دورية أكاديمية

Modulating Quantum Interference Between Destructive and Constructive States in Double N‐Substituted Single Molecule Junctions

التفاصيل البيبلوغرافية
العنوان: Modulating Quantum Interference Between Destructive and Constructive States in Double N‐Substituted Single Molecule Junctions
المؤلفون: Zi‐Zhen Chen, Shun‐Da Wu, Jin‐Liang Lin, Li‐Chuan Chen, Jing‐Jing Cao, Xiangfeng Shao, Colin J. Lambert, Hao‐Li Zhang
المصدر: Advanced Electronic Materials, Vol 9, Iss 2, Pp n/a-n/a (2023)
بيانات النشر: Wiley-VCH, 2023.
سنة النشر: 2023
المجموعة: LCC:Electric apparatus and materials. Electric circuits. Electric networks
LCC:Physics
مصطلحات موضوعية: molecular electronic, nonequilibrium Green's function, quantum interferences, scanning tunneling microscopes, single‐molecule devices, Electric apparatus and materials. Electric circuits. Electric networks, TK452-454.4, Physics, QC1-999
الوصف: Abstract Quantum interference (QI) plays a crucial role in determining the charge transport in molecular devices. In this work, the efficient modulation of QI in meta‐phenylene ethylene oligomer molecular devices by a double N‐substitution strategy is demonstrated. By altering the positions of two N atoms in the central ring with respect to the connecting sites, the molecular conductance can be tuned by more than one order of magnitude. Theoretical analysis, including magic ratio theory, orbital rule, and transmission simulations, reveals how the two N atoms synergistically modulate the molecule conductance between destructive QI and constructive QI states. Remarkably, addition of a second N atom does not simple reinforce the effect of the first; in contrast, it may completely cancel the effect of the first. Understanding the complex electronic interplay between the two N atoms in double N‐substituted molecules paves a path toward utilization of heterocyclic aromatic hydrocarbons in molecular electronics.
نوع الوثيقة: article
وصف الملف: electronic resource
اللغة: English
تدمد: 2199-160X
Relation: https://doaj.org/toc/2199-160X
DOI: 10.1002/aelm.202201024
URL الوصول: https://doaj.org/article/35a11f9e0cbc4c63bbce35371088bd8a
رقم الأكسشن: edsdoj.35a11f9e0cbc4c63bbce35371088bd8a
قاعدة البيانات: Directory of Open Access Journals
الوصف
تدمد:2199160X
DOI:10.1002/aelm.202201024