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Potential functions of the stretching, bending, and twisting vibrations of the O-H bond of alcohols in intermolecular and ion-molecular H-complexes

โœ Scribed by L. A. Gribov; T. T. El'meneva; I. S. Perelygin

Publisher
SP MAIK Nauka/Interperiodica
Year
1980
Tongue
English
Weight
573 KB
Volume
20
Category
Article
ISSN
0022-4766

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๐Ÿ“œ SIMILAR VOLUMES

An ab initio calculation of symmetric be
An ab initio calculation of symmetric bending and stretching vibrational states of the H3O+ and D3O+ ions
โœ Norihiro Shida; Kiyoshi Tanaka; Kimio Ohno ๐Ÿ“‚ Article ๐Ÿ“… 1984 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 303 KB

Calculations are reported for the symmetric bending and stretching vibrational states of H30f and D30' including coupling between these two modes. The calculations were carried out by using a potential surface calculated by the SCT Cl method and expressed in terms of symmetric internal coordinates\_