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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 199 records · Page 11
All sourcesNASA NTRSDOE OSTI
NASA NTRS1975

Rotational excitation in H2-H2 collisions - Close-coupling calculations

Rotational excitation in molecule-molecule collisions has been treated for the first time by accurate quantum close-coupling scattering calculations, employing an expansion basis set of two to three rotational levels for each molecule and correctly accounting for exchange of identical particles. Elastic and inelastic cross sections have been computed for collisions of para-para, ortho-ortho, and para-ortho hydrogen molecules assuming an intermolecular potential suggested previously. The accuracy of recent 'effective potential' calculations is demonstrated by comparison with the exact quantum results.

Green, S.↗
NASA NTRS1997

AXAF Detector Backgrounds Produced By Cosmic Ray Protons

One of the science instruments on the Advanced X-ray Astrophysics Facility (AXAF), planned for launch in 1998 into a highly elliptical (10,000 km x 140,000 km) orbit, is a microchannel plate High Resolution Camera (HRC). This detector is designed to provide imaging and spectroscopic observations of x-rays emitted by stellar sources in the 0.1 to 10 keV energy range. Described here are analyses made to determine the expected time-dependent detector background from prompt and delayed (activation) radiation initiated by galactic cosmic-ray (GCR) proton interactions in the spacecraft and payload. Numerical simulations were made using the coupled set of Monte Carlo radiation transport codes, analysis software, and data bases shown. The major codes are HETC for nucleon-meson transport, EGS for simulating electromagnetic cascades, and MORSE for low-energy (less than 15 MeV) neutron transport. The simulation follows the transport history of photons in the energy range from - 100 GeV down to approx. 0.1 keV due to gamma-ray sources from neutral pion decay, high-energy (spallation) collisions, and low-energy neutron inelastic scattering and capture reactions. Also included is radioisotope production and the tracking of gamma-rays, electrons, and positrons from induced radioactivity.

Armstrong, T. W.↗
NASA NTRS1984

The turbulent twisted magnetic flux tube gas

The kinematic behavior of a dilute, two-dimensional 'gas' of parallel twisted magnetic flux tubes in a highly conducting fluid is considered. Collisions between flux tubes with the same sense of twist are inelastic due to the reconnection of their oppositely directed azimuthal magnetic field components at impact. In some collisions, the tension in the reconnected magnetic flux is sufficient to bind the two flux tubes together. Collisions between flux tubes with the opposite sense of twist are elastic. It is shown that a tenuous gas of individual twisted flux tubes condenses into two large-scale regions of magnetic field with opposite twists. This calculation illustrates the results of Montgomery and co-workers on the migration of magnetic energy towards small wavenumbers in two-dimensional magnetohydrodynamic (MHD) turbulence. In particular, this problem illustrates the dynamical nonequilibrium of the relaxation phase in turbulent MHD systems.

Bogdan, T. J.↗
NASA NTRS2018

New O+CO2 Scattering Cross Sections and Their Impact on Photochemical Atmospheric Escape of Oxygen from Mars

Dissociative recombination of O2+ and CO2+ molecular ions in the upper atmosphere of Mars is a major source of suprathermal (hot) oxygen atoms. A significant fraction of hot O atoms are sufficiently fast to overcome Mars' gravitational potential and escape to space. This mechanism is known as photochemical escape (PE) and found to be one of the major escape mechanisms presently active on Mars. The Mars Atmosphere and Volatile Evolution Mission (MAVEN) can constrain the PE rate from measurements of electron temperature and density and ion temperature and density. Escape probabilities of hot O can then be constructed from in-situ neutral densities and escaping O flux loss due to collisions with atmospheric background gases. Due to CO2 abundance in the upper atmosphere, O+CO2 scattering is the most important sink of the escaping hot O flux that strongly affects estimates of total atomic oxygen escape rate obtained from MAVEN data, as outlined above. New O+CO2 elastic and inelastic cross sections were constructed from first principles for collision energies from 0.01-5 eV. O(3P)+CO2 collisions were described using new 4D electronic potential energy surfaces (PESs) for restricted geometries. Three lowest triplet states of CO2 were considered for symmetric, bending, and asymmetric vibrational modes. The cross sections were determined from close-coupling calculations performed on individual surfaces using vibrating rotor approximations for CO2 molecule. Differential and momentum transfer cross sections, of use in energy transfer atmospheric models, were also constructed. The obtained cross sections are in excellent agreement with published results. Our new elastic cross sections are significantly smaller than assumed in earlier atmospheric escape models, resulting in larger photochemical escape rate of O from Mars, as estimated from a 1D escape model. Our results agree well with estimated hot O flux (about 9 x 10(sup 25) s(sup -1)) derived from altitude profiles of 130.4 nm O emission measured up to ~4,000 km by the Imaging Ultraviolet Spectrograph on MAVEN orbiter.

Atmospheric↗
NASA NTRS1987

Solitary waves in the resonant phenomenon between a surface gravity wave packet and an internal gravity wave

A two-layer inviscid incompressible fluid system of intermediate depth is considered. A multiple-scales perturbation technique is applied to the basic equations and boundary conditions for a two-layer fluid system to derive a system of weakly nonlinear partial integrodifferential equations governing the resonant interaction between a surface gravity wave packet and an internal gravity wave at an intermediate depth, providing a bridge between the existing shallow and deep fluid theories. The convolution integral term in these equations accounts for the dispersion in the lower-layer fluid. An iterative fast Fourier transform scheme is developed to find solitary wave solutions to this system of equations. The overtaking collision of two pairs of solitary waves, simulated using a spectral method, is found to be inelastic. It is found that the amplitude of the solitary waves changes slightly after the collision. The phase shifts these solitary waves undergo was calculated numerically.

Sepulveda, Nicasio↗
NASA NTRS1997

Collision Strengths for Electron Collisional Excitation of S II

Electron collisional excitation strengths for inelastic transitions in S II are calculated using the R-matrix method in a 19-state (3s(sup 2)3p(sup 3)(sup 4)S(sup o), (sup 2)D(sup o), (sup 2)p(sup o), 3s3p(sup 4)(sup 4)P, (sup 2)D, (sup 2)S, 3S(sup 2)3p(sup 2)3d(sup 2)P, (sup 4)F, (sup 4)D, (sup 2)F, (sup 4)P, 3s(sup 2)3p(sup 2)4s(sup 4)P, (sup 2)P, 3s(sup 2)3p(sup 2)4p(sup 2)S(s o), (sup 4)D(sup o), (sup 4)P(sup o), (sup 2)D(sup o), (sup 4)S(sup o), (sup 2)P(sup o)) close-coupling approximation. These target states are represented by extensive configuration-interaction wave functions that give excitation energies and oscillator strengths that are usually in good agreement with the experimental values and the available accurate calculations. The present results for collision strengths are in very good agreement with the recent merged beams energy loss measurement of Liao et al. and agree reasonably well with the 18-state R-matrix calculation of Ramsbottom, Bell, & Stafford, but show significant differences from the 12-state R-matrix calculation of Cai & Pradhan.

Tayal, S. S.↗
NASA NTRS1991

Cross sections and rate coefficients for inelastic interactions of heavy particles

The existing analytical inelastic cross-sections for direct atom-atom ionizing collisions of Firsov (1959), Fleischmann et al. (1972), and Drawin (1968) are discussed. General analytical expressions for direct ionization cross-sections in atom-atom collisions are derived. The main advantage of the present cross-sections is their generality, simplicity, and overall accuracy, which is acceptable in most applications and is better than the overall accuracy of the cross-sections of Firsov, Fleischmann et al., and Drawin. The atom-atom interaction is considered as a superposition of all the pairwise interactions between the test particle and all the electrons of the outer nl shell of the target atom. Such a picture of atom-atom collision is acceptable at low- and medium-impact energies because then the electrons of the outer shell of the target atom are most likely the ones that get ionized. At high-impact energy, the picture becomes inaccurate because of strong overlapping of the atomic shells.

Kunc, J. A.↗
NASA NTRS1998

Cross Sections for Electron Impact Excitation of Ions Relevant to Planetary Atmospheres Observation

The goal of this research grant was to calculate accurate oscillator strengths and electron collisional excitation strengths for inelastic transitions in atomic species of relevance to Planetary Atmospheres. Large scale configuration-interaction atomic structure calculations have been performed to obtain oscillator strengths and transition probabilities for transitions among the fine-structure levels and R-matrix method has been used in the calculations of electron-ion collision cross sections of C II, S I, S II, S III, and Ar II. A number of strong features due to ions of sulfur have been detected in the spectra of Jupiter satellite Io. The electron excitation cross sections for the C II and S II transitions are studied in collaboration with the experimental atomic physics group at the Jet Propulsion Laboratory. There is excellent agreement between experiment and theory which provide an accurate and broad-base test of the ability of theoretical methods used in the calculation of atomic processes. Specifically, research problems have been investigated for: electron impact excitation cross sections of C II: electron impact excitation cross sections of S III; energy levels and oscillator strengths for transitions in S III; collision strengths for electron collisional excitation of S II; electron impact excitation of inelastic transitions in Ar II; oscillator strengths of fine-structure transitions in neutral sulfur; cross sections for inelastic scattering of electrons from atomic nitrogen; and excitation of atomic ions by electron impact.

Tayal, Swaraj S.↗
NASA NTRS1969

Heavy particle collisions.

Diatomic heavy particle collisions with emphasis on epithermal energy range, discussing elastic scattering and inelastic processes

Smith, F. T.↗
NASA NTRS1978

Quantum mechanical theory of collisional ionization in the presence of intense laser radiation

The paper presents a quantum mechanical formalism for treating ionizing collisions occurring in the presence of an intense laser field. Both the intense laser radiation and the internal electronic continuum states associated with the emitted electrons are rigorously taken into account by combining discretization techniques with expansions in terms of electronic-field representations for the quasi-molecule-plus-photon system. The procedure leads to a coupled-channel description of the heavy-particle dynamics which involves effective electronic-field potential surfaces and continua. It is suggested that laser-influenced ionizing collisions can be studied to verify the effects of intense laser radiation on inelastic collisional processes. Calculation procedures for electronic transition dipole matrix elements between discrete and continuum electronic states are outlined.

Bellum, J. C.↗
NASA NTRS1987

Dynamics of atom-surface interactions

Scattering techniques currently being used to examine the dynamics and energetics of gas-surface energy exchange processes and gas-surface reaction mechanisms are reviewed. In particular, recent inelastic scattering measurements are highlighted which are revealing the microscopic basis for collision-induced gas-surface energy exchange, e.g., which surface vibrational modes actively participate in translational energy accommodation. Reactive scattering and laser desorptive experiments which examine energy disposal in volatile products are also discussed. Finally, an efficient atomic oxygen beam source is described which is suitable for terrestrial studies of gas-surface interactions.

Sibener, Steven J.↗
NASA NTRS1994

Theoretical Study of Electron Scattering By Small Clusters and Adsorbates

Current interest in clusters stems from their role as novel materials as well as a possible extension of cluster results to bulk systems. Experimental investigations on clusters have been carried out using laser spectroscopy, microwave spectroscopy, heavy-particle collisions, as well as electron collisions with earlier experimental work on electron attachment and ionization having been reviewed previously. Recently, Mark and coworkers studied the decay channels of cluster ions following electron impact ionization. Rauth et al. reported the formation of the superhalogen ion SF7(-) and other nonstoichiometric cluster ions in their study of electron attachment to SF6 clusters. Kresin et al. measured the absolute electron-impact depletion cross section of metal clusters Na8, Na(20), and Na(40). They found that the inelastic scattering cross section increased with cluster size and was considerably greater than the hard sphere collision cross sections. They hypothesized that electron attachment and collision-induced fragmentation were the dominant physical processes responsible for this effect. For the two smaller clusters, they also found a sharp increase in the cross section near threshold. Most theoretical studies of clusters have been devoted to their electronic structures, vibrational relaxation, and predissociation while investigations of electron scattering from clusters has been lacking. In view of this, we recently undertook an ab initio study of electron scattering from small Be clusters and BeCO. Beryllium was chosen because it is readily amenable to ab t'nitio calculations. Moreover, the electronic structure of Be clusters has been studied extensively, showing that the Be-Be bond is relatively weak in comparison with a normal chemical bond. Our investigation focuses on how the cross sections change with cluster size and geometry. The range of energy studied, 0.05 - 5.0 eV, is chosen because of the ubiquitous resonance in the low-energy scattering of Be. Hence it can be determined if it is possible, as a consequence of the weaker bonds in the Be clusters, to identify the atomic origin of the cluster resonance.

Huo, Winifred M.↗
NASA NTRS1986

Second quantization techniques in the scattering of nonidentical composite bodies

Second quantization techniques for describing elastic and inelastic interactions between nonidentical composite bodies are presented and are applied to nucleus-nucleus collisions involving ground-state and one-particle-one-hole excitations. Evaluations of the resultant collision matrix elements are made through use of Wick's theorem.

Norbury, J. W.↗