Effect of defects on ballistic transport in a bilayer SnS2-based junction with Co intercalated electrodes†

IF 2.9 3区 化学 Q3 CHEMISTRY, PHYSICAL Physical Chemistry Chemical Physics Pub Date : 2025-01-02 DOI:10.1039/D4CP03605K
Miao Liu, Huan Wang, Xiaojie Liu, Yin Wang and Haitao Yin
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Abstract

This study theoretically investigates the defect-related electronic structure and transport properties in a device where a semiconductor bilayer SnS2 (BL-SnS2) serves as the central scattering region and bilayer SnS2 with cobalt atom intercalation (Co-SnS2) as the metallic electrodes. The Co-SnS2/BL-SnS2 junction forms an ohmic contact, which is robust to defects. Low contact resistances of 52.1 Ω μm and 56.2 Ω μm are obtained in the zigzag (ZZ) and armchair (AC) transport directions, respectively. Defects, whether near the interface or in the middle of the central region, reduce the barrier between metal and semiconductor and the contact resistance. In particular, defects in the middle of the central region introduce impurity states and may result in resonant tunneling processes. This causes leakage current in the AC direction but not in the ZZ direction because impurity-associated transmission peaks in the latter are always outside the bias window.

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缺陷对钴嵌入电极双层SnS2基结中弹道输运的影响
本研究以半导体双层SnS2 (BL-SnS2)为中心散射区,钴原子嵌层双层SnS2 (Co-SnS2)为金属电极,从理论上研究了该器件中与缺陷相关的电子结构和输运性质。Co-SnS2/BL-SnS2结形成欧姆接触,对缺陷具有较强的鲁棒性。在z形(ZZ)输运方向和扶手椅(AC)输运方向上,接触电阻分别为52.1 Ω·μm和56.2 Ω·μm。缺陷,无论是在界面附近还是在中心区域的中间,都减少了金属与半导体之间的屏障和接触电阻。特别是,中心区域中间的缺陷引入杂质态,并可能导致共振隧穿过程。由于杂质相关的传输峰总是在偏置窗口之外,因此在交流方向上产生漏电流,而在ZZ方向上不会产生漏电流。
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来源期刊
Physical Chemistry Chemical Physics
Physical Chemistry Chemical Physics 化学-物理:原子、分子和化学物理
CiteScore
5.50
自引率
9.10%
发文量
2675
审稿时长
2.0 months
期刊介绍: 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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