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arXiv · 0902.1599

Structural stability of the $B_{80}$ fullerene against defect formation

Kuo Bao·Stefan Goedecker·Luigi Genovese·Alexey Neelov·S. Alireza Ghasemi·Thierry Deutsch
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Abstract

Using a systematic search algorithm we identify several types of point defects in the boron fullerene with 80 atoms. All these point defect leave the cage structure intact. In addition the cage structure is also very stable with respect to elastic deformations and addition or removal of atoms.

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Kuo Bao, Stefan Goedecker, Luigi Genovese, Alexey Neelov, S. Alireza Ghasemi, Thierry Deutsch. 2009-02-10. Structural stability of the $B_{80}$ fullerene against defect formation. https://arxiv.org/abs/0902.1599

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