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- W2023625039 abstract "Abstract Through a joint experimental and theoretical study we assess the effect of random 13 C substitution in the vibrational spectra of 12 C 60− x 13 C x . First, Raman data are gathered for a 25% 13 C-substituted sample. Then, we randomly generate an ensemble of isotopomers of 12 C 60− x 13 C x , with x =19, 36. For all these isotopomers we calculate the vibrational frequencies and normal modes and project them onto the space of the normal modes of 12 C 60 to yield mode scrambling matrices. The accumulation of the resulting mode scrambling matrices gives the frequency dispersion upon random isotopic substitution. Both experiment and theory find that the dispersion of the lower-frequency vibration is multimodal." @default.
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- W2023625039 date "1993-08-01" @default.
- W2023625039 modified "2023-09-27" @default.
- W2023625039 title "Scattering of the vibrational frequencies of 13C12C60−. A Raman spectroscopy and quantum chemical study" @default.
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- W2023625039 doi "https://doi.org/10.1016/0009-2614(93)87072-b" @default.
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