Physics of planetary atmospheres III - The time-dependent coupled Hartree-Fock approximation

Coupled Hartree-Fock approximation for calculating frequency-dependent refractive index of helium ga

Potential energy curves for the interaction of Ag(5s) and Ag(5p) with noble gas atoms

We investigate the interaction of ground and excited states of a silver atom with noble gases (NG), including helium. Born-Oppenheimer potential energy curves are calculated with quantum chemistry methods and spin-orbit effects in the excited states are included by assuming a spin-orbit splitting independent of the internuclear distance. We compare our results with experimentally available spectroscopic data, as well as with previous calculations. Because of strong spin-orbit interactions, excited Ag-NG potential energy curves cannot be fitted to Morse-like potentials. We find that the labeling of the observed vibrational levels has to be shifted by one unit

Physics of planetary atmospheres. i- ray- leigh scattering by helium

Physics of planetary atmospheres - Variation method used to calculate Rayleigh scattering cross sections of helium as wavelength functio

Physics of planetary atmospheres ii- the fluorescence of solar ionizing radiation

Calculations of midday dayglow intensities arising from fluorescence of solar ionizing radiatio

Sympathetic cooling of polyatomic molecules with S-state atoms in a magnetic trap

We present a rigorous theoretical study of low-temperature collisions of polyatomic molecular radicals with ^1S_0 atoms in the presence of an external magnetic field. Accurate quantum scattering calculations based on ab initio and scaled interaction potentials show that collision-induced spin relaxation of the prototypical organic molecule CH_2(X^3B_1) (methylene) and nine other triatomic radicals in cold 3He gas occurs at a slow rate, demonstrating that cryogenic buffer-gas cooling and magnetic trapping of these molecules is feasible with current technology. Our calculations further suggest that it may be possible to create ultracold gases of polyatomic molecules by sympathetic cooling with alkaline-earth atoms in a magnetic trap.Comment: 5 pages, 3 figures, 1 tabl

The Atmosphere Explorer and the shuttle glow

Recent analyses of the Atmosphere Explorer data are discussed in which it is demonstrated that the satellite glows have two components, one at high altitudes which is consistent with excitation in single collisions of atmospheric oxygen atoms with the vehicle surface and the other at low altitudes which is consistent with double collisions of nitrogen molecules. Contrary to an earlier suggestion, the low-altitude data are not consistent with collisions of oxygen molecules. The separation of the two components strengthens the conclusion that the high-altitude glow arises from vibrationally excited OH molecules produced by a formation mechanism that is different from that leading to the normal atmospheric OH airglow. The spectrum is consistent with association of oxygen and hydrogen atoms at sites on the surface into the vibrational levels of OH. The low-altitude glow is consistent with the green mechanism but there are difficulties with it. The shuttle glows are different and have the spectral appearance of emission from NO2. The characteristics of the shuttle glows and the satellite glows will be contrasted and a tentative resolution of the differences in the Atmosphere Explorer and shuttle glows will be offered

Molecular processes in comets

Potential energy curves for the two lowest 2 sigma- states of OH are computed at the configuration-interaction level using four different basis sets. Electronic transition dipole moments connecting the excited 1 2 sigma- and 2(D) 2 sigma- states with each other and with he ground X2pi state are presented as functions of internuclear distance. The theoretical absorption oscillator strengths for the D 2 sigma-(v prime=0) reverser to X 2pi (v prime prime=0) transition are in good agreement with the empirical value derived from astronomical measurements. The photodissociation cross sections for absorption rom the v prime prime=0,1, and levels of the ground state into the continuum of the 1 2 sigma- state are calculated, and the interstellar and cometary photodissociation rates are derived

Molecular Processes in Comets

The research focused on molecular hydrogen and its response to ultraviolet radiation, photoelectron impact excitation and X-ray radiation and on the interpretation of the ultraviolet spectra of the Jupiter dayglow and auroras. A systematic effort was made to obtain reliable rate coefficients for rovibrational energy transfer of H2, particularly in collisions with hydrogen atoms. We carried out elaborate quantum-mechanical calculations of the scattering of H and H2 on what had been characterized as a reliable potential energy surface of the H3 molecular system. These calculations took into account reactive channels and rate coefficients for ortho-para transitions were obtained. Quantal calculations are too complex to be applied to all the possible rovibrational transitions and we turned to a semi-classical method. With it we calculated rate coefficients for transitions, reactive and non-reactive, for all the rovibrational levels. We carried out the calculations for three of the available H3 potential energy surfaces. We discovered an unexpected sensitivity of the rate coefficients for the non-reactive channels to the potential energy surface. This discovery stimulated more thorough investigations of the potential energy surface elsewhere and to the construction of a new surface. We have used it in further semi-classical calculations in work that will shortly be 2 completed and which, together with new quantum-mechanical calculations should comprise a set of reliable rate coefficients that can be used in discussions of H2 on the Jovian planets. We carried out a detailed study of the Jovian ultraviolet dayglow. There has been a long-running argument about the dayglow on Jupiter. There are two sources of excitation: fluorescence and photoelectron impact excitation. It had been argued that a third source "the electron glow" was needed to bring theory and observation into agreement. We believe we have shown conclusively that the third source is unnecessary. We have achieved a close quantitative agreement between the predicted spectrum arising from fluorescence and photoelectrons and the measured spectrum. We also demonstrated a method by which the presence of HD could be established observationary. Similar calculations were carried out of the ultraviolet spectra of the Jovian auroras. We again found close agreement. Indeed, the agreement was so detailed we were able to derive the temperature of the atmosphere. We found, contrary to the standard model of the time, a high temperature between 400 K and 600 K and established the presence of a significant temperature gradient. A large temperature gradient was indeed found by direct sampling with the Jupiter probe