Original Scientific Paper
On the Characteristic Polynomial and the Spectrum of the Terminal Distance Matrix of Kragujevac Trees
ABBAS HEYDARI ๏ท
Department of Science, Arak University of Technology, Arak, Iran ARTICLE INFO ABSTRACT
Article History:
Received: 28 April 2021 Accepted: 15 May 2021 Published online: 30 June 2021 Academic Editor: Tomislav Doลกliฤ
In this paper , the characteristic polynomial and the spectrum of the terminal distance matrix of some special types of Kragujevac trees is computed. As an application , we obtain an upper bound and a lower bound for the spectral radius of the terminal distance matrix of the Kragujevac trees.
ยฉ 2021 University of Kashan Press. All rights reserved Keywords:
Kragujevac trees
Characteristic polynomial Terminal distance matrix Spectral radius
1. I
NTRODUCTIONLet ๐บ be a simple connected graph with vertex set ๐(๐บ) = {๐ฃ , ๐ฃ , ๐ฃ , โฆ , ๐ฃ } . For vertices ๐ฃ , ๐ฃ โ ๐(๐บ) ,we denote by ๐(๐ฃ , ๐ฃ ) the topological distance (i.e. , the number of edges on the shortest path) joining the two vertices of ๐บ . The square matrix of order ๐ whose (๐, ๐ ) entry is ๐(๐ฃ , ๐ฃ ) is called the distance matrix of ๐บ.
A connected acyclic graph is called a tree . The number of vertices of a tree is its order . The terminal distance matrix or reduced distance matrix is defined for (molecular)
๏ทCorresponding Author: [email protected] DOI: 10.22052/IJMC.2021.242219.1559
trees [1]. Let ๐ be a tree of order ๐ with ๐ pendent vertices (vertices of degree one), labeled by ๐ฃ , ๐ฃ , . . . , ๐ฃ , then ๐๐ท(๐) the terminal distance matrix of ๐, is the square matrix of order ๐ whose (๐, ๐) entry is ๐(๐ฃ , ๐ฃ ) for 1 โค ๐, ๐ โค ๐.
Terminal distance matrices were used in the mathematical modeling of proteins and genetic codes [2, 3, 5], and were proposed to serve as a source of a whole class of molecular-structure descriptors [3, 4].
A rooted tree is a tree in which one particular vertex is distinguished , this vertex is referred to as the root (of the rooted tree) . In order to define the Kragujevac trees , we first explain the structure of its branches [6].
Definition 1.1. Let ๐ be the 3-vertex tree , rooted at one of its terminal vertices . For ๐ = 2,3, โฆ construct the rooted tree ๐ต by identifying the roots of ๐ copies of ๐ . The vertex obtained by identifying the roots of ๐ -trees is the root of ๐ต .
Examples illustrating the structure of the rooted tree ๐ต are depicted in Fig ure 1 .
Figure 1. The rooted trees ๐ต , ๐ต , and ๐ต in the Definition 1.1.
Definition 1.2. Let ๐ โฅ 2 be an integer . Let ๐ต , ๐ต , . . . , ๐ต be the rooted trees specified in Definition 1.1 . A Kragujevac tree ๐ is a tree possessing a vertex of degree ๐, adjacent to the roots of ๐ต , ๐ต , . . . , ๐ต . This vertex is said to be the central vertex of ๐, whereas ๐ is the degree of ๐. The subgraphs ๐ต , ๐ต , . . . , ๐ต are the branches of ๐ (See Figure 2). Recall that some (or all) branches of ๐ may be mutually isomorphic . If all branches of ๐ are isomorphic , then ๐ is called regular Kragujevac tree . We will denote by ๐ , a regular Kragujevac tree with ๐ branches isomorphic to ๐ต .
The class of Kragujevac trees emerged in several studies addressed to solve the problem of characterizing the tree with minimal atom-bond connectivity index [7,8].
Suppose that ๐บ = {๐บ , ๐บ ,, โฆ , ๐บ } is a sequence of simple graphs and ๐ป is a simple graph of order ๐. For ๐ = 1, 2, . . ., ๐, choose a vertex ๐ฅ as the rooted vertex of ๐บ . The graph obtained by identifying ๐ฅ and ๐-th vertex of ๐ป is denoted by ๐ป(๐บ) and is called
the rooted product of ๐ป by ๐บ [9]. If ๐ is the tree of order 1, ๐ is the star graph of order ๐ + 1 and ๐บ = {๐ , ๐ต , ๐ต , โฆ , ๐ต }, then the Kragujevac tree which is described in Definition 1.2, can be constructed by the rooted product of ๐ by ๐บ as follows:
T = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต .
Figure 2. The graph of ๐, , a regular Kragujevac tree of order 29 of degree 4.
Let ๐ด be a square matrix and ๐ดฬ be the square matrix obtained from ๐ด, by deleting the first row and the first column. Suppose that ๐ธ , denotes the ๐ ร ๐ matrix whose (1,1) entry is 1 and others are 0. If |๐ด| denotes the determinant of square matrix ๐ด, then the following theorem obtain a method for computation of the characteristic polynomial of the rooted product of graphs [9].
Theorem 1.1. Let ๐ด , ๐ด , โฆ , ๐ด be symmetric matrices of order ๐ , ๐ , โฆ , ๐ respectively. If
๐ =
โฃ
โข
โข
โก ๐ด ๐ธ
๐ธ ๐ด
โฏ ๐ธ
โฏ ๐ธ
โฎ โฎ
๐ธ ๐ธ
โฑ โฎ
โฏ ๐ด โฆ
โฅ
โฅ
โค
, then |๐| =
|๐ด | |๐ด |
|๐ด | |๐ด |
โฏ |๐ด |
โฏ |๐ด |
โฎ โฎ
|๐ด | |๐ด |
โฑ โฎ
โฏ |๐ด | .
In this paper , we compute the characteristic polynomial and the spectrum of the terminal distance matrix of ๐ , in terms of positive integers ๐ and ๐ . As an application , we obtain an upper bound and a lower bound for the spectral radius of the terminal distance matrix of the Kragujevac trees .
2. C
HARACTERISTICP
OLYNOMIALIn this section, the characteristic polynomial of the terminal distance matrix of some special types of Kragujevac trees is calculated by use of Theorem 1.1. For this purpose the terminal distance matrix of these trees must be written in a suitable form of a block matrix.
If ๐ต for 1 โค ๐ โค ๐ is one of the branches of the Kragujevac tree T = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต , then the terminal distance matrix of ๐ต is given as
๐๐ท ๐ต =
0 4 4 0
โฆ 4
โฆ 4
โฎ โฎ 4 4
โฑ โฎ
โฆ 0 ร
.
If ๐ถ ร is a ๐ ร ๐ matrix whose all entries equal to 6, the terminal distance matrix of ๐ is given as follows:
๐๐ท(๐) =
โฃ
โขโข
โข
โก ๐๐ท ๐ต ๐ถ ร
๐ถ ร ๐๐ท ๐ต
โฆ ๐ถ ร
โฆ ๐ถ ร
โฎ โฎ ๐ถ ร ๐ถ ร
โฑ โฎ
โฆ ๐๐ท ๐ต โฆโฅโฅโฅโค
ร
.
By subtracting the first row from the other rows, and then subtracting the first column of ๐ถ ร from the other columns of this matrix, we can transform ๐ถ ร to 6๐ธ ร (whose (1,1) entry is 6 and other entries are equal to 0). If ๐ท for 1 โค ๐ โค ๐, denotes the square matrix which is obtained by applying the used linear transformations to transform ๐ถ ร to 6๐ธ ร on ๐๐ท ๐ต , we have
๐๐ท(๐) =
โฃ
โข
โข
โก ๐ท 6๐ธ ร
6๐ธ ร ๐ท
โฆ 6๐ธ ร
โฆ 6๐ธ ร
โฎ โฎ
6๐ธ ร 6๐ธ ร
โฑ โฎ
โฆ ๐ท โฆ
โฅ
โฅ
โค
ร
.
Since det ๐๐ผ โ ๐๐ท ๐ต = det (๐๐ผ โ ๐ท ), if ะค (๐) denotes the characteristic polynomial of ๐๐ท ๐ต and ะค (๐) = det (๐ท ) for 1 โค ๐ โค ๐, then by using Theorem 1.1, the characteristic polynomial of the terminal distance matrix of ๐ is given as
ะค (๐) =
ะค (๐) โ6ะค (ฮป)
โ6ะค (ฮป) ะค (๐)
โฆ โ6ะค (ฮป)
โฆ โ6ะค (ฮป)
โฎ โฎ
โ6ะค (ฮป) โ6ะค (ฮป)
โฑ โฎ
โฆ ะค (๐)
ร
. (1)
To compute Equation (1), we need to calculate the determinant of a special type of square matrices which is introduced in the following lemma.
Lemma 2.1. If the main diagonal of a square matrix contains ๐ variable ๐ฅ and ๐ variable ๐ฆ and the other entries are -6, then
๐ฅ โ6 โฏ
โ6 ๐ฅ โฏ
โ6 โฏ
โ6 โฏ
โ6 โฏ โ6
โ6 โฏ โ6
โฎ
โ6
โฎ
โ6
โฑ
โฏ
โ6 โ6 โฏ
โฎ ๐ฅ
โฎ
โ6
โ6 ๐ฆ
โฎ
โ6
โฑ
โฏ
โ6
โ6
โ6 โฏ โ6
โ6 โ6 โฏ
โฎ
โ6
โฎ
โ6
โฎ
โฏ
โ6 โ6
โฎ
โ6
โฎ
โ6
๐ฆ โฏ โ6
โฎ โฑ
โ6 โฏ
โฎ ๐ฆ
= (๐ฅ + 6) (๐ฆ + 6) ๐ฅ ๐ฆ โ 6(๐ โ 1) โ 6(๐ โ 1)๐ฆ โ 36(๐ + ๐ โ 1) .
Proof. The lemma can be proved by induction on ๐ = ๐ + ๐ . โก Theorem 2.2. Let ๐, ๐ โฅ 2 be positive integers. The characteristic polynomial of the terminal distance matrix of the regular Kragujevac tree is computed as:
ะค , (๐) = (๐ + 4) ( )(๐ + 2๐ + 4) (๐ โ ๐(6๐ โ 2) + 4).
Proof. Let ๐ต be one of the branches of ๐ , . The characteristic polynomial of ๐๐ท(๐ต ) is given as follows:
ะค (๐) =
๐ โ4
โ4 ๐
โฆ โ4
โฆ โ4
โฎ โฎ
โ4 โ4
โฑ โฎ
โฆ ๐ ร
= (๐ + 4) ๐ โ 4(๐ โ 1) . (2)
On the other hand, if ๐ denotes the obtained determinant from ะค (๐) by subtracting the first row from the other rows and then subtracting the first column from the other columns of ะค (๐), then ะค (๐) = det (๐). Hence
ะค ( ) = (๐ + 4)
โ2 โ1
โ1 โ2
โฆ โ1
โฆ โ1
โฎ โฎ
โ1 โ1
โฑ โฎ
โฆ โ2 ( )ร( )
= ๐(๐ + 4) . (3)
By Equation (1), the characteristic polynomial of the terminal distance matrix of ๐ , is given as follows:
ะค , (๐) =
ะค (๐) โ6ะค (๐)
โ6ะค (๐) ะค (๐)
โฆ โ6ะค (๐)
โฆ โ6ะค (๐)
โฎ โฎ
โ6ะค (๐) โ6ะค (๐) โฑ โฎ
โฆ ะค (๐)
ร
.
Now by use of Lemma 2.1, we get ะค , (๐) = ะค (๐) ะค ( )
ะค ( )+ 6 ะค ( )
ะค ( )โ 6(๐ โ 1) = ะค (๐) + 6ะค (๐) ะค (๐) โ 6(๐ โ 1)ะค (๐) = (๐ + 4) ( )(๐ + 2๐ + 4) (๐ โ ๐(6๐ โ 2) + 4).
Therefore, the proof is completed. โก Corollary 2.3. The spectrum of the terminal distance matrix of ๐ , contains the integer numbers, โ4 with multiplicity ๐(๐ โ 1), โ2๐ โ 4 with multiplicity ๐ โ 1, and a positive integer equal to ๐(6๐ โ 2) โ 4.
In what follows, we compute the characteristic polynomial of the terminal distance matrix of two special types of Kragujevac trees which are used in the next section.
Theorem 2.4. Let ๐, ๐ โฅ 2 be positive integers. The characteristic polynomial of the terminal distance matrix of ๐ = ๐ (๐ , ๐ต , ๐ต , โฆ , ๐ต ), the Kragujevac tree which one of its branches is ๐ต and other branches are ๐ต , is given as follows:
ะค (๐) = (๐ + 4) (๐ + 8) (๐ โ (4๐ + 12๐ โ 24)๐ โ 8๐(3๐ + 1) โ 16(3๐ โ 5)).
Proof. By Equation (1), we have
ะค (๐) =
ะค (๐) โ6ะค (๐)
โ6ะค (๐) ะค (๐)
โฏ โ6ะค (๐)
โฏ โ6ะค (๐)
โฎ โฎ
โ6ะค (๐) โ6ะค (๐)
โฑ โฎ
โฏ ะค (๐)
= ะค (๐) ะค (๐)
ะค (๐)
ะค (๐) โ6
โ6 ะค (๐) ะค (๐)
โฏ โ6
โฆ โ6
โฎ โฎ
โ6 โ6
โฑ โฎ
โฏ ะค (๐) ะค (๐)
.
Now, by applying Lemma 2.1, we get ะค (๐) = ะค (๐) ะค (๐) ะค ( )
ะค ( )+ 6 ะค ( )
ะค ( ) ะค ( )
ะค ( )โ 6(๐ โ 2) โ 36(๐ โ 1)
= ะค (๐) + 6ะค (๐) ะค (๐)(ะค (๐) โ 6(๐ โ 2)ะค (๐)) โ 36(๐ โ 1)ะค (๐)ะค (๐) .
The result now follows from replacing ะค (๐), ะค (๐), ะค (๐) and ะค (๐) from Equations (2) and (3). โก Theorem 2.5. Let ๐, ๐ โฅ 2 be positive integers. The characteristic polynomial of the terminal distance matrix of ๐ = ๐ (๐ , ๐ต , โฆ , ๐ต , ๐ต โฆ , ๐ต ), a Kragujevac tree of degree ๐ with ๐ branches equal to ๐ต and ๐ โ ๐ branches equal to ๐ต is given as follows:
ะค (๐) = (๐ + 4) ( ) (๐ + 2๐ + 6) (๐ + 2๐ + 4)
(๐ โ (6๐๐ โ 4๐ + 6 ๐ โ 10)๐ โ (12๐โ4)๐ โ (36๐ โ 20)๐ โ 24(๐ โ 1)).
Proof. By Equation (1), ะค (๐) is given as follows:
ะค (๐) โ6ะค (๐) โฆ
โฎ โฎ
โ6ะค (๐) โฆ
โฎ โฆ
โ6ะค (๐) โฆ โ6ะค (๐)
โ6ะค (๐) โฆ โ6ะค (๐)
โ6ะค (๐) โ6ะค (๐) โฆ
โ6ะค (๐) โ6ะค (๐) โฆ
ะค (๐) โฆ
โ6ะค (๐) โฆ
โ6ะค (๐) โฆ โ6ะค (๐) ะค (๐) โฆ โ6ะค (๐)
โฎ โฎ
โ6ะค (๐) โ6ะค (๐) โฆ
โฎ โฑ
โ6ะค (๐) โฆ
โฎ โฎ
โ6ะค (๐) โฆ ะค (๐) Now, by use of Lemma 2.1, we have
ะค (๐) = ะค (๐) ะค (๐) ะค (๐)
ะค (๐)+ 6 ร
ะค ( )
ะค ( )+ 6 ะค ( )
ะค ( )
ะค ( )
ะค ( )โ 6(๐ โ ๐ โ 1) โ 6(๐1โ 1) ะค๐(๐)
ะค๐ต๐(๐)โ 36(๐ โ 1) = (๐ + 4) ( ) (๐ + 2๐ + 6) (๐ + 2๐ + 4) ร
(๐ โ (6๐๐ โ 4๐ + 6 ๐ โ 10)๐ โ (12๐โ4)๐ โ (36๐ โ 20)๐ โ 24(๐ โ 1)).
This completes the proof. โก
2. S
PECTRALR
ADIUSIn this section, we obtain a lower bound and an upper bound for the spectral radius of Kragujevac trees of order ๐. Let ๐ = (๐ฅ , ๐ฅ , โฆ , ๐ฅ ) be the Perron vector and ฯ be the spectral radius of the terminal distance matrix of T= ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต . The components of ๐ which are correspond to the pendant vertices of ๐ต are equal, so we will denote these components by ๐ฅ for 1 โค ๐ โค ๐.
Lemma 3.1. If ๐ = (๐ฅ , ๐ฅ , โฆ , ๐ฅ ) is the Perron vector of the terminal distance matrix of ๐ = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต and ๐ > ๐ for some 1 โค ๐, ๐ โค ๐, then ๐ฅ < ๐ฅ .
Proof. If ฯ denotes the spectral radius of ๐, then by use of the eigenvalue equation, we get ๐๐ท(๐)๐ = ๐X. Thus
๐๐๐๐ = ๐(๐๐โ ๐)๐๐๐+ ๐๐๐๐๐๐ + โฏ + ๐๐๐ ๐๐๐ . (๐)
๐๐ฅ = 6๐ ๐ฅ + 4 ๐ โ 1 ๐ฅ + โฏ + 6๐ ๐ฅ . (5) By subtracting Equation (4) from Equation (5) we have
(๐ + 4 + 2๐ )๐ฅ = ๐ + 4 + 2๐ ๐ฅ .
Since ๐ > ๐ , hence x < x . โก Now let in ๐ = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต , ๐ has maximum value and ๐ has minimum value among branches of ๐. If ๐ โ 1 > ๐ , then we denote by ๐โ, the Kragujevac three which is obtained from ๐ by replacing ๐ต with ๐ต and replacing ๐ต with ๐ต . The spectral radius of ๐๐ท(๐) and ๐๐ท(๐โ) will be compared in the following lemma.
Lemma 3.2. If ๐ and ๐โ are the spectral radius of ๐๐ท(๐) and ๐๐ท(๐โ) respectively, then ๐โ > ๐.
Proof. Let ๐ท and ๐ทโ denote the terminal distance matrix of ๐ and ๐โ respectively and ๐ be the Perron vector of ๐ท. By use of the eigenvalue equation we get
๐ฟ๐(๐ซโโ ๐ซ)๐ฟ = ๐(๐๐๐๐๐๐๐๐๐+ ๐(๐๐โ ๐)๐๐๐๐โ ๐(๐๐โ ๐)๐๐๐๐โ ๐๐๐๐๐๐๐๐๐)
= ๐๐๐๐ (๐๐โ ๐)๐๐๐โ ๐๐๐๐๐ . (๐) If ๐ = โ ๐ , then by use of Equation (4) we get
๐ ๐ฅ > 4(๐ โ 1)๐ฅ + 6๐ ๐ฅ + 6 ๐ โ ๐ โ๐ ๐ฅ โ ๐ + 4 > 6๐ โ 2๐ . (7) By subtracting Equations (4) and (5) we have
๐ ๐ฅ โ ๐ฅ = (2๐ + 4)๐ฅ โ 2๐ + 4 ๐ฅ โ (๐+4 + 2๐ )๐ฅ = ๐ + 4 + 2๐ ๐ฅ . Hence,
(๐ โ 1)๐ฅ โ ๐ ๐ฅ = (๐ โ 1)๐ฅ โ ๐ ๐+4 + 2๐๐ ๐+4 + 2๐๐๐ฅ =
(๐+4) ๐ โ 1 โ ๐ โ 2๐
๐
๐+4 + 2๐๐ ๐ฅ
Since ๐ โ 1 โ ๐ > 1, by use of Equation (7), we get (๐ โ 1)๐ฅ โ ๐ ๐ฅ >6๐ โ 2๐ โ2๐๐
๐+4 + 2๐๐ ๐ฅ > 0. (8) Now by using Equations (6) and (8) we have ๐ (๐ทโโ ๐ท)๐ > 0 and from Riley equation, we get ๐โ โฅ โ > = ๐. Therefore, the proof is completed. โก
Let ๐, ๐ โฅ 2 be positive integers. In continue we suppose that
๐ = and ๐ = ( ) .
If ๐ is a Kragujevac tree of order ๐ with degree ๐, then ๐ is an positive integer.
Theorem 3.3. Among Kragujevac trees of order ๐ and degree ๐, the terminal distance matrix of the Kragujevac tree with ๐ branches isomorphic to ๐ต and ๐ โ ๐ branches isomorphic to ๐ต , has maximum value of the spectral radius.
Proof. Let ๐ = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต be a Kragujevac tree of order ๐ and degree ๐ with maximum value of spectral radius. By use of Lemma 3.2, |๐ โ ๐ | โค 1, for 1 โค ๐, ๐ โค ๐. Hence, ๐ = or ๐ = , for 1 โค ๐ โค ๐. This completes the result. โก Corollary 3.4. If ๐ is the spectral radius of the terminal distance matrix of a Kragujevac tree of order ๐ and degree ๐, then
๐ โค ๐(3d โ 2) + 3๐ โ 5 + 9๐ ๐ + 18๐๐๐ + 6๐(๐ โ 2๐ ) + 3๐ (3๐ โ 2) + 1.
Proof. By using Theorem 3.3, if ๐ = ๐ (๐ , ๐ต , โฆ , ๐ต , ๐ต โฆ , ๐ต ), then ๐๐ท(๐) has maximum value of the spectral radius. Now by use of Theorem 2.5, ๐ is the largest root of the equation ๐ โ (6๐๐ โ 4๐ + 6 ๐ โ 10)๐ โ (12๐โ4)๐ โ (36๐ โ 20)๐ โ 24(๐ โ 1) = 0. Hence ๐ = ๐(3d โ 2) + 3๐ โ 5 + 9๐ ๐ + 18๐๐๐ + 6๐(๐ โ 2๐ ) + 3๐ (3๐ โ 2) + 1.
Thus the corollary is proved. โก
Theorem 3.5. Among Kragujevac trees of order ๐ and degree ๐, if ๐ = and ๐ = ๐ (๐ , ๐ต , ๐ต , ๐ต โฆ , ๐ต ), then ๐๐ท(๐) has minimum value of the spectral radius.
Proof. Let ๐ = ๐ ๐ , ๐ต , ๐ต , โฆ , ๐ต be a Kragujevac tree of order ๐ and degree ๐ with minimum value of spectral radius. If ๐ = 2, for 1 โค ๐ โค ๐, then the result of theorem is proved. Let for example ๐ > 2. If ๐ > 2, for 2 โค ๐ โค ๐, then by using Lemma 3.2, we
can obtain a Kragujevac tree of order ๐ and degree ๐ form ๐ with larger spectral radius than ๐ , which is a contradiction. Hence ๐ = 2, 2 โค ๐ โค ๐, and the theorem is proved. โก Corollary 3.6. Let ๐ be the spectral radius of the terminal distance matrix of a Kragujevac tree of order ๐ and degree ๐. Then
๐ โฅ 2๐ + 6๐ โ 12 + 2 (๐ + 3๐) + 2๐(3๐ โ 5) โ 8(3๐ โ 2).
Proof. By use of Theorem 2.4, if ๐ = ๐ (๐ , ๐ต , ๐ต , ๐ต โฆ , ๐ต ), then ๐ is the greatest root of the following equation:
๐ โ (4๐ + 12๐ โ 24)๐ โ 8๐(3๐ + 1) โ 16(3๐ โ 5) = 0,
Hence, ๐ = 2๐ + 6๐ โ 12 + 2 (๐ + 3๐) + 2๐(3๐ โ 5) โ 8(3๐ โ 2). We now apply Theorem 3.5 to deduce the result. โก
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