The multiradical character of one- and two-dimensional graphene nanoribbons

一维和二维石墨烯纳米带的多自由基特性

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Abstract

When is an acene stable? The pronounced multiradical character of graphene nanoribbons of different size and shape was investigated with high-level multireference methods. Quantitative information based on the number of effectively unpaired electrons leads to specific estimates of the chemical stability of graphene nanostructures.

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