Despite the great promise of armchair graphene nanoribbons (aGNRs) as high-performance semiconductors, practical band-gap engineering of aGNRs remains an unmet challenge. Given that width and edge structures are the two key factors for modulating band-gaps of aGNRs, a reliable synthetic method that allows control of both factors would be highly desirable. Here we report a simple modular strategy for efficient preparation of N = 6 aGNR, the narrowest member in the N = 3p (p: natural number) aGNR family, and two unsymmetrically edge-functionalized GNRs that contain benzothiadiazole and benzotriazole moieties. The trend of band-gap transitions among these GNRs parallels those in donor-acceptor alternating conjugated polymers. In addition, post-functionalization of the unsymmetrical heterocyclic edge via C-H borylation permits further band-gap tuning. Therefore, this method opens the door for convenient band-gap engineering of aGNRs through modifying the heteroarenes on the edge.
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http://dx.doi.org/10.1038/s41467-018-03747-2 | DOI Listing |
Mater Horiz
January 2025
State Key Laboratory of Digital Medical Engineering, School of Biological Science and Medical Engineering, Southeast University, Nanjing, 210096, P. R. China.
Atrazine is a widely used and heavily contaminating pesticide. In this work, we designed and synthesized a versatile catalyst for the degradation and fluorescent detection of atrazine. This catalyst consists of Cu clusters modified by a Schiff base.
View Article and Find Full Text PDFJ Phys Condens Matter
January 2025
South China Normal University, School of Physics, Guangdong Provincial Key Laboratory of Quantum Engineering and Quantum Materials, Guangdong Basic Research Center of Excellence for Structure and Fundamental Interactions of Matter, Guangzhou, 510631, CHINA.
With the continuous development of digital information and big data technologies, the ambient temperature and heat generation during the operation of magnetic storage devices play an increasingly crucial role in ensuring data security and device stability. In this study, we examined the lattice thermal conductivity of the van der Waals magnetic semiconductor CrSBr from bulk to monolayer structures using first-principles calculations and the phonon Boltzmann transport equation. Our results indicated that lattice thermal conductivity show anisotropy and CrSBr bilayer exhibits lower thermal conductivity at all temperatures.
View Article and Find Full Text PDFACS Omega
January 2025
Department of Mechanical Engineering and Engineering Science, University of North Carolina at Charlotte, Charlotte, North Carolina 28223, United States.
Electrides are ionic crystals, with electrons acting as anions occupying well-defined lattice sites. These exotic materials have attracted considerable attention in recent years for potential applications in catalysis, rechargeable batteries, and display technology. Among this class of materials, electride semiconductors can further expand the horizon of potential applications due to the presence of a band gap.
View Article and Find Full Text PDFACS Omega
January 2025
Department of Physics, Government General Degree College Gopiballavpur-II, Jhargram 721517, India.
Effective engineering of nanostructured materials provides a scope to explore the underlying photoelectric phenomenon completely. A simple cost-effective chemical reduction route is taken to grow nanoparticles of Cd Zn S with varying = 1, 0.7, 0.
View Article and Find Full Text PDFChem Asian J
January 2025
China Three Gorges University, Key Laboratory of Inorganic Nonmetallic Crystalline and Energy Conversion Materials, College of Materials and Chemical Engineering, China Three Gorges University, CHINA.
The Keggin clusters are one kind of the most representative molecular structures in the field of metal-oxo clusters. Although the different types of Keggin clusters with various components were reported, the research about γ-Keggin isomer remains less developed. This is ascribed to the difficulty in obtaining the stable pure γ-Keggin cluster for the structural isomerization.
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