schultz index of armchair polyhex nanotubes舒尔茨指数扶手椅六面体纳米管.pdfVIP

schultz index of armchair polyhex nanotubes舒尔茨指数扶手椅六面体纳米管.pdf

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schultz index of armchair polyhex nanotubes舒尔茨指数扶手椅六面体纳米管

Int. J. Mol. Sci. 2008, 9, 2016-2026; DOI: 10.3390/ijms9102016 OPEN ACCESS International Journal of Molecular Sciences ISSN 1422-0067 /journal/ijms Article Schultz Index of Armchair Polyhex Nanotubes Mehdi Eliasi and Nafiseh Salehi Islamic Azad University Najafabad Branch, Isfahan, Iran; E-Mail: nsalehi@iaun.ac.ir Author to whom correspondence should be addressed. E-mail: eliasi@math.iut.ac.ir Received: 3 July 2008; in revised form: 23 August 2008 / Accepted: 14 October 2008 / Published: 29 October 2008 Abstract: The study of topological indices – graph invariants that can be used for describing and predicting physicochemical or pharmacological properties of organic compounds – is currently one of the most active research fields in chemical graph theory. In this paper we study the Schultz index and find a relation with the Wiener index of the armchair polyhex nanotubes . An exact expression for Schultz index of this molecule is also found. Keywords: Topological index; Wiener index; Schultz index; Armchair nanotube; Molecular graph; Distance; Carbon Nanotube. 1. Introduction Topological indices are a convenient method of translating chemical constitution into numerical val- ues that can be used for correlations with physical, chemical or biological properties. This method has been introduced by Harold Wiener as a descriptor for explaining the boiling points of paraffins [ 1–3]. If is the distance of the vertices and of the undirected connected graph (i.e., the numb

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