An estimation of HOMO–LUMO gap for a class of molecular graphs

نویسندگان

چکیده

Abstract For any simple connected graph G of order n , having eigen spectrum μ 1 ≥ 2 ⋯ with middle eigenvalues H and L where = ⌊( + 1)/2⌋ ⌈( 1)/2⌉, the HOMO–LUMO gap is defined as Δ . In this article, a upper bound for corresponding to special class bipartite graphs estimated. As an application, bounds certain classes nanotubes nanotori are

برای دانلود باید عضویت طلایی داشته باشید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

an application of fuzzy logic for car insurance underwriting

در ایران بیمه خودرو سهم بزرگی در صنعت بیمه دارد. تعیین حق بیمه مناسب و عادلانه نیازمند طبقه بندی خریداران بیمه نامه براساس خطرات احتمالی آنها است. عوامل ریسکی فراوانی می تواند بر این قیمت گذاری تاثیر بگذارد. طبقه بندی و تعیین میزان تاثیر گذاری هر عامل ریسکی بر قیمت گذاری بیمه خودرو پیچیدگی خاصی دارد. در این پایان نامه سعی در ارائه راهی جدید برای طبقه بندی عوامل ریسکی با استفاده از اصول و روش ها...

An Efficient Algorithm for Reducing the Duality Gap in a Special Class of the Knapsack Problem

A special class of the knapsack problem is called the separable nonlinear knapsack problem. This problem has received considerable attention recently because of its numerous applications. Dynamic programming is one of the basic approaches for solving this problem. Unfortunately, the size of state-pace will dramatically increase and cause the dimensionality problem. In this paper, an efficient a...

متن کامل

An Efficient Algorithm for Reducing the Duality Gap in a Special Class of the Knapsack Problem

A special class of the knapsack problem is called the separable nonlinear knapsack problem. This problem has received considerable attention recently because of its numerous applications. Dynamic programming is one of the basic approaches for solving this problem. Unfortunately, the size of state-pace will dramatically increase and cause the dimensionality problem. In this paper, an efficient a...

متن کامل

development and implementation of an optimized control strategy for induction machine in an electric vehicle

in the area of automotive engineering there is a tendency to more electrification of power train. in this work control of an induction machine for the application of electric vehicle is investigated. through the changing operating point of the machine, adapting the rotor magnetization current seems to be useful to increase the machines efficiency. in the literature there are many approaches wh...

15 صفحه اول

investigating the feasibility of a proposed model for geometric design of deployable arch structures

deployable scissor type structures are composed of the so-called scissor-like elements (sles), which are connected to each other at an intermediate point through a pivotal connection and allow them to be folded into a compact bundle for storage or transport. several sles are connected to each other in order to form units with regular polygonal plan views. the sides and radii of the polygons are...

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

ژورنال

عنوان ژورنال: Main Group Metal Chemistry

سال: 2022

ISSN: ['0792-1241', '2191-0219']

DOI: https://doi.org/10.1515/mgmc-2022-0011