In 2015, a new two-dimensional carbon allotrope named penta-graphene (PG), was reported as metastable based on theoretical calculations. This means that PG represents a local minimum in the potential energy surface and it sustains binding energy slightly less negative than the ones displayed by graphite and diamond. PG is formed by pentagonal rings of carbon atoms with sp2 or sp3 hybridization, and they are organized in a pattern known as Cairo pentagonal tiling. In addition, PG was obtained experimentally from the exfoliation of the T12-carbon phase. In 2017, a group of scientists successfully synthesized the few-layered PdSe2 (FL-PdSe2) from bulk crystals, a pentagonal 2D layered noble transition metal dichalcogenide with a puckered morphology that is air-stable. They confirmed that the field-effect transistors made from the FL- PdSe2 display tunable ambipolar charge carrier conduction with a high electron field-effect mobility, indicating the promise of this anisotropic, air-stable, pentagonal 2D material for electronic devices. In this work, we investigated the structural and electronic properties of p-PdSe2 nanoribbons (p-PdSe2NRs) using density functional theory (DFT). Herein, we propose a series of new p-PdSe2NRs by cutting p-PdSe2 sheets. Our first-principles calculations show that such p-PdSe2NRs are energetically stable and a semiconductor excludes sawtooth-sawtooth p-PdSe2NR. These findings provide useful insight into a novel material structure in low-dimensional material systems for potential nanoelectronics.
Tạp chí: 5th INTERNATIONAL NEW YORK CONFERENCE ON EVOLVING TRENDS IN INTERDISCIPLINARY RESEARCH & PRACTICES, Manhattan, New York City, October 3-5, 2021
Tạp chí: Global Multidisciplinary Conference on Industrial Revolution 4.0, Business, Innovation, Education and Social Sciences 2021 (GMIBIES2021) held on 4 December 2021, Kuala Lumpur, Malaysia
Tạp chí: 5th INTERNATIONAL NEW YORK CONFERENCE ON EVOLVING TRENDS IN INTERDISCIPLINARY RESEARCH & PRACTICES, October 3-5, 2021 Manhattan, New York City
Tạp chí khoa học Trường Đại học Cần Thơ
Lầu 4, Nhà Điều Hành, Khu II, đường 3/2, P. Xuân Khánh, Q. Ninh Kiều, TP. Cần Thơ
Điện thoại: (0292) 3 872 157; Email: tapchidhct@ctu.edu.vn
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