Implication methods for the determination of quadratic force constants
Currently the formulation of a valid force constant matrix poses the largest problem in the normal coordinate analysis or the mechanical interpretation of vibrational spectra. Usually a preselected set of trial force constants is iteratively corrected by means of first order perturbation theory and...
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| Language: | English |
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University of British Columbia
2011
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| Online Access: | http://hdl.handle.net/2429/33723 |