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7.1 Matrices 195
v 2
v 1 v 3
v 6 v 4
v 5
FIGURE 7.1 A typical graph.
A walk of length n in a graph is a sequence v 1 ,v 2 ,··· ,v n+1 of points (not necessarily dif-
ferent), with each v j adjacent to v j+1 . Such a walk represents a possible path an atom might take
over n edges (perhaps some repeated) through various sites in the crystal. A v i − v j walk is one
that begins at v i and ends at v j .
Physicists and materials engineers are interested in the following question: given a crystal
with n sites v 1 ,v 2 ,··· ,v n , how many different walks of length k are there between two selected
sites?
Define the adjacency matrix A =[a ij ] of the graph to be the n × n matrix having
1 if v i is adjacent to v j in the graph
a ij =
0 if there is no line between v i and v j in the graph.
The graph of Figure 7.1 has the 6 × 6 adjacency matrix
⎛ ⎞
011100
101000
⎜ ⎟
⎜ ⎟
110100
⎜ ⎟
A = ⎜ ⎟ .
101011
⎜ ⎟
⎜ ⎟
⎝ 000101 ⎠
000110
The main diagonal elements are zero because there is no line between any v i and itself.
We claim that, if k be any positive integer, then the number of distinct v i −v j walks of length
k
k
k in the crystal is the i, j-element of A . The elements of A therefore answer the question posed.
To see why this is true, begin with k = 1. If i = j, there is a walk of length 1 between v i and
v j exactly when v i is adjacent to v j , and in this case a ij = 1.
We next show that, if the result is true for walks of length k, then it must be true for walks
of length k + 1. Consider how a v i − v j walk of length k + 1 is formed. First there must be a
v i − v r walk of length 1 from v i to some v r adjacent to v i ,followedbya v r − v j walk of length k
(Figure 7.2). Then
number of distinct v i − v j walks of length k + 1
= sum of the number of distinct v r − v j walks of length k,
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October 14, 2010 14:23 THM/NEIL Page-195 27410_07_ch07_p187-246