The optimal geometry of Lennard-Jones clusters: 148-309

DOI10.1016/S0010-4655(99)00259-3MaRDI QIDQ1961791zbMATH OpenOpenAlexFDO

Authors Yanyan Li

Publication date 10 April 2000

Published in Computer Physics Communications (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/s0010-4655(99)00259-3

zbMATH Keywords

genetic algorithmglobal optimizationicosahedral latticeLennard-Jones clustersn-atom cluster configurationstochastic search procedure

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) Atomic physics (81V45)

Cited in

(3)

• Optimal atomic-resolution structures of prion AGAAAAGA amyloid fibrils
• On the global minimum of the classical potential energy for clusters bound by many-body forces
• Objective function features providing barriers to rapid global optimization

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