Article ID Journal Published Year Pages File Type
5430703 Journal of Quantitative Spectroscopy and Radiative Transfer 2008 14 Pages PDF
Abstract

Using ab initio calculated potential energy and electric dipole moment functions, absolute radiative transition probabilities between the rovibronic Renner-Teller states of the electronic ground state X2Πg of CO2+ have been evaluated. The rovibronic eigenstates were obtained (up to 6500cm-1 and J⩽132) from variational calculations including the Renner-Teller and spin-orbit angular momentum couplings. The absolute intensities for the rovibrational states of the neutral CO2 electronic ground state, calculated by a similar approach, are found to be in excellent agreement with experimental data. For CO2+ the presented results are expected to have similar accuracy. It is found that the overtone intensities of the antisymmetric stretching mode of CO2+ are of similar magnitude as the fundamental transitions, in contrast with CO2. The theoretically generated IR-emission spectrum is compared with the limb spectrum of the Mars atmosphere, measured by the Thermal Emission Spectrometer on Mars Global Surveyor.

Related Topics
Physical Sciences and Engineering Chemistry Spectroscopy
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