Melting Transition of Small Aluminium Clusters Al11-20
-
Abstract
Heat capacities of small aluminium clusters Al11-20 are investigated using MD simulation with empirical many-body Gupta potential. The heat capacities of some clusters Al11, Al12, Al13 and Al19 show well-defined peaks while the
heat capacities of Al15-18 indicate a gradual melting transition. The spectra of isomers obtained by quenches along the MD trajectory give good interpretation for those results. -