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ONE-DIMENSIONAL TREATMENT OF HYDROGEN BOND PART1 THE CASE OF THE LINEAR HYDROGENBOND | ||
Journal of Sciences, Islamic Republic of Iran | ||
مقاله 5، دوره 7، شماره 1، خرداد 1996 اصل مقاله (502.34 K) | ||
چکیده | ||
The one-dimensional model of Lippincott and Schroeder for hydrogen bond has Been re-examined and it has been shown that O-H bond distance depends on repulsive van der Waals and attractive electrostatic potentials.it has been shown that constant b in the van der Waals repulsion potential is not transferable to all hydrogen bonds. The possibility of obtaining the semi-empircal parameters in the Lippincott and Schroeder potential function from OH Stretchihg frequeficies , hydrogen bond energy and geometrical parameters has been discussed | ||
عنوان مقاله [English] | ||
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چکیده [English] | ||
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