Conformational analysis of p-terphenyl b
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K. Honda; Y. Furukawa
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Article
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2005
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Elsevier Science
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English
⚖ 176 KB
The structures, vibrational frequencies, and infrared and Raman intensities of p-terphenyl have been calculated by the density functional theory method at the B3LYP/6-311CG\*\* level. On the basis of the results, the infrared and Raman spectra of p-terphenyl in solution and in the melt have been ana