Calculation of molecular polarizabilities: the indo method applied to some aromatic hydrocarbons1 |
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Authors: | P.J. Bounds |
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Affiliation: | Department of Chemistry, UMIST, Manchester M60 1QD, UK |
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Abstract: | Molecular polarizabilities calculated by the all valence electron INDO method are reported for benzene, naphthalene, anthracene, phenanthrene, biphenyl and p-terphenyl. For these molecules INDO is better than other semi-empirical methods at predicting the polarizability anisotropy. |
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Keywords: | Present address: Division of Chemistry National Research Council of Canada Ottawa Canada K1A OR6. |
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