Abstract
We report lower and upper bounds for the Harary index of a connected (molecular) graph, and, in particular, upper bounds of triangle- and quadrangle-free graphs. We also give the Nordhaus–Gaddum-type result for the Harary index.
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Plavšić D., Nikolić S., Trinajstić N., Mihalić Z (1993) . On the Harary index for the characterization of chemical graphs. J. Math. Chem. 12: 235–250
Ivanciuc O., Balaban T.S., Balaban A.T. (1993) Reciprocal distance matrix, related local vertex invariants and topological indices. J. Math. Chem. 12: 309–318
O. Ivanciuc and A.T. Balaban, The graph description of chemical structures. in Topological Indices and Related Descriptors in QSAR and QSPR, ed. by J. Devillers, A.T. Balaban (Gordon & Breach, Amsterdam, 1999), pp. 59–167
M.V. Diudea, M.S. Florescu, P.V. Khadikar, Molecular Topology and Its Applications (EfiCon Press, Bucharest, 2006), p. 57
D. Janežič, A. Miličević, S. Nikolić, N. Trinajstić, Graph Theoretical Matrices in Chemistry (Mathematical Chemistry Monographs No. 3, University of Kragujevac, Kragujevac, 2007)
Hosoya H. (1971) Topological index. A newly proposed quantity characterizing the topological nature of structural isomers of saturated hydrocarbons. Bull. Chem. Soc. Japan 44: 2332–2339
Wiener H. (1947) Structural determination of paraffin boiling points. J. Am. Chem. Soc. 69: 17–20
Ivanciuc O., Ivanciuc T., Balaban A.T. (1998) Design of topological indices Part 10 Parameters based on electronegativity and vovalent radius for the computation of molecular graph descriptors for heteroatom-containing molecules. J. Chem. Inf. Comput. Sci. 38, 395–401
Diudea M.V. (1997) Indices of reciprocal properties or Harary indices. J. Chem. Inf. Comput. Sci. 37: 292–299
Lučić B., Miličević A., Nikolić S., Trinajstić N. (2002) Harary index—twelve years later. Croat. Chem. Acta 75: 847–868
J. Devillers, A.T. Balaban (eds.), Topological Indices and Related Descriptors in QSAR and QSPR (Gordon & Breach, Amsterdam, 1999)
R. Todeschini, V. Consonni, Handbook of Molecular Descriptors (Wiley-VCH, Weinheim, 2000)
Mihalić Z., Trinajstić N. (1992) A graph-theoretical approach to structure-property relationships. J. Chem. Educ. 69: 701–712
Ivanciuc O. (2000) QSAR comparative study of Wiener descriptors for weighted molecular graphs. J. Chem. Inf. Comput. Sci. 40: 1412–1422
Lučić B., Lukovits I., Nikolić S., Trinajstić N. (2001) Distance-related indexes in the quantitative structure-property relationship modeling. J. Chem. Inf. Comput. Sci. 41, 527–535
Trinajstić N., Nikolić S., Basak S.C., Lukovits I. (2001) Distance indices and their hyper-counterparts: Intercorrelation and use in the structure-property modeling. SAR QSAR Environ. Res. 12: 31–54
Nordhaus E.A., Gaddum J.W. (1956) On complementary graphs. Amer. Math. Monthly 63, 175–177
Trinajstić N. (1992) Chemical Graph Theory, 2nd revised edn. CRC press, Boca Raton
Gutman I., Trinajstić N. (1972) Graph theory and molecular orbitals. III. Total π-electron energy of alternant hydrocarbons. Chem. Phys. Lett. 17, 535–538
Nikolić S., Kovačević G., Miličević A., Trinajstić N. (2003) The Zagreb indices 30 years after. Croat. Chem. Acta 76, 113–124
Gutman I., Das K.C. (2004) The first Zagreb index 30 years after. MATCH Commun. Math. Comput. Chem. 50, 83–92
Zhou B., Gutman I. (2004) Relationships between Wiener, hyper-Wiener and Zagreb indices. Chem. Phys. Lett. 394, 93–95
Zhou B., Stevanović D. (2006) A note on Zagreb indices. MATCH Commun. Math. Comput. Chem. 56, 571–578
Gutman I. (1997) A property of the Wiener number and its modifications. Indian J. Chem. 36A: 128–132
R.J. Wilson, Introduction to Graph Theory (Oliver & Boyd, Edinburgh, 1972), p. 46
D.M. Cvetković, M. Doob, H. Sachs, Spectra of Graphs—Theory and Application (Johann Ambrosius Barth, Heidelberg, 1995)
B. Zhou, N. Trinajstić, On the maximum eigenvalues of the reciprocal distance matrix and the reverse Wiener matrix. Int. J. Quantum Chem. (in press)
Zhang L., Wu B. (2005) The Nordhaus–Gaddum-type inequalities for some chemical indices. MATCH Commun. Math. Comput. Chem. 54, 183–194
F. Harary, Graph Theory, 2nd edn. (Addison-Wesley, Reading, PA, 1971)
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Dedicated to the memory of Professor Frank Harary (1921–2005), the late grandmaster of both graph theory and chemical graph theory.
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Zhou, B., Cai, X. & Trinajstić, N. On Harary index. J Math Chem 44, 611–618 (2008). https://doi.org/10.1007/s10910-007-9339-2
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DOI: https://doi.org/10.1007/s10910-007-9339-2