First-principles study of Si and Mg segregation in grain boundaries in Al and Cu: application of local-energy decomposition

Title
First-principles study of Si and Mg segregation in grain boundaries in Al and Cu: application of local-energy decomposition
Authors
Keywords
Impurity Atom, Impurity Segregation, Segregation Energy, Segregation Site, Back Bond
Journal
JOURNAL OF MATERIALS SCIENCE
Volume 50, Issue 21, Pages 6864-6881
Publisher
Springer Nature
Online
2015-07-31
DOI
10.1007/s10853-015-9294-4

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