Sasidharan, Nair S; Dr.Babu, Joseph K(Cochin University of Science and Technology, 1977)
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Abstract:
The present thesis deals with some studies in molecular dynamics using spectroscopic data. Two new approximation procedures the variable method and the average bonding energy criterion have been developed for a reliable calculation of molecular force fields and applied to several molecular species belonging to the xy2 type.
Description:
Department of Physics, Cochin University of Science & Technology