Abstract
A simple and effective approach for the enumeration of fullerene structures is proposed. The method combines the formalism of a fullerene graph cut-and-unfold onto a planar triangular lattice and a topological description of closed quasi-2D clusters. A tabulation of possible fullerene graphs Cn is given for the number of atoms 20 < or = n < or = 150.
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More From: Journal of chemical information and computer sciences
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