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Structural and electronic properties of large fullerenes (1993)

Wang, X. Q. ; Wang, C. Z. ; Zhang, B. L. ; [et al.]

Springer

The European physical journal 26 (1993), S. 264-266

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ISSN: 1434-6079

Keywords: 36.40.+d ; 33.10.−n ; 34.20.cf

Source: Springer Online Journal Archives 1860-2000

Topics: Physics

Notes: Abstract We present the results of a first-principles calculation for the geometrical and electronic structure of C78 and C84 fullerene isomers. Our study confirms that for C84 two isomers withD 2 andD 2d symmetries are the most energetically favorable, and for C78 aC 2v isomer is the ground-state configuration. Results from the present calculation are compared with recent experimental observations.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1007/BF01425685

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