Article ID Journal Published Year Pages File Type
5414009 Journal of Molecular Spectroscopy 2017 9 Pages PDF
Abstract

- A modified Local Mode Perturbation Theory (LMPT) model is presented.
- Several different complex types can now be investigated with the LMPT model.
- Transition wavenumbers are accurately predicted by the LMPT model.
- With the LMPT model, accurate equilibrium constants can be determined.
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Vibrational transitions in hydrogen bonded bimolecular complexes - A local mode perturbation theory approach to transition frequencies and intensities
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