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Physical perspectives on the global optimization of atomic clusters | | Jonathan Doye
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21 Jul 2000 | | Subject: | Condensed Matter; Atomic and Molecular Clusters | cond-mat physics.atm-clus | | Abstract: | In this chapter the physical aspects of the global optimization of the geometry of atomic clusters are elucidated. In particular, I examine the structural principles that determine the nature of the lowest-energy structure, the physical reasons why some clusters are especially difficult to optimize and how the basin-hopping transformation of the potential energy surface enables these difficult clusters to be optimized. | | Source: | arXiv, cond-mat/0007338 | | Services: | Forum | Review | PDF | Favorites | |
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