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Electronic properties of polymers including C60

✍ Scribed by Kazuyoshi Tanaka; Yukihito Matsuura; Yoshiaki Oshima; Tokio Yamabe


Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
283 KB
Volume
237
Category
Article
ISSN
0009-2614

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✦ Synopsis


The electronic properties of the polymer models involving C6o molecules incorporated into either polymer skeleton or side chain are first examined based on the one-dimensional (1D) tight-binding crystal orbital method in the framework of the extended Hiickel approximation. The band structure characteristic of each polymer model is discussed particularly with respect to the interruption of the w-conjugation of the rest of the main chain.


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Electronic properties of the C60 molecul
✍ Daniel Γ–stling; A. RosΓ©n πŸ“‚ Article πŸ“… 1993 πŸ› Elsevier Science 🌐 English βš– 404 KB

Molecular cluster calculations within the local density approximation have been performed in a study of the electronic structure of C& doped with K, where the K atom has been located inside or outside the cage. The results support our earlier calculations for endohedral KCso as well as those for end