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Heat of segregation of single substitutional impuritiesThe method of Bozzolo, Ferrante and Smith (BFS) is applied for the calculation of the heat of segregation of single substitutional impurities in fcc metals. A simple equation for predicting the heat of segregation is derived for the rigid case (no atomic relaxations). The results of including atomic relaxation using a Monte Carlo method are also presented and the results compared with a number of experimental and theoretical results.
Document ID
19930068876
Acquisition Source
Legacy CDMS
Document Type
Reprint (Version printed in journal)
External Source(s)
doi:10.1016/0039-6028(93)90896-R
Authors
Bozzolo, Guillermo (Analex Corp., Brook Park; NASA, Lewis Research Center Cleveland, OH, United States)
Good, Brian (NASA Lewis Research Center Cleveland, OH, United States)
Ferrante, John (NASA Lewis Research Center Cleveland, OH, United States)
Date Acquired
August 16, 2013
Publication Date
January 1, 1993
Publication Information
Publication: Surface Science
ISSN: 0039-6028
Subject Category
Inorganic And Physical Chemistry
Accession Number
93A52873
Distribution Limits
Public
Copyright
Other

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