The result of an ab initio investigation on the hypothetical system N C 8 12 is presented. This is a fullerene-like structure with T symmetry. Calculations have been h Ž . Ž . performed at self-consistent field SCF , second-order Møller-Plesset MP2 , and density Ž . Ž . functional theory DFT level,
✦ LIBER ✦
Characteristics of the Li n C 60 Complexes for n = 1−6 and 12: An ab Initio Study
✍ Scribed by Aree, Thammarat; Hannongbua, Supot
- Book ID
- 126002487
- Publisher
- American Chemical Society
- Year
- 1997
- Tongue
- English
- Weight
- 366 KB
- Volume
- 101
- Category
- Article
- ISSN
- 1089-5639
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