The graph of atomic orbitals and its basic properties. 1. Wiener index

Ivan Gutman, Andrey A. Toropov, Alla P. Toropova

Research output: Contribution to journalArticlepeer-review

Abstract

The graph of atomic orbitals (GAO) is a novel type of molecular graphs, recently put forward by two of the present authors. The definition of GAO is re-stated in precise graph theoretic terms. A connection between the Wiener index of GAO and the Wiener index of the ordinary molecular graphs, both hydrogen-depleted and hydrogen-filled, is established.

Original languageEnglish
Pages (from-to)215-224
Number of pages10
JournalMatch
Volume53
Issue number1
Publication statusPublished - 2005

ASJC Scopus subject areas

  • Chemistry(all)
  • Computer Science Applications
  • Computational Theory and Mathematics
  • Applied Mathematics

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