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S matrix elements for diatomic molecule rotational excitation by scattered atom computed by Amplitude Density Functions method
Quadrupole-quadrupole interaction constant for Se and halogen diatomic molecules, discussing long range interatomic forces determination
Degeneracy averaged cross sections for collisions between diatomic molecules reformulated, using diagrammatic methods to manipulate vector coupling coefficients
Electron impact cross sections for diatomic molecule ionization and excitation from modified Gryzinski theory, discussing results from molecular models
Semiclassical model for autoionization of diatomic molecules
Rotational excitation and scattering of diatomic molecules by structureless atoms, comparing approximation methods
Coupled Schroedinger equations for diatomic molecules internal motion solved using best adiabatic approximation to obtain energy correction to Born-Oppenheimer method
Scattering equations and cross sections for rotational excitation in collisions of rigid diatomic molecules interacting through soft potential
Diatomic molecules inelastic collision cross sections for specific rotational transitions, discussing S matrix energy requirements for statistical analysis
Strong coupled rotational excitation problem in atom-diatomic molecule scattering system, discussing transition probability matrices statistical analysis
Diatomic molecules nonsigma states rotational excitation adiabatic theory
Discussion of the factors affecting the intensity of forbidden transitions in diatomic molecules. It is shown that using Franck-Condon factors to predict relative band intensities is less reliable for forbidden transitions than it is for allowed transitions. The intensity of the 0,0 and 1,0 bands of the a super 3 pi-super 1 sigma Cameron system of CO are calculated using perturbation theory. The intensity arises from spin-orbit mixing of the A super 1 pi state with the a super 3 pi state. From the known spin-orbit coupling constant of the a super 1 pi state and the known intensity of the fourth positive A super 1 pi-super 1 sigma transition, the oscillator strengths of the 0,0 and 1,0 bands are calculated to be 1.63 x 10 to the minus 7th power and 1.99 x 10 to the minus 7th power. Lifetimes of various rotational levels are shown to range from 2.9 to several hundred milliseconds.-
The adiabatic-nuclei theory is shown to be quantitatively applicable to vibrational excitation of diatomic molecules by electron impact. When the dependence of the fixed-nuclei phase shifts on internuclear separation is approximated by a two-term Taylor series, the resulting formulas are transparent and easily evaluated. Application to e-H2 excitation is made, phase-shift derivatives are estimated, and the theory is found to fit experimental data.
The essential features of the translational energy dependence or excitation function for two types of endoergic collisional processes are deduced on the basis of information on the inverse, exoergic processes. Microreversibility is conveniently exploited via the symmetric field function, Y(E), which is uniquely determined at a given total energy, E. In the case of the vibrational excitation of diatomic molecules by atomic or molecular impact, use is made of the abundant data on the temperature dependence of the relaxation time.
Predissociation by rotation and curve crossing in diatomic molecules is discussed. The pattern of predissociation line widths is seen as providing a highly sensitive yardstick for the determination of unknown potential curves. In addition, the computation of such a pattern for given potential curves is considered a matter of routine, unless the predissociation happens to occur from an adiabatic potential curve. Analytic formulas are used to provide physical insight into the details of the predissociation pattern, to the extent that a direct inversion procedure is developed for determination of the repulsive potential curves for Type 1 predissociations.
The Fire 1 test was designed to study the heating of an Apollo-type reentry vehicle. The total reentry complex weighed approximately 230 kg and entered the upper atmosphere at a velocity of 11.5 km/s. The spectrum of the reentry complex has been studied in the wavelength range 3700 to 8800 A, where 102 multiplets of 21 atoms and the band systems of 5 diatomic molecules have been identified. Comparisons with meteor spectra are made.
Experimental results are presented for the vibrational relaxation of pure carbon monoxide behind incident shock waves over the temperature range 4000 to 6300 K. The data were obtained as infrared emission from the fundamental and overtone vibrational band systems (in some of the experiments the two-band systems were recorded simultaneously). The data are consistent with present theories for the vibrational relaxation of diatomic molecules and can be interpreted in terms of an initial Boltzmann vibrational distribution relaxing toward final equilibrium via a continuous sequence of intermediate Boltzmann distributions.
Statistical equilibrium of electronic states of diatomic molecules in stellar atmospheres is examined. Atmospheres discussed are representative of the sun, Arcturus (K-giant) and Betelgeuse (M-supergiant). A comparison of the relative collisional and radiative contributions to the equilibrium of the ground electronic state shows that this state is collisionally controlled and that the line source function for vibration-rotation transitions within this state is equivalent to the Planck function. Examination of the equilibrium for excited electronic states demonstrates that the exchange between these states and the ground electronic state is most probably determined by radiative excitation. This result implies that scattering rather than pure absorption is the appropriate mechanism for the formation of lines belonging to these electronic transitions. The scattering hypothesis is given a preliminary check against solar observations. Areas for future investigations are outlined.