Effect of an electric field on a methane molecule. II. Calculation of the degeneracy splitting of the ν3 band. Expression of the second derivatives of the CH4 dipole moment and evaluation of the second derivative of the C–H bond polarizability
In order to interpret infrared spectra of methane adsorbed in NaA at low temperature, we have calculated the frequencies of CH4 and CD4 perturbed by an electric field. This calculation needs the expressions of the second derivative of the dipole moment and the polarizability. These later were given...
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| Veröffentlicht in: | The Journal of chemical physics 1985-09, Vol.83 (6), p.2653-2660 |
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| Hauptverfasser: | , , |
| Format: | Artikel |
| Sprache: | eng ; jpn |
| Online-Zugang: | Volltext |
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