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At least 505 records · Page 28
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NASA NTRS1988

Multiple nucleon knockout by Coulomb dissociation in relativistic heavy-ion collisions

The Coulomb dissociation contributions to fragmentation cross sections in relativistic heavy ion collisions, where more than one nucleon is removed, are estimated using the Weizsacker-Williams method of virtual quanta. Photonuclear cross sections taken from experimental results were used to fold into target photon number spectra calculated with the Weizsacker-Williams method. Calculations for several projectile target combinations over a wide range of charge numbers, and a wide range of incident projectile energies, are reported. These results suggest that multiple nucleon knockout by the Coulomb field may be of negligible importance in galactic heavy ion studies for projectiles lighter than Fe-56.

Cucinotta, Francis A.↗
NASA NTRS1989

Introduction to dissociative recombination

Dissociative recombination (DR) of molecular ions with electrons has important consequences in many areas of physical science. Ab-initio calculations coupled with resonant scattering theory and multichannel quantum defect studies have produced detailed results illuminating the role of ion vibrational excitation, the quantum yields of the DR products, and the role of Rydberg states. The theoretical and experimental results are discussed.

Guberman, Steven L.↗
NASA NTRS1988

Computations of unsteady dissociating nitrogen flows

A time-accurate computer program has been developed to solve flows involving nonequilibrium chemical reactions and vibrational relaxation. The program is based on a multidomain approach and an explicit MacCormack scheme. Results are presented for three simple test cases, involving nitrogen dissociation in a closed box.

Marraffa, Lionel↗
NASA NTRS1988

Cross sections for the dissociative attachment of electrons to NO

Cross sections for the production of O(-) by electron attachment to NO are reported. It is found that the maximum value of the cross section is about 52 percent higher than the measurement of Rapp and Briglia (1965). Cross sections for the process of polar dissociation, e + NO yields N(+) + O(_), have also been measured, and the threshold energy for this process has been obtained.

Krishnakumar, E.↗
NASA NTRS1989

Fast molecular shocks. I - Reformation of molecules behind a dissociative shock

The physical and chemical processes that operate in the cooling gas behind a fast, dissociative, single-fluid shock propagating in a dense interstellar cloud are discussed. The treatment extends previous theoretical work on fast molecular shocks by including the effects of the conversion of Ly-alpha photons into radiation of the two-photon continuum and into H2 Lyman band emission lines, the effects of CO photodissociation following line absorption, and the formation and destruction of molecules containing the elements nitrogen, silicon, and sulphur, and of the complex hydrocarbons. Abundance profiles for the molecular species of interest are presented. After molecular hydrogen begins to reform, by means of gas phase and grain surface processes, the neutral species OH, H2O, O2, CO, CN, HCN, N2, NO, SO, and SiO reach substantial abundances. The molecular ions HeH(+), OH(+), SO(+), CH(+), H2(+), and H3(+), are produced while the gas is still hot and partially ionized. Emissions from them provide a possible diagnostic probe of fast molecular shocks.

Neufeld, David A.↗
NASA NTRS1989

Ionization yields, total absorption, and dissociative photoionization cross sections of CH4 from 110-950 A

Absolute absorption and photoionization cross sections of methane have been measured with an accuracy of about 2 or 3 percent over most of the wavelength range from 950 to 110 A. Also, dissociative photoionization cross sections were measured for the production of CH4(+), CH3(+), CH2(+), CH(+), and C(+) from their respective thresholds to 159 A, and for H(+) and H2(+) measurements were made down to 240 A. Fragmentation was observed at all excited ionic states of CH4.

Samson, James A. R.↗
NASA NTRS1990

Measurement of threshold temperature effects in dissociative electron attachment to HI and DI

From accurate spectroscopic constants it is found that the thermal dissociative-attachment process (DA) in DI should be exothermic only for rotational levels J greater than 8 in v = O. Here, measurement of an enhancement of DA with rotational temperature T in the range 298-468 K is reported. The effect is easily accounted for by the increase in total fractional population of excited J levels in DI relative to HI. The effect affords a rotational analog to the use of vibrationally excited molecules (e.g., HCl) in a plasma to control electron conduction.

Chutjian, A.↗
NASA NTRS1989

Numerical simulation of unsteady flows generated by dissociating nitrogen diffusion

An explicit time accurate predictor-corrector scheme, similar to MacCormack's, has been used to simulate unsteady nonequilibrium laminar chemically-reacting diffusion-reaction generated flows. A zonal approach, along with nonstructured boundaries, allows computation of internal and external flow with the same computer code. Results for equilibrium flows generated by dissociating, vibrationally relaxing nitrogen in a rectangular chamber are presented. The unsteady flows were generated strictly by the chemical reactions and concentration gradients.

Marraffa, Lionel↗
NASA NTRS1989

Dissociation revisited - Workload and performance in a simulated flight task

The multiple resource model has been used as the theoretical basis for interpreting single-to-dual task changes in measures of performance and workload ratings. Inconsistent relationships among these measures have been termed dissociation. It is possible they are an artifact of the way performance and workload measures are collected; performance measures are available for the components of a complex task whereas workload ratings are integrated across all of the tasks performed within an interval of time. This study compared component ratings with global ratings and found that component ratings provide better information about subjects' task strategies and in interpreting the resultant relationships between workload ratings and performance.

King, Teresa↗
NASA NTRS1990

Dissociative attachment of electrons to N2O

Cross sections for the production of O(-) from N2O by the process of dissociative electron attachment have been measured for electron-impact energies ranging from 0 to 50 eV. Three new O(-) peaks are observed. The present data above 5-eV electron-impact energy differ considerably from the previous measurements.

Krishnakumar, E.↗
NASA NTRS1990

On the dissociation energy of Mg2

The bonding in the X 1Sigma(+)g state of Mg2 is investigated using near-complete valence one-particle Slater and Gaussian basis sets containing up to h functions. It is shown that the four-electron complete CI limit can be approached using a sequence of either second-order CI (SOCI) or interacting correlated fragment (ICF) calculations. At the valence level, the best estimate of the dissociation energy D(e) was 464/cm. This is a lower limit and is probably within 5/cm of the complete basis value.

Partridge, Harry↗
NASA NTRS1989

Aeronomical determinations of the quantum yields of O (1S) and O (1D) from dissociative recombination of O2(+)

Data from the visible-airglow experiment on the Atmosphere Explorer-E satellite have been used to determine the quantum yields of O (1S) and O (1D) from the dissociative recombination of O2(+) based on a constant total recombination rate from each vibrational level. A range of values between 0.05 and 0.18 has been obtained for the quantum yield of O (1S) and shows a positive correlation with the extent of the vibrational excitation of O2(+). The quantum yield of O (1D) has been measured to be 0.9 + or - 0.2, with no apparent dependence on the vibrational distribution of O2(+).

Yee, Jeng-Hwa↗
NASA NTRS1989

Dissociative recombination in interstellar clouds

Molecular ions play a significant role in the chemistry and evolution of interstellar molecular clouds, even though these regions are overwhelmingly neutral. The dissociative recombination (DR) process governs the abundances of many of these ions and of related neutral species. The gas-phase ion-molecule chemistry of the simplest species is summarized, with emphasis on those problems which are most sensitive to uncertain rates or product branching ratios of DR processes. Examples of the kinds of information needed about DR processes are presented. The importance of the H3(+) ion and prospects for its direct observation are discussed.

Black, John H.↗
NASA NTRS1990

A theoretical prediction of hydrogen molecule dissociation-recombination rates including an accurate treatment of internal state nonequilibrium effects

The dissociation and recombination of H2 over the temperature range 1000-5000 K are calculated in a nonempirical manner. The computation procedure involves the calculation of the state-to-state energy transfer rate coefficients, the solution of the 349 coupled equations which form the master equation, and the determination of the phenomenological rate coefficients. The nonempirical results presented here are in good agreement with experimental data at 1000 and 3000 K.

Schwenke, David W.↗
NASA NTRS1990

On the dissociation energy of BH

The dissociation energy D(0) of the X 1Sigma(+) state has been determined to be 81.5 + or - 0.5 kcal/mol. This value includes an estimate for basis set incompleteness and for core-core and core-valence correlation. The barrier in the A 1Pi state potential is estimated to be 1.9 + or - 0.2 kcal/mol. By analyzing the tunneling through the barrier, it is demonstrated that D(0) and the predissociation limit differ by about 0.8-0.9 kcal/mol. Thus the experimental predissociation limit of 82.5 + or - 0.4 kcal/mol is consistent with the values computed for D(0) and the barrier in this work.

Bauschlicher, Charles W., Jr.↗
NASA NTRS1990

Theoretical study of the C-H bond dissociation energy of acetylene

The authors present a theoretical study of the convergence of the C-H bond dissociation energy (D sub o) of acetylene with respect to both the one- and n-particle spaces. Their best estimate for D sub o of 130.1 plus or minus 1.0 kcal/mole is slightly below previous theoretical estimates, but substantially above the value determined using Stark anticrossing spectroscopy that is asserted to be an upper bound.

Taylor, Peter R.↗
NASA NTRS1990

Theoretical study of the C-H bond dissociation energy of C2H

A theoretical study of the convergence of the C-H bond dissociation energy D(0) in C2H with respect to both the one- and n-particle spaces is presented. The calculated C-H bond energies of C2H2 and C2H4, which are in excellent agreement with experiment, are used for calibration. The best estimate for D(0) of 112.4 + or - 2.0 kcal/mol is slightly below the recent experimental value of 116.3 + or - 2.6 kcal/mol, but substantially above a previous theoretical estimate of 102 kcal/mol. The remaining discrepancy with experiment may reflect primarily the uncertainty in the experimental D(0) value of C2 required in the analysis.

Bauschlicher, Charles W., Jr.↗