Vibrational Analysis for C60 and Other Fullerenes
نویسندگان
چکیده
منابع مشابه
Photophysical Properties in C60 and Higher Fullerenes
The optical excitations in C60 and higher fullerenes, including isomers of C76, C78, and C84, are theoretically investigated. We use a tight binding model with long-range Coulomb interactions, treated by the Hartree-Fock and configuration-interaction methods. We find that the optical excitations in the energy region smaller than about 4 eV have most of their amplitudes at the pentagons. The osc...
متن کاملVibrational Spectroscopy of C60
The fullerene era was started in 1985 with the discovery of the stable C60 cluster and its interpretation as a cage structure with the familiar shape of a soccer ball [1]. An explosive growth in fullerene research was triggered in 1990 by the development of a method to produce fullerenes in bulk quantities [2]. Subsequently, the structural, electronic, and vibrational properties of many fullere...
متن کاملTribological properties of fullerenes C60 and C70 microparticles
The frictional behaviors of fullerenes C60 and C70 were studied because they were speculated to be solid lubricants. For the sublimated pure C60 films on Si(001), a high friction coefficient (0.55–0.8) was observed under different loads and pin materials. For the C70 film, the friction coefficient showed a pin dependence, which changed from 0.5 with an Al2O3 pin to about 0.9 with a 440 stainles...
متن کاملOn the Radical Anion Spectra of Fullerenes C60 and C70
The radical anion spectra of C60 and C70 can be easily generated and studied in primary aliphatic amines. In these conditions the C60• and C70• species are accompanied by the dianions C60 and C70. In the near infrared region the electronic transitions at 1075, 1058 and 991 nm were assigned to C60• while those at about 1020-1030 nm and at 933 nm were assigned to the fullerene dianion C60 . The e...
متن کاملVibrational properties of noble gas endohedral fullerenes.
Analysis of IR and Raman spectra of Ar@C(60) and Kr@C(60) shows that the incorporation of noble gas atoms causes a blue shift of low energy vibrations, which have radial character, and a red shift of higher energy ones which have a tangential character movement. The mechanism of these phenomena is explained on the basis of ab initio numerical experiments with DFT and MP2 procedures. Methodologi...
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ژورنال
عنوان ژورنال: Journal of Chemical Education
سال: 2003
ISSN: 0021-9584,1938-1328
DOI: 10.1021/ed080p1380.1