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A comparison of force fields and calculation methods for vibration intervals of isotopic H+3 molecules

✍ Scribed by Carney, Grady D.; Adler-Golden, Steven M.; Lesseski, David C.


Book ID
120224835
Publisher
American Institute of Physics
Year
1986
Tongue
English
Weight
1007 KB
Volume
84
Category
Article
ISSN
0021-9606

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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