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Mapping the magic numbers in binary Lennard-Jones clusters | | Jonathan P. K. Doye
; Lars Meyer
; | | Rating: | Visitors: 5/5 (1 visitor) | | Date: |
27 Apr 2005 | | Journal: | Phys. Rev. Lett. 95, 063401 (2005) DOI: 10.1103/PhysRevLett.95.063401 | | Subject: | Materials Science; Atomic and Molecular Clusters | cond-mat.mtrl-sci physics.atm-clus | | Abstract: | Using a global optimization approach that directly searches for the composition of greatest stability, we have been able to find the particularly stable structures for binary Lennard-Jones clusters with up to 100 atoms for a range of Lennard-Jones parameters. In particular, we have shown that just having atoms of different size leads to a remarkable stabilization of polytetrahedral structures, including both polyicosahedral clusters and at larger sizes structures with disclination lines. | | Source: | arXiv, cond-mat/0504726 | | Other source: | [GID 469363] pmid16090950 | | Services: | Forum | Review | PDF | Favorites | |
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