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Combining DFT, Cluster Expansions, and KMC to Model Point Defects in Alloys
Combining DFT, Cluster Expansions, and KMC to Model Point Defects in Alloys
2017
Normand Arthur Modine
Alan F. Wright
Stephen R. Lee
Stephen M. Foiles
Corbett Chandler. Battaile
John C. Thomas
A. Van der Ven
Keywords:
Computational chemistry
Crystallographic defect
Materials science
Condensed matter physics
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