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Influence of charge on the geometry of C60

 

作者: P.W. Fowler,  

 

期刊: Philosophical Magazine Letters  （Taylor Available online 1992）
卷期: Volume 66, issue 5  

页码: 277-279

 

ISSN:0950-0839

 

年代: 1992

 

DOI:10.1080/09500839208219045

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

Qualitative molecular orbital considerations rationalize computed differences in geometry between C60and C6-60and suggest that recent local-density-functional calculations give an incorrect picture of charge vibration coupling in Cg3-60.

 

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