Abstract
Using the ro-vibrational wave functions from a recent ab initio quantum dynamical calculation in combination with an empirical dipole function deduced from the collision induced far infrared spectrum of gaseous nitrogen, we have calculated the intensities of far infrared transitions in (N2)2 dimers. Employing, moreover, the multipole moment and polarizability derivatives from ab initio calculations on N2 monomers, we have estimated intensities of near infrared transitions. It is demonstrated that the dimer infrared spectra depend sensitively, not only on the intermolecular potential, but also on the different contributions to the N2-N2 interaction induced dipole function.
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Brocks, G., van der Avoird, A. (1985). Contribution of Bound Dimers, (N2)2, To the Interaction Induced Infrared Spectrum of Nitrogen. In: Birnbaum, G. (eds) Phenomena Induced by Intermolecular Interactions. NATO ASI series, vol 127. Springer, Boston, MA. https://doi.org/10.1007/978-1-4613-2511-6_39
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DOI: https://doi.org/10.1007/978-1-4613-2511-6_39
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