Graph Theory
Graph Theory
OF CERTAIN NETWORKS
MASTER OF SCIENCE
IN
MATHEMATICS
Submitted by
M. ABINAYA
Guided by
Department of mathematics
2019-2020
Government Arts College for Women (Autonomous)
CERTIFICATE
Examiners
1.
2.
ACKNOWLEDGEMENT
M. ABINAYA
INDEX
INTRODUCTION 1
Ⅰ PRELIMINARIES 2
CONCLUSION 31
BIBLIOGRAPHY 32
INTRODUCTION
In this project, we determine the square reverse index and its polynomial in
certain networks of chemical importance like silicate, chain silicate, rhombus silicate,
triangular silicate, hexagonal, oxide, rhombus oxide and honeycomb networks.
In chapter-Ⅱ, results for silicate, chain silicate, rhombus silicate and triangular
silicate networks are studied.
1
PRELIMINARIES
1.1 Graph
A graph G consists of a pair (V(G),E(G)) where V(G) is a non-empty finite set
whose elements are called points or vertices and E(G) is the set of unordered pair of distinct
element of V(G). The elements of E(G) are called lines or edges of a graph G.
Example:
G = {V(G), E(G)}
V(G) = {v1, v2, v3, v4, v5}, E(G) = {e1, e2, e3, e4, e5, e6, e7}
Example:
Example:
Finite graph G
Infinite graph H
Example:
1.5 Connected graph
A graph G is said to be a connected if there is at least one path between every
pair of vertices in G.
Example:
Connected graph:
1.6 Incident
When a vertex vi is an end vertex of some edge ej and vi and ej are said to be
incident with each other.
Example:
1.7 Adjacent
Two non-parallel edges are said to be adjacent if they are incident on a common
vertex. Two vertices are said to be adjacent if they are the vertices of the same edge.
Example:
Example:
1.9 Complete graph
A simple graph in which there exists an edge between every pair of vertices is
called a complete graph.
Example:
Example:
Example:
1.12 Degree
The number of edges incident at a vertex vi with self loop counted twice is
called the degree d(vi) of vertex vi.
Example:
Example:
Example:
The set of vertices V of G encodes atoms and the set of edges E encodes the
adjacency relationship between atoms in the molecule.
Example:
1.17 Atoms
Atoms are defined as the smallest units of matter that have the properties of an
individual element. Atoms are made up of smaller and even smaller particles of matter.
However, those smaller particles don’t have the properties of an element.
1.18 Bonds
A chemical bond is a lasting attraction between atoms, ions or molecules that
enables the formation of chemical compounds.
The bond may result from the electrostatic force of attraction between
oppositely charged ions as in ionic bonds or through the sharing of electrons as in covalent
bonds.
Example:
∑
2
QC (G, x) = x (c −c ) .
u v
uv ∈ E (G )
10
RESULTS FOR SILICATE, CHAIN SILICATE, RHOMBUS SILICATE
AND TRIANGULAR SILICATE NETWORKS
Let G be the graph of a silicate network SL n. From figure 1, it is easy to see that the
vertices of SLn are either of degree 3 or 6.
Therefore ∆(G) = 6.
= 6−dG(u) + 1
cu = 7−dG(u).
The graph G has 15n2+3n vertices and 36n2 edges. In algebraic method, there are
three types of edges based degree of end vertices of each edge as follows:
11
E36 = {uv ∈ E(G)|dG(u) = 3,dG(v) = 6}, |E36| = 18n2+6n.
Thus there are three types of reverse edges are given in table 1.
Theorem: 2.1
The square reverse index of a silicate network SLn is given by
QC(SLn) = 162n2+54n.
Proof:
From square reverse index equation and table 1, we get
= (4−4)26n+(4−1)2(18n2+6n)+(1−1)2(18n2−12n)
= (0)6n+(3)2(18n2+6n)+(0)(18n2−12n)
= 0+9(18n2+6n)+0
= 9(18n2+6n)
= 9(18n2)+9(6n)
QC(SLn) = 162n2+54n.
Hence proved.
Theorem: 2.2
The square reverse polynomial of a silicate network SLn is given by
12
Proof:
From square reverse polynomial equation and using table 1, we get
∑
2
QC(SLn, x) = x (c −c )
u v
uv ∈ E (G )
2 2 2
= 6n x(4 −4) +(18n2+6n) x(4 −1 ) +(18n2−12) x(1−1)
2 2 2
= 6n x(0) +(18n2+6n) x(3) +(18n2−12n) x(0)
= 6n x 0+(18n2+6n) x 9+(18n2−12n) x 0
= (18n2+6n) x 9+[6n+(18n2−12n)] x 0
Hence proved.
Let G be the graph of a chain silicate network CS n with 3n+1 vertices and 6n
edges. From figure-2, it is easy to see that the vertices of CSn are either of degree 3 or 6.
Therefore ∆(G) = 6.
Thus cu = ∆(G)−dG(u)+1
= 6−dG(u)+1
cu = 7−dG(u).
In G, by algebraic method, there are three types of edges based on the degree
of each edge as follows:
13
Thus there are three types of reverse edges as given in the table 2.
Theorem: 2.3
The square reverse index of a chain silicate network CSn is given by
QC(CSn) = 36n−18.
Proof:
From square reverse index equation and using table 2, we get
= (4−4)2(n+4)+(4−1)2(4n−2)+(1−1)2(n−2)
= 0(n+4)+(3)2(4n−2)+0(n−2)
= 0+9(4n−2)+0
= 9(4n−2)
= 9(4n)−9(2)
QC(CSn) = 36n−18.
Hence proved.
Theorem: 2.4
The square reverse polynomial of a chain silicate network CSn is given by
Proof:
From square reverse polynomial equation and using table 2, we get
∑
2
(c u−c v )
QC(CSn, x) = x
uv ∈ E (G )
2 2 2
= (n+4) x(4 −4) +(4n−2) x(4 −1 ) +(n−2) x(1−1)
2 2 2
= (n+4) x(0) +(4n−2) x(3) +(n−2) x(0)
= (4n−2) x 9+[n−2+n+4] x 0
Hence proved.
Therefore ∆(G) = 6.
15
= 6−dG(u)+1
cu = 7−dG(u).
In G, by algebraic method, there are three types of edges based on the degree of end
vertices of each as follows:
Theorem: 2.5
The square reverse index of a silicate network RHSLn is given by
QC(RHSLn) = 54n2+36n−36.
Proof:
From square reverse index and using table 3, we get
= (4−4)2(4n+2)+(4−1)2(6n2+4n−4)+(1−1)2(6n2−8n+2)
= (0)2(4n+2)+(3)2(6n2+4n−4)+(0)2(6n2−8n+2)
= 0+9(6n2+4n−4)+0
= 9(6n2)+9(4n)−9(4)
QC(RHSLn) = 54n2+36n−36.
Hence proved.
16
Theorem: 2.6
The square reverse polynomial of a silicate network RHSLn is given by
Proof:
From square reverse polynomial and using table 3, we get
∑
2
QC(RHSLn, x) = x (c −c )
u v
uv ∈ E (G )
2 2 2
= (4n+2) x(4 −4) +(6n2+4n−4) x(4 −1 ) +(6n2−8n+2) x(1−1)
2 2 2
= (4n+2) x(0) +(6n2+4n−4) x(3) +(6n2−8n+2) x(0)
Hence proved.
Let G be the graph of a triangular silicate network TSLn. From figure-4, it is easy to
see that the vertices of TSLn are either of degree 3,7 or 12.
= 12−dG(u)+1
cu = 13−dG(u).
3
The graph G has ( ( n−1 ) ( n−2 )|2 ) 3( n−1)+n2 +3 vertices and n(n+1) edges.
2
In G, by algebraic method, there are six types of edges based on the degree of end
vertices of each edge as follows:
6 ( n−2 )(n−1)
E3 12 = {uv ∈ E(G) |dG(u) = 3, dG(v) = 12}, |E3 12| = .
2
3 ( n−3 ) (n−2)
E12 12 = {uv ∈ E(G) |dG(u) = 12, dG(v) = 12}, |E12 12| = .
2
Theorem: 2.7
The square reverse index of a triangular silicate network TSLn is given by
QC(TSLn) = 243n2+285n−762.
18
Proof:
From square reverse index equation and using table 4, we get
QC(TSLn) = ∑ [cu −c v ]2
uv ∈ E (G )
= 16(33)+16(9)(n−4)+81(3)(n−1)(n−2)+25(12)+25(6)(n−4)
= 528+144(n−4)+243(n−1)(n−2)+300(n−4)
= 243(n−1)(n−2)+(n−4)[144+300]+528
= 243(n2−3n+2)+(n−4)(444)+528
= 243n2−729n+486+444n−1776+528
= 243n2 +285n+1014−1776
QC(TSLn) = 243n2+285n−762.
Hence proved.
Theorem: 2.8
The square reverse polynomial of a triangular silicate network is given by
3
QC(TSLn, x) = (n2−3n+6) x 0+3(n−1) x 16+6(n−2) x 25+3(n2−3n+2) x 81.
2
Proof:
From square reverse polynomial equation and using table 4, we get
∑
2
QC(TSLn, x) = x [c −c ]
u v
uv ∈ E (G )
x
2
19
2 2 2 2 2 3 ( n−2 ) ( n−3) (0 )
2
3 ( n−2 ) ( n−3) 0
+ x
2
+[12+6(n−4)] x 25
+3(n−1)(n−2) x 81
3
QC(TSLn, x) = (n2−3n+6) x 0+3(n−1) x 16 +6(n−2) x 25+3(n2−3n+2) x 81.
2
Hence proved.
20
RESULTS FOR HEXAGONAL, OXIDE, RHOMBUS OXIDE AND
HONEYCOMB NETWORKS
Let G be the graph of a hexagonal network HXn. The graph G has 3n2−3n+1 vertices
and 9n2−15n+6 edges.
From figure 5, it is easy to see that the vertices of HXn are either of degree 3, 4, or 6.
21
Therefore ∆(G) = 6 and δ(G) = 3.
Thus cu = ∆(G)−dG(u)+1
= 6−dG(u)+1
cu = 7−dG(u).
In G, by algebraic method, there are five types of edges based on the degree of
end vertices of each edges as follows:
Theorem: 3.1
The square reverse index of a hexagonal network HXn is
QC(HXn) = 48n−30.
Proof:
From square reverse index and using table 5, we get
= (4−3)212+(4−1)26+(3−3)2(6n−18)+(3−1)2(12n−24)+(1−1)2(9n2−33n+30)
= (1)212+(3)26+(0)(6n−18)+(2)2(12n−24)+(0)(9n2−33n+30)
22
= 1×12+9×6+0+4(12n−24)+0
= 12+54+48n−96
= 48n−96+66
QC(HXn) = 48n−30.
Hence proved.
Theorem :3.2
The square reverse polynomial of a hexagonal network HXn.
Proof:
From square reverse polynomial equation and using table 5, we get
∑
2
(c u−c v )
QC(HXn, x) = x
uv∈ E (G )
2 2 2 2 2
= 12 x(4 −3 ) +6 x(4 −1 ) +(6n−18) x(3−3) +(12n−24) x(3−1) +(9n2−33n+30) x(1−1)
2 2 2 2 2
= 12 x(1) +6 x(3) +(6n−18) x(0) +(12n−24) x(2) +(9n2−33n+30) x(0)
Hence proved.
23
Figure -6: Oxide network of dimension 5.
Let G be the graph of an oxide network OX n. From figure 6,it is easy to see that the
vertices of OXn are either of degree 2 or 4.
Therefore ∆(G) = 4.
Thus cu = ∆(G)−dG(u)+1
= 4−dG(u)+1
cu = 5−dG(u).
In G, by algebraic method there are two types of edges based on the degree of end
vertices of each edge as follows:
24
QC(OXn) = 48n.
Proof:
From square reverse index equation and using table 6, we get
= (3−1)212n+(1−1)2(18n2−12n)
= (2)212n+(0)(18n2−12n)
= (4)12n+0
QC(OXn) = 48n.
Hence proved.
Theorem: 3.4
The square reverse polynomial of an oxide network OXn is given by
Proof:
From square reverse polynomial equation and using table 6, we get
∑
2
QC(OXn, x) = x (c −c )
u v
uv∈ E (G )
2 2
= 12n x(3−1) +(18n2−12n) x(1−1)
2 2
= 12n x(2) +(18n2−12n) x(0)
= 12n x 4 +(18n2−12n) x 0
Hence proved.
25
Results for rhombus oxide network
We consider a family of rhombus oxide network. A rhombus oxide network
of dimension n is denoted by RHOXn. A rhombus oxide network of dimension 3 is shown in
the figure 7.
Let G be the graph of rhombus oxide network RHOX n. From figure 7, it is easy to
see that the vertices of RHOXn are either of degree 2 or 4.
Therefore ∆(G) = 4.
= 4−dG(u)+1
cu = 5−dG(u).
In G, by algebraic method, there are three types of edges based on the degree of end
vertices of each edge as follows:
Thus there are three types of reverse edges are given in the table.
26
cu, cv \uv ∈ E(G) (3, 3) (3, 1) (1, 1)
Number of edges 2 8n−¿ 4 6n2−8n+2
Theorem: 3.5
The square reverse index of a rhombus oxide network RHOXn is given by
QC(RHOXn) = 32n−16.
Proof:
From square index equation and using table 7, we get
QC(RHOXn) = ∑ [cu −c v ]2
uv∈ E (G )
= (3−3)2(2)+(3−1)2(8n−4)+(1−1)2(6n2−8n+2)
= (0)(2)+(2)2(8n−4)+(0)(6n2−8n+2)
= 0+(4)(8n−4)+0
= 4(8n)−4(4)
QC(RHOXn) = 32n−16.
Hence proved.
Theorem: 3.6
The square reverse polynomial of rhombus oxide network RHOXn is given by
QC(RHOXn, x) = (8n−4)x4+(6n2−8n+4)x0.
Proof:
From square reverse polynomial equation and using table 7, we get
∑
2
QC(RHOXn, x) = uv ∈ E (G ) x [c −c ]
u v
2 2 2
= (2) x [3−3] + ¿(8n−4) x [3−1] +(6n2−8n+2) x [1−1]
27
2 2 2
= (2) x(0) +(8n−4) x(2) +(6n2−8n+2) x(0)
= 2x0+(8n−4)x4+(6n2−8n+2)x0
= x0(6n2−8n+2+2)+(8n−4)x4
QC(RHOXn, x) = (8n−4)x4+(6n2−8n+4)
Hence proved.
Let G be the graph of a honeycomb network HC n. From figure 8, it is easy to see that
the vertices of HCn are either of degree 2 or 3.
Thus ∆(G) = 3.
Therefore cu = ∆(G)−dG(u)+1
= 3−dG(u)+1
28
cu = 4−dG(u).
In G, by algebraic method, there are three types of edges based on the degree of end
vertices of each edge as follows:
Theorem: 3.7
The square reverse index of a honeycomb network HCn is
QC(HCn) = 12n−12.
Proof:
From square reverse equation and using table 8, we get
= (2−2)26+(2−1)2(12n−12)+(1−1)2(9n2−12n+6)
= (0)6+(1)2(12n−12)+(0)(9n2−12n+6)
= 0+12n−12+0
QC(HCn) = 12n−12.
Hence proved.
29
Theorem :3.8
The square reverse polynomial of a honeycomb network HCn is given by
Proof:
From square reverse polynomial equation and using table 8, we get
∑
2
QC(HCn, x) = x (c −c )
u v
uv ∈ E (G )
2 2 2
= 6 x(2−2) +(12n−12) x (2−1) +(9n2−15n+6) x(1−1)
2 2 2
= 6 x(0) +(12n−12) x(1) +(9n2−15n+6) x(0)
= 6 x 0+(12n−12) x 1+(9n2−15n+6) x 0
= (12n−12) x 1+(6+9n2−15n+6) x 0
Hence proved.
30
CONCLUSION
In this project, the explicit formulas for the reduced square reverse index and its
polynomial of silicate, chain silicate, rhombus silicate, triangular silicate, hexagonal, oxide,
rhombus oxide and honeycomb networks are computed. These expressions can correlate the
molecular structure of silicate, chain silicate, rhombus silicate, triangular silicate, hexagonal,
oxide, rhombus oxide and honeycomb networks to information about their physical network.
31
BIBLIOGRAPHY
32