论文部分内容阅读
Heat capacities of small aluminium clusters Al11-20 are investigated using MD simulation with empirical manybody 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.