Graphenequantum dots embedded in a hexagonal BN sheet: identical influences of zigzag/armchair edges
文献信息
Various graphene quantum dots (GQDs) embedded in a hexagonal BN sheet were studied theoretically using the tight binding model. The effective mass was analyzed as a function of the distance between neighboring GQDs. It was found that the effective mass increases exponentially as the distance increases, indicating that the confined states of GQDs are well conserved in these hybrid systems. Further studies revealed that a ubiquitous gap of 0.3–3 eV exists, the size of which is mainly governed by the GQD's dimensions whereas it is insensitive to edge structures. These results show that GQDs in BN are promising candidates for optoelectronics.
期刊推荐

Atomization and Sprays

Herald of the Russian Academy of Sciences

Chinese Journal of Chemistry

Journal of Asian Natural Products Research

Topics in Catalysis

Bioorganic & Medicinal Chemistry Letters

Journal of Chemical Sciences

Critical Reviews in Solid State and Materials Sciences

Biocatalysis and Biotransformation

Cellulose
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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.
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