Two-dimensional (2D) transition metal dichalcogenide (TMDC) semiconductors have been recognized as reliable candidates for future sub-10 nm physical gate length field-effect transistors (FETs). However, the device performance of 2D P-type devices is far inferior to that of N-type devices, which seriously hinders the development of complementary metal-oxide-semiconductor (CMOS) integrated circuits. Herein, we presented that two new 2D TMDC channel materials, ZrS and HfS, can realize high-performance P-type MOSFETs through first-principles quantum transport simulations. Different from the 2D MoS and WSe, the continuous in-plane -orbitals at the valence band edge of 2D ZrS and HfS lead to a small hole effective mass of 0.24 m. As a result, 2D ZrS and HfS P-type MOSFETs with 10 nm gate length possess an on-state current () as high as 2000 μA/μm. Moreover, even when the gate length shrinks to 5 nm, the can also reach ∼1500 μA/μm with the energy delay product ranging from 3 × 10 to 1 × 10 Js/μm, which are better than many other 2D P-type MOSFETs like MoS and WSe. Our work demonstrates that 2D ZrS and HfS are competitive channel materials for constructing future sub-10 nm P-type high-performance FETs.
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http://dx.doi.org/10.1021/acs.jpclett.4c02694 | DOI Listing |
Nano Lett
January 2025
Department of Physics, Chalmers University of Technology, SE-412 96 Gothenburg, Sweden.
Two-dimensional (2D) transition metal dichalcogenides (TMDs) have received significant interest for use in tunnel field-effect transistors (TFETs) due to their ultrathin layers and tunable band gap features. In this study, we used density functional theory (DFT) to investigate the electronic properties of six TMD heterostructures, namely, MoSe/HfS, MoTe/ZrS, MoTe/HfS, WSe/HfS, WTe/ZrS, and WTe/HfS, focusing on variations in band alignments. We demonstrate that WTe/ZrS and WTe/HfS have the smallest band gaps (close to 0 or broken) from the considered set.
View Article and Find Full Text PDFJ Phys Chem Lett
November 2024
MIIT Key Laboratory of Advanced Display Materials and Devices, School of Materials Science and Engineering, Nanjing University of Science and Technology, Nanjing 210094, China.
Small Methods
October 2024
Key Lab of Semiconductor Materials Science, Institute of Semiconductors, Chinese Academy of Sciences, Beijing, 100083, P. R. China.
Van der Waals (vdW) heterostructures comprising of transition metal dichalcogenides (TMDs) and hexagonal boron nitride (h-BN) are promising building blocks for novel 2D devices. The vdW epitaxy provides a straightforward integration method for fabricating high-quality TMDs/h-BN vertical heterostructures. In this work, the vdW epitaxy of high-quality single-crystal HfSe on epitaxial h-BN/sapphire substrates by chemical vapor deposition is demonstrated.
View Article and Find Full Text PDFNanoscale
November 2023
School of Physics, Henan Key Laboratory of Infrared Materials & Spectrum Measures and Applications, Henan Normal University, Xinxiang, Henan 453007, China.
Multifunctional devices are an indispensable choice to fulfil the increasing demand for miniaturized and integrated circuit systems. However, bulk material-based devices encounter the challenge of miniaturized all-in-one systems with multiple functions. In this study, we designed a field effect transistor (FET) based on a monolayer HfS-ZrS lateral heterojunction.
View Article and Find Full Text PDFPhys Chem Chem Phys
March 2023
School of Physics and Electronic Science, Hunan University of Science and Technology, Xiangtan 411201, China.
Z-scheme van der Waals heterojunctions are very attractive photocatalysts attributed to their excellent reduction and oxidation abilities. In this paper, we designed InN/XS (X = Zr, Hf) heterojunctions and explored their electronic structure properties, photocatalytic performance, and light absorption systematically using first-principles calculations. We found that the valence-band maximum (VBM) and conduction-band minimum (CBM) of the InN/XS (X = Zr, Hf) heterojunctions are contributed by InN and XS, respectively.
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