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Electronic Structure of C70 Within the Tight-Binding Approximation |
GU Binglin;LIU Jingnan;HUANG Mingwei;ZHU Jialin |
Department of Physics, Tsinghua University, Beijing 100084 |
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Cite this article: |
GU Binglin, LIU Jingnan, HUANG Mingwei et al 1993 Chin. Phys. Lett. 10 290-293 |
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Abstract The electronic structure of C70 molecule with D5h symmetry has been studied using a simple tight-binding approximation. Comparing the results with those of local -density approximation calculation and experiment, we have determined the hopping matrix element. We have also compared the electronic structure and charge density over cluster of C70 with the results of ellipsoid model, and found the angular momentum and magnetic quantum number (1 and m) of each bunch and level.
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Keywords:
36.40.+d
71.25.Mg
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Published: 01 May 1993
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