Coupled Anharmonic Vibrational Dynamics of the Hydrogen Bond in Binary Complexes

Coupled Anharmonic Vibrational Dynamics of the Hydrogen Bond in Binary Complexes

We report anharmonic vibrational analyses of the coupling between the red-shifted high frequency HFstretching vibrations and low frequency intermolecular modes in the hydrogen-bonded complexes thiirane-HF and H2 O-HF. The important non-diagonal anharmonicities found in high-level ab initio...

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Bibliographic Details
Main Authors: Manuel Goubet, Bruno Madebène, Marius Lewerenz
Format: Article
Language:deu
Published: Swiss Chemical Society 2004-05-01
Series:CHIMIA
Subjects:
Hydrogen-bonded complexes
Hydrogen fluoride
Thirane
Vibrational dynamics
Water
Online Access:https://chimia.ch/chimia/article/view/3848

Internet

https://chimia.ch/chimia/article/view/3848

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