Modelling the structure of clusters of C_60 molecules

We locate putative global minima for (C_60)_N clusters modelled by the potential of Pacheco and Prates-Ramalho up to N=105. These minima are based on icosahedral packing up to N=15, but above this size the lowest-energy structures are decahedral or close-packed. Although structures based on the 98-m...

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書目詳細資料
Main Authors: Doye, J, Wales, D, Branz, W, Calvo, F
格式: Journal article
語言:English
出版: American Physical Society 2001