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Derivation of many-body potentials for b.c.c. metals

 

作者: James Eridon,   Satish Rao,  

 

期刊: Philosophical Magazine Letters  (Taylor Available online 1989)
卷期: Volume 59, issue 1  

页码: 31-35

 

ISSN:0950-0839

 

年代: 1989

 

DOI:10.1080/09500838908214773

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

A method of deriving the shape of pair potentials describing both the long- and short-wavelength behaviour of b.c.c. metals within the Finnis-Sinclair many-body-potential model is described. The method guarantees a fit to both the elastic constants and zone-boundary vibrational frequencies of b.c.c. metals using the five nearest-neighbour shells in the b.c.c. structure. The application of the method to niobium is briefly discussed and compared with previous work.

 

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