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Dimensionality Reduction Methods for Rotovibrational Cross Section Calculations

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The Transfer of Molecular Energies by Collision: Recent Quantum Treatments

Part of the book series: Lecture Notes in Chemistry ((LNC,volume 11))

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Abstract

In the previous Chapter we established the fundamental theory describing physical and chemical aspects, on a microscopic level, of the elastic and inelastic collisions between molecules in their ground electronic states. The whole formulation of that theory was given by quantum mechanics based on the Schrödinger equation and it was made clear that the most systematic approximations used to provide possible numerical treatments involve the expansion of the total wavefunction for the system under study in terms of a unperturbed basis set of known, exact or nearly exact, functions.

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Authors and Affiliations

  1. Institute of Physical Chemistry, The University of Bari, Via Amendola 173, Bari, Italy

    Franco Antonio Gianturco

  2. Quantum Chemistry Laboratory, (L.C.Q.E.M), C.N.R., Pisa, Italy

    Franco Antonio Gianturco

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  1. Franco Antonio Gianturco
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Gianturco, F.A. (1979). Dimensionality Reduction Methods for Rotovibrational Cross Section Calculations. In: The Transfer of Molecular Energies by Collision: Recent Quantum Treatments. Lecture Notes in Chemistry, vol 11. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-93122-2_5

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  • DOI: https://doi.org/10.1007/978-3-642-93122-2_5

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