Abstract
This chapter provides the accurate ab initio dipole moment surfaces and comparison of ν3 strongest line intensities from empirical HITRAN data with their ab initio calculated values of 16O3 measured using the MRCI-SD method with three basis sets on a dense grid of about 1950 geometrical configurations.
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Guelachvili, G., Picqué, N. (2019). 16O3 Accurate Ab Initio Dipole Moment Surfaces. Comparison of ν3 Strongest Line Intensities from Empirical HITRAN Data with Their Ab Initio Calculated Values. In: Guelachvili, G. (eds) Molecular Constants Mostly from Infrared Spectroscopy. Molecules and Radicals, vol 20C2. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-662-57960-2_142
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DOI: https://doi.org/10.1007/978-3-662-57960-2_142
Publisher Name: Springer, Berlin, Heidelberg
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