Ab initio study of structural stability of small 3d late transition metal clusters: Interplay of magnetization and hybridization
Using first-principles density-functional-theory-based calculations, we analyze the structural stability of small clusters of 3d late transition metals. We consider the relative stability of the two structures: layer-like structures with hexagonal closed packed stacking and more compact structures o...
Main Authors: | Datta, Soumendu (Author), Saha-Dasgupta, Tanusri (Author), Kabir, Mohammad Mukul (Contributor) |
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Other Authors: | Massachusetts Institute of Technology. Department of Materials Science and Engineering (Contributor) |
Format: | Article |
Language: | English |
Published: |
American Physical Society,
2011-11-17T18:46:38Z.
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Subjects: | |
Online Access: | Get fulltext |
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