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Digitale Medien

Variational calculations of vibrational and vibration-rotational properties of ozone (1989)

Anmin, Tian ; Ruifeng, Liu ; Zemin, Sun ; [weitere]

New York, NY : Wiley-Blackwell

International Journal of Quantum Chemistry 36 (1989), S. 765-771

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Details

ISSN: 0020-7608

Schlagwort(e): Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics

Quelle: Wiley InterScience Backfile Collection 1832-2000

Thema: Chemie und Pharmazie

Notizen: Vibrational and vibration-rotational energy levels of ozone and its isotopic substitutes have been calculated variationally by the ladder operator method. Thirty vibrational band origins and rotational energies of vibrational ground states for these molecules have been given. The good agreement between the calculated results and the observed values shows that the calculation method is a promising one for variational studies of vibrational and vibration-rotational properties of nonlinear polyatomic molecules.

Zusätzliches Material: 7 Tab.

Materialart: Digitale Medien

URL: http://dx.doi.org/10.1002/qua.560360608

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