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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