Fourier transform infrared isotopic study of the C12 chain trapped in solid Ar
| Autor: | Shunlin Wang, C. M. L. Rittby, X. D. Ding, W. R. M. Graham |
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| Rok vydání: | 2000 |
| Předmět: |
Infrared
Chemistry Analytical chemistry General Physics and Astronomy Infrared spectroscopy Pulse sequence Molecular physics Fourier transform spectroscopy symbols.namesake Fourier transform Kinetic isotope effect symbols Density functional theory Physical and Theoretical Chemistry Fourier transform infrared spectroscopy |
| Zdroj: | The Journal of Chemical Physics. 112:5113-5120 |
| ISSN: | 1089-7690 0021-9606 |
| DOI: | 10.1063/1.481067 |
| Popis: | A Fourier transform infrared investigation of the 13C isotopic spectrum of linear C12 in solid Ar coupled with density functional theory calculations at the B3LYP/cc-pVDZ level has resulted in the identification of the ν8=1997.2 and ν9=1818.0 cm−1 stretching modes. Agreement between experimental measurements and theory is very good. The identification of a third mode ν7=2140.6 cm−1 is considered tentative. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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