Semiempirical molecular dynamics studies of C60/C70 fullerene oxides: C60O, C60O2 and C70O
โ Scribed by Bo-Cheng Wang; Likey Chen; Kuei-Jen Lee; Chang-Yuan Cheng
- Book ID
- 114143478
- Publisher
- Elsevier Science
- Year
- 1999
- Tongue
- English
- Weight
- 497 KB
- Volume
- 469
- Category
- Article
- ISSN
- 0166-1280
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
Photo-transformation of G, C,,,, C,O, and C,Os in toluene results in destruction of these species. CW and CT0 are transformed with equal rates to form C,O and C,OO. No higher oxides of these fullerenes are formed. C,O is destroyed twice as fast and &,,02 approximately 40-50 times faster than Cs Prod
Semi-empirical, ab initio Hartrce-Fock, and density functional studies (including gradient corrections) on the structures and stabilities of C,O and C&H2 are reported. Two low-energy isomers are found for both compounds which are roughly comparable in energy. These are obtained by bridging across th