Memoirs of the Faculty of Engineering, Okayama University 29巻 2号
1995-03-27 発行
東辻 千枝子
Department of Electrical and Electronic Engineering
Matsubara Takeo
Okayama University of Science
Obuchi Masumi
Okayama University of Science
The π-electron band of C(60) molecule has been obtained by the tight binding approximation. Application of molecular orbital wave functions derived on the basis of the optimized bond orbital model gives, with simpler calculations, the results in satisfactory agreement with those of previous theoretical analyses.