Torsional eigenvalues of the water trime
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Chona S. Guiang; Robert E. Wyatt
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Article
📅
1998
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John Wiley and Sons
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English
⚖ 289 KB
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Eigenvalues corresponding to the three torsional degrees of freedom were calculated for the water trimer and its deuterated isotopomer in four sets of calculations involving different potential energy surfaces. The four potential surfaces were developed in this work by reparametrization of the CKL f