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Concerning a new method for the determination of vibrational force constants of molecules

โœ Scribed by D.E Freeman

Publisher
Elsevier Science
Year
1967
Tongue
English
Weight
321 KB
Volume
22
Category
Article
ISSN
0022-2852

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๐Ÿ“œ SIMILAR VOLUMES

A new method for the calculation of vibr
A new method for the calculation of vibrational force constants. Application to H2
โœ L.L. Shipman; R.E. Christoffersen ๐Ÿ“‚ Article ๐Ÿ“… 1971 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 428 KB

A new method for the quantum mechanical ~lci~ktion of vibrational force constants is pressted. This method is applied to the calculation of the viirational force constant of Hz, using a mmpktely optimized wavefunction constructed from a sing% gaussian orbitaL The mhe of the face constant obtained us

Determination of vibrational quantum num
Determination of vibrational quantum numbers of diatomic molecules using a variational method
โœ C.R. Vidal ๐Ÿ“‚ Article ๐Ÿ“… 1979 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 356 KB

The method is based on a variational method xxhich gives vibrationat quantum nun~brrs for 1, hich the measured term v&es are described by the quantum mechanical energy eisenvatues of a rotating vibrator. The method is applied to the AtE\* states of the 4oCaz .md of the 6LiH molecuk.