期刊
POLYCYCLIC AROMATIC COMPOUNDS
卷 43, 期 5, 页码 4055-4069出版社
TAYLOR & FRANCIS LTD
DOI: 10.1080/10406638.2022.2083193
关键词
Perfect matching (Kekule structure); forcing number; forcing polynomial; double hexagonal (benzenoid) chain
This paper explores the relationship between the Clar number and forcing number in hexagonal systems and introduces the concept of forcing polynomials. By deriving a recurrence relation for the forcing polynomial of double hexagonal chains, explicit forms of forcing polynomials for double linear and zigzag hexagonal chains, as well as some special examples, are obtained.
For hexagonal systems, the maximum forcing number is equal to the Clar number, which is an invariant to estimate the resonance energy. The forcing number of a perfect matching M of a graph G was introduced by Harary et al., which is the smallest cardinality over all subsets of M that are not included by any other perfect matchings of G. The same concept under the name 'degree of freedom' was proposed by Klein and Randic in earlier time. The first author and collaborators introduced the forcing polynomial of a graph as an enumerating polynomial for perfect matchings with the same forcing number. In this paper, we derive a recurrence relation of forcing polynomial for double hexagonal chains, which is a hexagonal system constructed by successive triple-edge fusions of naphthalenes. As consequences, we obtain explicit forms of forcing polynomials for double linear and zigzag hexagonal chains, and some special examples.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据