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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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288 records · Page 16
All sourcesNASA NTRSDOE OSTI
NASA NTRS1989

Comment on linewidths and shifts in the Stokes-Raman Q branch of D2 in He

Collision-induced widths and shifts for Raman Q-branch transitions of D2 in He were calculated from S matrices obtained with converged close coupling scattering calculations on an accurate theoretical interaction potential. Results agree well with experimental values. Discrepancies between experimental line shifts and theoretical values from an earlier study (Blackmore et al., 1988) are traced to a computational error in that work. The effects of vibrational inelasticity and of centrifugal distortion on energy levels and on potential matrix elements, all of which were ignored in the earlier study, are explicitly considered here and found to be small.

Green, Sheldon↗
NASA NTRS1989

Statistical fluctuations in Monte Carlo calculations

The time counter and modified Nanbu simulation techniques are analyzed, with emphasis placed on the convergence of the calculations to a steady macroscopic state. Such variables as translational and rotational temperature, and flow velocity, sampled at several points in the flowfield, are considered. Both macroscopic averages and molecular distribution functions are analyzed. The calculation of inelastic collisions, in which transfer of energy between translational and internal energy modes is performed, is achieved through the use of the Larsen-Borgnakke phenomenological model. It is noted that, with reference to translational temperature, the time counter method shows less statistical scatter than that found with the modified Nanbu simulation technique.

Boyd, I. D.↗
NASA NTRS1972

Semiclassical theory of inelastic collisions. II - Momentum-space formulation.

The time-dependent equations of the classical picture of inelastic collisions (classical-trajectory equations) are derived using the momentum-space semiclassical approximation. Thereby it is shown that the classical-trajectory equations remain valid in the vicinity of classical turning points provided that (a) the momentum-space semiclassical approximation is valid, (b) the trajectories for elastic scattering in the various internal states differ only slightly, and (c) the slopes of the elastic scattering potentials have the same sign. A brief review of the existing derivations of the classical-trajectory equations is given, and the general conditions for their validity are discussed.

Delos, J. B.↗
NASA NTRS1993

Evolution of planetesimals. I - Dynamics: Relaxation in a thin disk. II - Numerical simulations

The study examines the effects of density inhomogeneity and differential rotation as well as inelastic collisions on the dynamical evolution of planetesimals. Consideration is given to a three-step analysis: the dynamical evolution of the planetesimals, collisions and mass accumulation, and interaction with gas. It is shown that the velocity dispersion of a cold system of planetesimals increases rapidly due to elastic gravitational scattering. When the dispersion in the epicycle amplitude becomes comparable to the planetesimals' Roche radius, energy is transferred from the systematic Keplerian shear to the dispersive motion. With a numerical N-body scheme, gravitational scattering and physical collisions among a system of planetesimals is simulated. It is shown that dynamical equilibrium is attained with a velocity dispersion comparable to the surface escape velocity of those planetesimals which contribute most of the system mass.

Palmer, P. L.↗
NASA NTRS1976

Accuracy of decoupling approximations for rotational excitation - Low-energy CO-He collisions

Scattering calculations have been performed for low-energy collisions of CO with He using the 'effective potential' approximation of Rabitz (1972) and the 'coupled states' approximation of McGuire and Kouri (1973). These are compared with the accurate quantum close-coupling scattering results of Green and Thaddeus. All calculations employed a theoretical potential believed to represent accurately the true interaction. The effective potential method is found to be in qualitative agreement, and the coupled states method is found to be in semi-quantitative agreement, with close-coupling results for rotationally inelastic integral cross sections.

Green, S.↗
NASA NTRS1977

Electron impact excitation of SF6

A study of the electron impact energy-loss spectrum of SF6 under both optical (low scattering angle, high impact energy) and non-optical conditions (high scattering angle, low impact energy) has revealed a number of electronic excitation processes. With the help of theoretical calculations, several of these transitions have been assigned and approximate cross sections associated with four features have been determined. In addition, a strong resonance at 12 eV has been observed in both elastic and vibrationally inelastic (delta E = 0.092 eV) channels.

Trajmar, S.↗
NASA NTRS1994

Forward production of protons in relativistic 12C-nucleus collisions

The production of protons in heavy ion collisions through the knockout mechanism (abrasion) is described using the Glauber model. The multiple knockouts from the projectile, including the inelastic collision series with the target, are considered using a closure approximation in treating energy conservation. Calculations for reactions of 12C projectiles with several targets at energies of 1 and 2A GeV arc compared to experiments. For large secondary proton momentum a strong dependence on the target mass is found and attributed to multiple scattering of the projectile knockouts.

NASA Discipline Radiation Health↗
NASA NTRS1989

Time dependent three-dimensional body frame quantal wave packet treatment of the H + H2 exchange reaction on the Liu-Siegbahn-Truhlar-Horowitz (LSTH) surface

The first successful application of the three-dimensional quantum body frame wave packet approach to reactive scattering is reported for the H + H2 exchange reaction on the LSTH potential surface. The method used is based on a procedure for calculating total reaction probabilities from wave packets. It is found that converged, vibrationally resolved reactive probabilities can be calculated with a grid that is not much larger than required for the pure inelastic calculation. Tabular results are presented for several energies.

Neuhauser, Daniel↗
NASA NTRS1986

Rotational inelastic cross sections for OCS-Ar, OCS-He, OCS-H2 collisions - A comparison between theory and experiment

The experimental determination of absorption line profiles for OCS nu3 vibrational transitions broadened by collisions with Ar, He, and H3 buffer gases is reported. The experimental method using diode laser spectroscopy in the five micron region is described. The data are compared with theoretical values obtained using intermolecular potentials previously suggested for these systems and infinite order sudden approximation molecular scattering calculations.

Broquier, M.↗
NASA NTRS1990

Ab initio R-matrix calculations of e+-molecule scattering

The adaptation of the molecular R-matrix method, originally developed for electron-molecule collision studies, to positron scattering is discussed. Ab initio R-matrix calculations are presented for collisions of low energy positrons with a number of diatomic systems including H2, HF and N2. Differential elastic cross sections for positron-H2 show a minimum at about 45 deg for collision energies between 0.3 and 0.5 Ryd. The calculations predict a bound state of positronHF. Calculations on inelastic processes in N2 and O2 are also discussed.

Danby, Grahame↗
NASA NTRS1983

A Potential Function Derivation of a Constitutive Equation for Inelastic Material Response

Physical and thermodynamic concepts are used to develop a potential function for application to high temperature polycrystalline material response. Inherent in the formulation is a differential relationship between the potential function and constitutive equation in terms of the state variables. Integration of the differential relationship produces a state variable evolution equation that requires specification of the initial value of the state variable and its time derivative. It is shown that the initial loading rate, which is directly related to the initial hardening rate, can significantly influence subsequent material response. This effect is consistent with observed material behavior on the macroscopic and microscopic levels, and may explain the wide scatter in response often found in creep testing.

Stouffer, D. C.↗
NASA NTRS1975

Scattering of 4.5 eV electrons by ground /x 3 Sigma g minus/ state and metastable /a 1 Delta g/ oxygen molecules

The paper reports on differential and integral cross sections for scattering of 4.5 eV electrons by ground state (x 3 Sigma g minus) and metastable (a 1 Delta g) oxygen molecules in the -2.0 eV to plus 2.0 eV energy loss range. The cross section for the (a 1 Delta g to b 1 Sigma g plus) transition was found to be more than an order of magnitude larger than that of the excitation of the b state from the ground state. It was found that the principle of detailed balance can be applied to the rotationally unresolved inelastic and superelastic electronic transitions between the (x 3 Sigma g minus) and (a 1 Delta g) states, which indicates that for this transition one may neglect the very different rotational level structure of the two states in estimating superelastic cross section from inelastic data to an accuracy of about 15 per cent.

Hall, R. I.↗
NASA NTRS1975

Validity of approximate methods in molecular scattering - Thermal HCl-He collisions

Accurate close coupling scattering calculations are presented for thermal energy HCl-He collisions. The interaction potential is obtained from the Gordon-Kim electron gas model, adjusted to have the correct long-range multipole form. A variety of phenomenological cross sections are computed from the close coupling S matrix, and these are compared with results from several commonly employed approximate methods. In particular, it is found that the total integral, total differential, and gas kinetic cross sections are accurately predicted by the central field approximation which retains just the spherical average of the interaction. Integral inelastic cross sections are represented quite accurately by the coupled states approximation of McGuire and Kouri, but only qualitatively by the effective potential method of Rabitz.

Green, S.↗
NASA NTRS1997

Effective Collision Strengths for Electron Impact Excitation of Inelastic Transitions in S III

We have calculated electron collisional excitation strengths for all electric dipole forbidden, semi-forbidden, and allowed transitions among the lowest 17 LS states 3s(exp 2)3p(exp 2) P-3, D-1, S-1, 3s3p(exp 3)S-5(exp 0), D-3(exp 0), P-3(exp 0), P-1(exp 0), S-3(exp 0), D-1(exp 0), 3S(exp 2)3p3d D-1(exp 0), F-3(exp 0), P-3(exp 0), D-3(exp 0), F-3(exp 0), P-1(exp 0), and 3S(exp 2)3p4S P-3(exp 0), P-l(exp 0) of S III using the R-matrix method. These S m states are represented by fairly extensive configuration-interaction wave functions that yield excited state energies in close agreement with recent laboratory measurements. Rydberg series of resonances converging to the excited state thresholds are explicitly included in the scattering calculation. The effective collision strengths are determined assuming Maxwellian distribution of electron energies. These are listed over a wide temperature range ([0.5-10] x 10(exp 4) K) and compared, where possible, with other available calculations. Subject headings: atomic data - atomic processes

Tayal, S. S.↗
NASA NTRS1995

Rotational Energy Transfer and Collisional Induced Raman Linewidths in N2 Gas: Energy Transfer Rates - 1

Rotationally inelastic transitions of N2 have been studied in the coupled state (CS) and infinite-order-sudden (IOS) approximations, using the N2-N2 rigidrotor potential of van der Avoird et al. For benchmarking purposes, close coupling (CC) calculations have also been carried out over a limited energy range. The CC and CS cross sections have been obtained both with and without identical molecule exchange symmetry, whereas exchange was neglected in the IOS calculations. The CS results track the CC cross sections rather well; between 113 - 219 cm(exp -1) the average deviation is 14%. Comparison between the CS and IOS cross sections at the high energy end of the CS calculation, 500 - 680 cm(exp -1), shows that IOS is sensitive to the amount of inelasticity and the results for large DELTA J transitions are subject to larger errors. It is found that the state-to-state cross sections with even and odd exchange symmetry agree to better than 2% and are well represented as a sum of direct and exchange cross sections for distinguishable molecules, an indication of the applicability of a classical treatment for this system. This result, however, does not apply to partial cross sections for given total J, but arises from a near cancellation in summing over partial waves. In order to use rigid-rotor results for the calculation of effective rotational excitation rates of N2 in the v=1 vibrational level colliding with bath N2 molecules in the v=0 level, it is assumed that exchange scattering between molecules in different vibrational levels is negligible and direct scattering is independent of Y. Good agreement with room temperature experimental data is obtained. The effective rates determined using the IOS and energy corrected sudden (ECS) approximations are also in reasonable agreement with experiment, with the ECS results being somewhat better. The problem with a degeneracy factor in earlier cross section expressions for collisions between identical molecules is pointed out and corrected.

Huo, Winifred M.↗
NASA NTRS1985

The collisional dynamics of particulate disks

It is shown that the use of the Krook equation greatly simplifies the discussion of the collisional dynamics of particulate disks. Collisions are assumed to be inelastic from the outset. A simple heuristic argument is used to compute the effective collision rate in a disk of spherical particles with a power-law distribution of sizes. For Saturn's rings, the effective collision rate for momentum transport is substantially lower than that conventionally estimated on the basis of an observed optical depth at visual wavelengths. The closure of the vertically integrated set of moment equations without discarding the third-order moments at the outset is discussed, allowing for the possibility of a bent disk. In the limit that the collision frequency is much larger than the orbit frequency, the usual Navier-Stokes equations of viscous hydrodynamics for a thin disk are recovered with an explicit expression for the shear viscosity. The method is generalized to include the effects of gravitational scattering.

Shu, F. H.↗
NASA NTRS1994

Multiplicities of secondaries in nuclear interactions, induced by 20Ne, 40Ar and 56Fe nuclei at 0.1-0.5 GeV/nucleon

Multiplicities of various species of charged secondaries produced in inelastic interactions of 20Ne, 40Ar and 56Fe nuclei with emulsion nuclei at 0.1-0.5 GeV/nucleon have been measured. The data obtained are compared with the results for interactions of higher energy nuclei with emulsion nuclei. The dependences of the nucleus-nucleus interaction parameters on masses and energies of colliding nuclei are examined.

NASA Discipline Radiation Health↗
NASA NTRS1996

Overview of nuclear fragmentation models and needs

It has been known for some time that adequate assessment of spacecraft shield requirements and concomitant estimates of astronauts radiation exposures from galactic cosmic radiation requires accurate, quantitative methods for characterizing these radiation fields as they pass through thick absorbers. The main nuclear interaction processes involved are (1) nuclear elastic and inelastic collisions, and (2) nuclear breakup (fragmentation) and electromagnetic dissociation (EMD). Nuclear fragmentation and EMD are important because they alter the elemental and isotopic composition of the transported radiation fields. At present, there is no suitably accurate theory for predicting nuclear fragmentation cross sections for all collision pairs and energies of interest in space radiation protection. Typical cross-section differences between theory and experiment range from about 25 percent to a factor of two. The resulting errors in transported flux, for high linear energy transfer (LET) particles, are comparble to these cross-section errors. In this overview, theoretical models of heavy ion fragmentation currently used to generate input data bases for cosmic-ray transport and shielding codes are reviewed. Their shortcomings are discussed. Further actions needed to improve their accuracy and generality are presented.

Review↗