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Title:
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Studies in molecular dynamics: new criteria for evaluation of intramolecular force fields |
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Author:
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Sasidharan, Nair S; Dr.Babu, Joseph K
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Abstract:
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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. |
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Description:
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Department of Physics, Cochin University of Science & Technology |
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URI:
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http://dyuthi.cusat.ac.in/purl/3333
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Date:
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1977 |