PMID- 32442982 OWN - NLM STAT- PubMed-not-MEDLINE LR - 20200716 IS - 1361-6528 (Electronic) IS - 0957-4484 (Linking) VI - 31 IP - 39 DP - 2020 Sep 25 TI - First-principles investigations on MXene-blue phosphorene and MXene-MoS(2) transistors. PG - 395203 LID - 10.1088/1361-6528/ab95b4 [doi] AB - In the semiconductor industry, one of the most important steps in the development of electronic devices is the discovery of electrode materials that are suitable for ohmic contact. As a newly found type of 2D materials, MXenes have been explored as materials for use in field effect transistors (FETs) with promising performances, which urges for the underlying mechanisms to be understood. In this work, the behaviors of the 5-10 nm device models for monolayer blue phosphorene (BlueP) and MoS(2) with a MXene electrode are investigated using ab initio quantum transport simulations. Firstly, the interfacial properties of BlueP and MoS(2) in contact with M(3)C(2)T(2) (M = Ti, Zr, or Hf; T = F, OH, or O) MXene are studied. The results show that OH and some of the F functionalized MXenes form an n-type ohmic contact with BlueP or MoS(2), while the O functionalized MXenes form a p-type ohmic contact with BlueP and MoS(2). Accordingly, when the FET model is built with M(3)C(2)(OH)(2) electrodes, these FETs exhibit high on-currents due to the ohmic contacts with subthreshold swing between 100 approximately 200 mV/decade, and high on/off ratios up to 10(6) at a bias voltage of 0.5 V. Our results imply that a FET with a sub-10 nm channel length can satisfy the requirements of both high performance and low power logic applications. The results from this study indicate that MXenes may act as the appropriate electrode for high-performance BlueP and MoS(2) FETs, which may provide new clues to guide the application of various 2D materials in electronics. FAU - Zhou, Yuhong AU - Zhou Y AD - School of Electronics and Information Engineering, Ningbo University of Technology, Ningbo 315201 People's Republic of China. FAU - Zhuge, Xia AU - Zhuge X FAU - An, Peng AU - An P FAU - Du, Shiyu AU - Du S LA - eng PT - Journal Article DEP - 20200522 PL - England TA - Nanotechnology JT - Nanotechnology JID - 101241272 SB - IM EDAT- 2020/05/23 06:00 MHDA- 2020/05/23 06:01 CRDT- 2020/05/23 06:00 PHST- 2020/05/23 06:00 [pubmed] PHST- 2020/05/23 06:01 [medline] PHST- 2020/05/23 06:00 [entrez] AID - 10.1088/1361-6528/ab95b4 [doi] PST - ppublish SO - Nanotechnology. 2020 Sep 25;31(39):395203. doi: 10.1088/1361-6528/ab95b4. Epub 2020 May 22.