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  • 1
    Digitale Medien
    Digitale Medien
    Springer
    Theoretical chemistry accounts 63 (1983), S. 473-495 
    ISSN: 1432-2234
    Schlagwort(e): Characteristic polynomial ; Chebyshev polynomial ; Topological index ; Structure factor ; Graph
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Chemie und Pharmazie
    Notizen: Abstract The structural dependency (effect of branching and cyclisation) of an alternative form, the Chebyshev expansion, for the characteristic polynomial were investigated systematically. Closed forms of the Chebyshev expansion for an arbitrary star graph and a bicentric tree graph were obtained in terms of the “structure factor” expressed as the linear combination of the “step-down operator”. Several theorems were also derived for non-tree graphs. Usefulness and effectiveness of the Chebyshev expansion are illustrated with a number of examples. Relation with the topological index (Z G ) was discussed.
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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  • 2
    Digitale Medien
    Digitale Medien
    Springer
    Theoretical chemistry accounts 63 (1983), S. 473-495 
    ISSN: 1432-2234
    Schlagwort(e): Characteristic polynomial ; Chebyshev polynomial ; Topological index ; Structure factor ; Graph
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Chemie und Pharmazie
    Notizen: Abstract The structural dependency (effect of branching and cyclisation) of an alternative form, the Chebyshev expansion, for the characteristic polynomial were investigated systematically. Closed forms of the Chebyshev expansion for an arbitrary star graph and a bicentric tree graph were obtained in terms of the “structure factor” expressed as the linear combination of the “step-down operator”. Several theorems were also derived for non-tree graphs. Usefulness and effectiveness of the Chebyshev expansion are illustrated with a number of examples. Relation with the topological index (Z G ) was discussed.
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
    BibTip Andere fanden auch interessant ...
  • 3
    Digitale Medien
    Digitale Medien
    Springer
    Theoretical chemistry accounts 64 (1983), S. 153-170 
    ISSN: 1432-2234
    Schlagwort(e): Polycyclic benzenoid hydrocarbon ; Kekulé structure ; Clar's aromatic sextet ; Sextet polynomial ; Graph theory
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Chemie und Pharmazie
    Notizen: Abstract Mathematical meaning of the Clar's “aromatic sextet” is clarified by analysing the topological dependency of the sextet polynomial. Generalised recursive method for obtaining the sextet polynomial of a polyhex graph is presented. It is shown that the concept of the “super sextet” is necessarily introduced, if one-to-one correspondence between the Kekulé and sextet patterns is assumed. Topological dependency of the maximum number of resonant sextets is clarified and discussed in relation to the aromaticity and stability of polycyclic benzenoid hydrocarbons.
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
    BibTip Andere fanden auch interessant ...
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