On the maximal energy tree with two maximum degree vertices

TL;DR

This paper determines which of two specific tree structures maximizes the energy among trees with two maximum degree vertices, revealing that the maximal structure varies with the maximum degree and the size of the tree.

Contribution

It introduces a new method to identify the maximal energy tree among two candidates, resolving previous ambiguities and detailing how the optimal structure depends on degree and size.

Findings

For large degree (≥7), $T_b$ is maximal.

For degree 3, $T_a$ is maximal.

For degree 4, $T_a$ is maximal except at $t=4$ where $T_b$ is maximal.

Abstract

For a simple graph $G$, the energy $E(G)$ is defined as the sum of the absolute values of all eigenvalues of its adjacent matrix. For $\Delta\geq 3$ and $t\geq 3$, denote by $T_a(\Delta,t)$ (or simply $T_a$) the tree formed from a path $P_t$ on $t$ vertices by attaching $\Delta-1$ $P_2$'s on each end of the path $P_t$, and $T_b(\Delta, t)$ (or simply $T_b$) the tree formed from $P_{t+2}$ by attaching $\Delta-1$ $P_2$'s on an end of the $P_{t+2}$ and $\Delta -2$ $P_2$'s on the vertex next to the end. In [X. Li, X. Yao, J. Zhang and I. Gutman, Maximum energy trees with two maximum degree vertices, J. Math. Chem. 45(2009), 962--973], Li et al. proved that among trees of order $n$ with two vertices of maximum degree $\Delta$, the maximal energy tree is either the graph $T_a$ or the graph $T_b$, where $t=n+4-4\Delta\geq 3$. However, they could not determine which one of $T_a$ and $T_b$ is the maximal energy tree. This is because the quasi-order method is invalid for comparing their energies. In this paper, we use a new method to determine the maximal energy tree. It turns out that things are more complicated. We prove that the maximal energy tree is $T_b$ for $\Delta\geq 7$ and any $t\geq 3$, while the maximal energy tree is $T_a$ for $\Delta=3$ and any $t\geq 3$. Moreover, for $\Delta=4$, the maximal energy tree is $T_a$ for all $t\geq 3$ but $t=4$, for which $T_b$ is the maximal energy tree. For $\Delta=5$, the maximal energy tree is $T_b$ for all $t\geq 3$ but $t$ is odd and $3\leq t\leq 89$, for which $T_a$ is the maximal energy tree. For $\Delta=6$, the maximal energy tree is $T_b$ for all $t\geq 3$ but $t=3,5,7$, for which $T_a$ is the maximal energy tree. One can see that for most $\Delta$, $T_b$ is the maximal energy tree, $\Delta=5$ is a turning point, and $\Delta=3$ and 4 are exceptional cases.