標題: Interface Theory of Benzenoids: Basic Applications
作者: Langner, Johanna
Witek, Henryk A.
交大名義發表
應用化學系分子科學碩博班
National Chiao Tung University
Institute of Molecular science
公開日期: 1-一月-2020
摘要: We show that the recently introduced interface theory of benzenoids [Langner and Witek, MATCH Commun. Math. Comput. Chem. (2020)] can be readily applied to characterize various properties of benzenoids and their Clar covers. A carefully selected collection of examples demonstrates how to use interface theory for detecting non-Kekulean or essentially disconnected character of benzenoids, computing their Clar numbers, constructing and enumerating their Kekule structures and Clar covers, and determining their Zhang-Zhang polynomials. The exposition has rather pedagogical character and is supposed to familiarize the reader with the basic toolkit of the interface theory of benzenoids.
URI: http://hdl.handle.net/11536/154355
ISSN: 0340-6253
期刊: MATCH-COMMUNICATIONS IN MATHEMATICAL AND IN COMPUTER CHEMISTRY
Volume: 84
Issue: 1
起始頁: 177
結束頁: 215
顯示於類別:期刊論文