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. 2018 Dec 6;2018(1):334. doi: 10.1186/s13660-018-1927-0

Improved McClelland and Koolen–Moulton bounds for distance energy of a graph

G Sridhara 1, M R Rajesh Kanna 2,, R Pradeep Kumar 3,4, D Soner Nandappa 4
PMCID: PMC6290675  PMID: 30839896

Abstract

Let G be a graph with n vertices and m edges. The term energy of a graph G was introduced by I. Gutman in chemistry due to its relevance to the total π-electron energy of a carbon compound. An analogous energy ED(G), called the distance energy, was defined by Indulal et al. (MATCH Commun. Math. Comput. Chem. 60:461–472, 2008) in 2008. McClelland and Koolen–Moulton bounds for distance energy were established subsequently by Ramane et al. (Kragujev. J. Math. 31:59–68, 2008). The lower and upper bounds for ED(G) obtained in this paper are better than the McClelland and Koolen–Moulton bounds.

Keywords: Distance matrix, Distance spectrum, Bounds for distance energy of graph

Introduction

Let G be a simple undirected graph with n vertices and m edges. The distance between two vertices vi and vj is denoted by dij and is defined as the length of the shortest path from vi to vj. The distance sum W(G)=i<jdij is called the Wiener index of the graph G. For simplicity, we write the Wiener index as W. The distance matrix of the graph G is defined as A(G)=AD(G)=[dij]. Clearly, AD(G) is a symmetric matrix. Its eigenvalues are called D-eigenvalues and are ordered in the form μ1μ2μn. The largest eigenvalue μ1 is called the distance spectral radius of the graph G. We also write its absolute eigenvalues in decreasing order as ρ1ρ2ρn. Given a graph G, the distance energy of G is defined by ED(G) = i=1n|μi|=i=1nρi. For any vertex vi in the connected graph G, the eccentricity e(vi) is the distance between vi and a vertex that is farthest from vi in G. The minimum eccentricity among the vertices of G is called the radius of graph G, and the maximum eccentricity among the vertices is called the diameter of the graph G, which are respectively denoted by rad(G) and diam(G).

The distance energy is analogous to the ordinary energy of a graph G, which is defined as E(G) = i=1n|λi|, where λ1λ2λn are ordinary eigenvalues of G obtained from its adjacency matrix. The studies on the graph energy can be seen in papers [5, 6]. For a detailed survey on applications to the graph energy, see [24, 7]. For the ordinary energy, the best known bounds are the Koolen and Moulton upper bound [9, 10] and the McClelland lower bound [12].

For a connected graph G, the Koolen and Moulton upper bound [13] for the distance energy in terms of W, M, and n is

ED(G)(2Wn)+(n1)(2M(2Wn)2)for 2Wn, 1.1

where M=i<jndij2.

In this paper, we show that the upper bound (1.1) can be modified to a better bound for all classes of graphs with n24m. Further results on upper bounds can also be seen in [11].

The McClelland bounds [13] for the distance energy of a graph, which is true for any connected graph G, is

2M+n(n1)|det(A)|2nED(G)2Mn. 1.2

The lower bound obtained in this paper is better than that of McClelland. For more studies on the distance energy, we refer to [1, 8, 14].

We use the following two lemmas, which follow from the properties of distance eigenvalues.

Lemma 1.1

Let G be a graph with n3 vertices and m edges. Let μ1μ2μn be D-eigenvalues of G. Then

i=1nμi=0andi=1nμi2=2M.

Lemma 1.2

If μ1(G) is the distance spectral radius of the graph G, then μ1(G)2Wn.

Note that M=i<jndij2i<jndij=W and M=i<jndij2i<jndij=W.

The main results

Lemma 2.1

If μn(G) is the smallest distance eigenvalue of the graph G and ρn(G) is the smallest absolute distance eigenvalue, then

μn(G)2Wnandρn(G)|det(A)|1n.

Proof

For any nonzero vector X,

μn(G)minX0(XAXXX)JAJJJ=2Wn,

where J is the unit n×1 matrix J=[1,1,1,,1]. Now consider ρ1ρ2ρ3ρn=|det(A)|. Then ρnρnρnρnρ1ρ2ρ3ρn|det(A)| ρn(G)|det(A)|1n. □

Lemma 2.2

Let G be a graph with n3 vertices and m edges. For the largest and smallest distance eigenvalues μ1 and μn of G, μ1+μn2M(n2)n.

Proof

For D-eigenvalues μ1μ2μn of G, it is well known that i=1nμi=0 and i=1nμi2=2M. Using the Cauchy–Schwarz inequality for (μ2,μ3,,μn1) and (1,1,,1)(n2)times(n3) we have

(i=2n1μi)2(i=2n11)(i=2n1μi2),

that is, (μ1μn)2(n2)(2Mμ12μn2).

(n2)2M(μ1+μn)2+(n2)(μ12+μn2)=(μ1+μn)2+(n2)((μ1+μn)22μ1μn)=(μ1+μn)2(n1)2(n2)μ1μn.

However, (μ1+μn2)2μ1μn, which implies that μ1μn(μ1+μn2)2.

Thus (n2)2M(μ1+μn)2(n1)2(n2)(μ1+μn)24 = (μ1+μn)2n2.

Hence μ1+μn2M(n2)n. □

Upper bound for the distance energy of a graph

Theorem 3.1

Let G be a graph with n3 vertices and m edges. If n24m, then

ED(G)2Wn+2Wn+(n2)(2M2Wn4W2n2). 3.1

The equality holds iff G is n2K2.

Proof

Applying the Cauchy–Schwarz inequality for (|μ2|,|μ3|,,|μn1|) and (1,1,,1)(n2)times, we have

(i=2n1|μi|)2(i=2n11)(i=2n1|μi|2),(ED(G)|μ1||μn|)2(n2)(2M|μ1|2|μn|2),ED(G)|μ1|+|μn|+(n2)(2M|μ1|2|μn|2).

Let |μ1|=x and |μn|=y.

We maximize the function f(x,y)=x+y+(n2)(2Mx2y2). Differentiating f(x,y) with respect to x and y, we have

fx=1x(n2)(n2)(2Mx2y2),fy=1y(n2)(n2)(2Mx2y2),fxx=(n2)(2My2)(2Mx2y2)32,fyy=(n2)(2Mx2)(2Mx2y2)32andfxy=(n2)(xy)(2Mx2y2)32.

For maxima or minima, fx=0 and fy=0, which implies

x2(n1)+y2=2Mandy2(n1)+x2=2M.

Solving these equations, we obtain that x=y=2Mn. At this point the values of fxx, fyy, fxy, and Δ=fxxfyy(fxy)2 are

fxx=(n2)(n1)2Mn(n2)320,fyy=(n2)(n1)2Mn(n2)32,fxy=(n2)2Mn(n2)32andΔ=n(n2+33n)2M(n2)20.

Therefore f(x,y) attains its maximum value at x=y=2Mn, and this maximum value is f(2Mn,2Mn)=2Mn.

However, f(x,y) decreases in the intervals

2MnxMand0y2Wn2MnM.

Since n24m, mWM, and MW, we have

2mn2Mn2Wn|μ1|M,0|μn|2Wn2MnM.

Thus f(|μ1|,|μn|)f(2Wn,2Wn)f(2Mn,2Mn)

ED(G)2Wn+2Wn+(n2)(2m2Wn4W2n2)2Mn.

For the graph Gn2K2(n=2m), ED(G)=n. Hence the equality holds. □

Now we show that the above bound is an improvement of the Koolen–Moulton bound. Take g(x,y)=x+y+(n1)(2Mx2y2). Then, clearly, f(x,y)g(x,y) for all (x,y) in the given region of x and y.

Along x=2Wn, f(2Wn,y)=2Wn+y+(n2)(2M4W2n2y2). However, f(2Wn,y) decreases in the interval 0y2M4M2n2. Since n24m, we also have 0y2Wn2M4W2n2. Thus f(2Wn,2Wn)f(2Wn,0).

Since f(2Wn,0)g(2Wn,0) and g(2Wn,0)=2Wn+(n1)(2M4W2n2), it follows that f(2Wn,2Wn)g(2Wn,0). Hence

2Wn+2Wn+(n2)(2M2mn4W2n2)(2Wn)+(n1)(2M(2Wn)2).

Lower bounds for the distance energy of a graph

Theorem 4.1

If G is a nonsingular graph, then ED(G)n|detA|1n. The equality holds iff G is n2K2, where n=2m.

Proof

For the eigenvalues ρ1ρ2ρn of G (or its adjacency distance matrix A) it is well known that |det(A)|=ρ1ρ2ρn. Since G is nonsingular, we have |det(A)|0.

Applying the Cauchy–Schwarz inequality for n terms ai=ρi and bi=1 for all i=1,2,,n, We have

i=1nρi(i=1nρi)n,ED(G)i=1nρin.

However, ρ1+ρ2++ρnn(ρ1ρ2ρn)1n,

ED(G)n(ρ1ρ2ρn)1nnED(G)n|detA|1n.

For the graph Gn2K2 with n=2m, |det(A)|=1. Hence the equality holds. □

Theorem 4.2

Let G be a graph with n>1 vertices and m edges, and let 2Wn. Then

ED(G)2Wn+(n1)|det(A)|1(n1)(2Wn)1(n1). 4.1

The equality holds if G is isomorphic to Kn and n2K2 with n=2m.

Proof

Using the Cauchy–Schwarz inequality for ρ2,ρ3,,ρn and (1,1,,1)(n1)times, we have

i=2nρi(i=2nρi)(n1),i=2nρi(ED(G)ρ1)(n1),ED(G)ρ1i=2nρin1.

However, ρ2+ρ3++ρnn1(ρ2ρ3ρn)1n1, and therefore

ED(G)ρ1(n1)(ρ2ρ3ρn)1(n1)(n1),ED(G)ρ1+(n1)(ρ2ρ3ρn)1(n1)=ρ1+(n1)(|det(A)|ρ1)1(n1).

Let ρ1=x and f(x)=x+(n1)(|det(A)|x)1(n1). Then f(x)=1|det(A)|1(n1)xn(n1) and f(x)=n|det(A)|1(n1)(n1)x(2n1)(n1).

For maxima or minima, f(x)=0, which gives the value x=|det(A)|1n.

At this point, f(x)=n(n1)|det(A)|1n0 for all n>1. Thus the function f(x) attains its minimum at x=|det(A)|1n, and the minimum value is f(|det(A)|1n)=n|det(A)|1n. However, 2Mn=ρ12+ρ22++ρn2n2Wnρ1+ρ2++ρnn(ρ1ρ2ρn)1n. This implies |det(A)|1n2Wn. Since 2Wn, we have 2Wnρ1.

Therefore, the function is increasing in the interval |detA|1n2Wnρ12M, and therefore f(ρ1)f(2Wn), and

ED(G)2Wn+(n1)|det(A)|1(n1)(2Wn)1(n1).

(i) If G is isomorphic to Kn, then |det(A)|=n1, 2Wn=n1, and hence ED(G)=2(n1).

(ii) If G isomorphic to n2K2 with n=2m, then the eigenvalues are ±1 (each with multiplicity n2), and hence ED(G)=n. □

Theorem 4.3

Let G be a graph with m edges and n(>3) vertices, and let Wn. Then

ED(G)(Wn)+(2Wn)+(n2)|det(A)|1(n2)((Wn)(2Wn))1(n2). 4.2

Proof

For (n2) entries of eigenvalues ρ2,ρ3,,ρn1 and (1,1,,1)(n2)times, applying the Cauchy–Schwarz inequality, we have

i=2n1ρi(i=2n1ρi)(n2),

that is,

i=2n1ρi(ED(G)ρ1ρn)(n2),

so that

ED(G)ρ1ρni=2n1ρin2.

Since the arithmetic mean is greater than or equal to the geometric mean, we get

ED(G)ρ1ρn(n2)(ρ2ρ3ρn1)1(n2)(n2),ED(G)ρ1+ρn+(n2)(|det(A)|ρ1ρn)1(n2).

The equality holds if G is n2K2 with n=2m or Kn,n.

Put ρ1=x and ρn=y. We minimize the right side of the above function. Let f(x,y)=x+y+(n2)(|det(A)|xy)1(n2). Then fx=1|det(A)|1n2y(xy)(n1)n2,

fy=1|det(A)|1n2x(xy)(n1)n2,fxx=|det(A)|1n2(n1n2)y2(xy)(2n3)n2,fyy=|det(A)|1n2(n1n2)x2(xy)(2n3)n2andfxy=|det(A)|1n2(xy)(n1)n2n2.

For maxima or minima, fx=0 and fy=0, which gives xy1n1=|det(A)|1n1 and yx1n1=|det(A)|1n1. Solving, we get x=|det(A)|1n and y=|det(A)|1n. At this point, the values of fxx, fyy, fxy, and Δ=fxxfyy(fxy)2 are fxx=fyy=(n1n2)|det(A)|1n, fxy=1n2|det(A)|1n, and Δ=(nn2)|det(A)|2n0 for all n2. The minimum value is f(|det(A)|1n,|det(A)|1n)=n|det(A)|1n. However, |det(A)|1n2Wnρ12M and 0ρn|det(A)|1n2Wn2M.

For Wn, f(x,y) increases in the intervals |det(A)|1n2Wnx2M and 0y|det(A)|1nWn2Wn2M, that is, f(x,y) increases in the intervals |det(A)|1n2Wnρ12M and 0ρn|det(A)|1nWn2M. At ρn=Wn, we have

f(ρ1,ρn)f(2Wn,Wn)f(2Wn,|det(A)|1n)f(|det(A)|1n,|det(A)|1n).

Therefore ED(G)(Wn)+(2Wn)+(n2)|det(A)|1(n2)((Wn)(2Wn))1(n2). □

Brief summary and conclusion

In this paper, we established lower and upper bounds for the distance energy of a graph. Across the globe, attempts are being made by researchers to improve these bounds. The lower and upper bounds obtained in this paper improve the McClelland and Koolen–Moulton bounds for the distance energy of a graph.

Acknowledgements

We thank anonymous reviewers and editors of this manuscript for giving their inputs and suggestions in improving the quality of this paper.

Authors’ contributions

GS and MRR drafted the manuscript. RPK and DSN revised it. All authors read and approved the final manuscript.

Funding

Not applicable.

Competing interests

The authors declare that they have no competing interests.

Footnotes

Publisher’s Note

Springer Nature remains neutral with regard to jurisdictional claims in published maps and institutional affiliations.

Contributor Information

G. Sridhara, Email: srsrig@gmail.com

M. R. Rajesh Kanna, Email: mr.rajeshkanna@gmail.com

R. Pradeep Kumar, Email: pradeepr.mysore@gmail.com

D. Soner Nandappa, Email: ndsoner@gmail.com

References

  • 1.Bozkurt S.B., Gügör A.D., Zhou B. Note on distance energy of graph. MATCH Commun. Math. Comput. Chem. 2010;64:129–134. [Google Scholar]
  • 2.Cvetković D., Gutman I., editors. Applications of Graph Spectra. Belgrade: Mathematical Institution; 2009. [Google Scholar]
  • 3.Cvetković D., Gutman I., editors. Selected Topics on Applications of Graph Spectra. Belgrade: Mathematical Institute; 2011. [Google Scholar]
  • 4.Graovac A., Gutman I., Trinajstić N. Topological Approach to the Chemistry of Conjugated Molecules. Berlin: Springer; 1977. [Google Scholar]
  • 5.Gutman I. The energy of a graph. Ber. Math. Stat. Sekt. Forschungsz. Graz. 1978;103:1–22. [Google Scholar]
  • 6.Gutman I. The energy of a graph: old and new. In: Betten A., Kohnert A., Laue R., Wassermann A., editors. Algebraic Combinatorics and Applications. Berlin: Springer; 2001. pp. 196–211. [Google Scholar]
  • 7.Gutman I., Polansky O.E. Mathematical Concepts in Organic Chemistry. Berlin: Springer; 1986. [Google Scholar]
  • 8.Indulal G., Gutman I., Vijayakumar A. On the distance energy of graph. MATCH Commun. Math. Comput. Chem. 2008;60:461–472. [Google Scholar]
  • 9.Koolen J.H., Moulton V. Maximal energy of graphs. Adv. Appl. Math. 2001;26:47–52. doi: 10.1006/aama.2000.0705. [DOI] [Google Scholar]
  • 10.Koolen J.H., Moulton V. Maximal energy of bipartite graphs. Graphs Comb. 2003;19:131–135. doi: 10.1007/s00373-002-0487-7. [DOI] [Google Scholar]
  • 11.Liu H., Lu M., Tian F. Some upper bounds for the energy of graphs. J. Math. Chem. 2007;41(1):45–57. doi: 10.1007/s10910-006-9183-9. [DOI] [Google Scholar]
  • 12.McClelland B.J. Properties of the latent root of a matrix: the estimation of π-electron energies. J. Chem. Phys. 1971;54:640–643. doi: 10.1063/1.1674889. [DOI] [Google Scholar]
  • 13.Ramane H.S., Revankar D.S., Gutman I., Rao S.B., Acharya B.D., Walikar H.B. Bounds for distance energy of graph. Kragujev. J. Math. 2008;31:59–68. [Google Scholar]
  • 14.Zhou B., Ilić A. On distance spectral radius and distance energy of graphs. MATCH Commun. Math. Comput. Chem. 2010;64:261–280. [Google Scholar]

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