A new method for computing vibrational force constants
Abstract
Initial tests of the method of Fletcher and Powell suggest that it overcomes all the computational difficulties associated with older methods.
Initial tests of the method of Fletcher and Powell suggest that it overcomes all the computational difficulties associated with older methods.
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P. Gans, J. Chem. Soc. D, 1970, 1504 DOI: 10.1039/C29700001504
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