A General Algorithm For Determining The Conductivity Zeros In Large Molecular Nanostructures: Applications To Rectangular Graphene Sheets

Fuente: arXiv
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Autori principali: Nita, Marian, Tolea, Mugurel, Marinescu, Catalina
Natura: Preprint
Pubblicazione: 2025
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author Nita, Marian
Tolea, Mugurel
Marinescu, Catalina
author_facet Nita, Marian
Tolea, Mugurel
Marinescu, Catalina
contents We propose an algorithm for determining the zeros of the electric conductivity in large molecular nanonstructures such as graphene sheets. To this end, we employ the inverse graph method, whereby non-zeros of the Green's functions are represented graphically by a segment connecting two atomic sites, to visually signal the existence of a conductance zero as a line that is missing. In rectangular graphene structures the topological properties of the inverse graph determine the existence of two types of Green's function zeros that correspond to absolute conductance cancellations with distinct behavior in the presence of external disorder. We discuss these findings and their potential applications in some particular cases.
format Preprint
id arxiv_https___arxiv_org_abs_2505_14237
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle A General Algorithm For Determining The Conductivity Zeros In Large Molecular Nanostructures: Applications To Rectangular Graphene Sheets
Nita, Marian
Tolea, Mugurel
Marinescu, Catalina
Mesoscale and Nanoscale Physics
We propose an algorithm for determining the zeros of the electric conductivity in large molecular nanonstructures such as graphene sheets. To this end, we employ the inverse graph method, whereby non-zeros of the Green's functions are represented graphically by a segment connecting two atomic sites, to visually signal the existence of a conductance zero as a line that is missing. In rectangular graphene structures the topological properties of the inverse graph determine the existence of two types of Green's function zeros that correspond to absolute conductance cancellations with distinct behavior in the presence of external disorder. We discuss these findings and their potential applications in some particular cases.
title A General Algorithm For Determining The Conductivity Zeros In Large Molecular Nanostructures: Applications To Rectangular Graphene Sheets
topic Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2505.14237