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Vibrational Information Extracted from Inertial Defects: The Complete General Valence Force Field for
1Institut fur Physikalische und Theoretische Chemie, Universitat Tubingen, Tubingen, D-72076, Germany
Journal of Molecular Spectroscopy
|February 25, 1998
Abstract:
The method of extracting harmonic information from inertial defect differences has been used to obtain sufficient information for a determination of the complete force field for 1,1-difluoroethylene. The presumption that inertial defect differences for non-totally-symmetric vibrations of orthorhombic molecules contain purely harmonic information (1992. D. Christen, J. Mol. Spectrosc. 151, 1-11) must be revoked, however. Copyright 1998 Academic Press. Copyright 1998Academic Press