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On Construction of the Characteristic Polynomial

Calculating the characteristic polynomial for larger systems could be tedious, but with current computer software, such as MATLAB [7], this is no longer an issue. There are very useful recursion formulas for the characteristic polynomial of acyclic graphs due to Heilbronner [8], the simplest of which is [Pg.101]

Here Ch(G - C) is the characteristic polynomial of a graph G obtained from G by deleting the cycle C and the summation goes over all cycles of the graph G containing the edge mv. Below, we illustrate application of the above recursion on naphthalene (as reported in [11])  [Pg.102]

Some may be skeptical, not about the accuracy of the results but about, in this time of computers, wasting time and energy on something that you can get easily [Pg.102]

FIGURE 4.1 Heilbronner s general recursion expression for the characteristic polynomial of a tree illustrated on a graph of 3-methylhexane. The recursion applies also to the bridge bond of polycyclic graphs. [Pg.102]

Characteristic Polynomials of Carbon Skeletons of n-Alkanes for n = 1 to n = 12 (Path Graphs of Lengths 1-12) [Pg.103]


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