Force constant computations,part IV: Extremal nature of force constant solutions with a singular jacobian |
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Authors: | P Gans |
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Institution: | Department of Inorganic and Structural Chemistry, The University, Leeds LS2 9JT, UK |
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Abstract: | Force constant solutions to the vibrational secular equations for which the jacobian is singular are shown to have the extremal property (∂Frr/∂Fst) = ∞ for all r. |
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