The topological resonance energy method was applied to all the open structure isomers (both cations and anions) of C36X(X=O, NH, S) to investigate their aromaticity.

• 摘要采用拓扑共振能方法对富勒烯C36X(X=O,NH,S)开环结构中的所有可能的异构体及阳离子和阴离子芳香性进行了理论研究。