the Sapphire wafer. The double sided hybrid crystal structure further includes an integrated III-Nitride crystalline layer on the front side of the Sapphire wafer that enables continuous integration of a selected III-Nitride device on the front side of the Sapphire wafer.

Park, Yeonjoon↗
NASA NTRS1979

A form-factor method for determining the structure of distorted stars

The equilibrium equations of a uniformly rotating and tidally distorted star are reduced to the same form as for a spherical star except for the inclusion of two form factors. One factor, expressing the buoyancy effects of centrifugal force, is determined directly from the integrated structure variables. The other factor, expressing the deviation from spherical shape, is shown to be relatively insensitive to errors in the assumed shape, so that accurate solutions are obtained in spite of the use of an a priori shape. The method is employed by adding computations for the factors to an existing spherical model program. Upper Main Sequence models determined by this method compare closely with results from the double approximation method even for critical rotation and tidal distortion.

Wolfe, R. H., Jr.↗