With the help of the topological structures of the dihedral D , D , D ; p ph pd . ps5, 6 fullerenes, we have derived the formulas for the decomposition of their nuclear motions into irreducible representations. So their infrared and Raman active modes have been obtained. Furthermore, by use of the
Vibrational spectra of icosahedral (Ih and I) fullerenes
β Scribed by Au Chin Tang; Qian Shu Li; Wei Cheng
- Publisher
- John Wiley and Sons
- Year
- 1998
- Tongue
- English
- Weight
- 161 KB
- Volume
- 66
- Category
- Article
- ISSN
- 0020-7608
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β¦ Synopsis
On the bases of the topological structures of the three big classes of Ε½ . Ε½ 2 . Ε½ . Ε½ 2 .
π SIMILAR VOLUMES
On analyzing the topological structures of the three big types of Ε½ . Ε½ 2 . Ε½ . Ε½ 2 .
Geometry, vibrational and NMR spectra of the icosahedral aza-closo-dodecaborane MeNB 11 H 11 are calculated by ab initio methods. The results are compared with experimental data. They are in accord with local C 5v symmetry of the cluster unit and local C 3v symmetry of the methyl group. The boron at
In this article, a new method was proposed to solve the Huckel Hamiltonian of any fullerene with a certain point group as its symmetry. This method was applied to Ε½ 2 . calculate the energy levels of icosahedral fullerenes C I , n s 60 h , 25 G h ) 0 , C . I , n s 20 h , 39 G h ) 0 , and C I, n s 2
The vibrational spectra of three cyclic phosphazene molecules, [N 3 P 3 Cl 4 (O 2 C 12 H 8 )] (CP1), [N 3 P 3 Cl 2 (O 2 C 12 H 8 ) 2 ] (CP2) and [N 3 P 3 (O 2 C 12 H 8 ) 3 ] (CP3), are reported. The far-infrared, infrared and Raman spectra were recorded. The assignment of fundamental vibrational mod
The IR and Raman spectra of polycrystalline anhydrous orotic acid and its N1, N3, and O12 trideuterated isotopomer are recorded in the 4000 -40 cm Οͺ1 spectral interval as part of a series of vibrational analyses of nucleosides, nucleotides, and related compounds carried out in our laboratory. The fr