First principles-based study of monolayer WSSe and metal interface. (Record no. 429537)

MARC details
000 -LEADER
fixed length control field 02795nam a2200229 4500
008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION
fixed length control field 230628b |||||||| |||| 00| 0 eng d
041 ## - LANGUAGE CODE
Language code of text/sound track or separate title en.
082 ## - DEWEY DECIMAL CLASSIFICATION NUMBER
Classification number 621.3
Item number MAY
100 ## - MAIN ENTRY--PERSONAL NAME
Personal name Kumar, Mayank
245 ## - TITLE STATEMENT
Title First principles-based study of monolayer WSSe and metal interface.
260 ## - PUBLICATION, DISTRIBUTION, ETC. (IMPRINT)
Place of publication, distribution, etc Bengaluru
Name of publisher, distributor, etc IISc
Date of publication, distribution, etc 2023
300 ## - PHYSICAL DESCRIPTION
Extent xv, 54p.
Other physical details col. ill. ;
Dimensions 29.1 cm * 20.5 cm
Accompanying material e-Thesis
Size of unit 3.362Mb
500 ## - GENERAL NOTE
General note Include bibliographical references and index.
502 ## - DISSERTATION NOTE
Dissertation note MTech (Res); 2023; Electronic systems engineering
520 ## - SUMMARY, ETC.
Summary, etc The semiconductor-metal interface is universal for any electron device. Two-dimensional semiconductors have the advantages of free dangling bonds and atomically flat surfaces, making them promising materials to substitute bulk-Silicon in next-generation transistors. However, two-dimensional material like transition metal dichalcogenides (TMD) makes highly resistive contact with metallic electrodes in electronic devices. A material with intrinsic dipole can optimize this effect. 2D Janus TMD MoSSe has structural symmetry like MoS2 and contains intrinsic dipoles that strongly modify the metal contact properties. A study of MoSSe with potential electrode materials has already seen where both the S and Se sides of MoSSe tend to have ohmic behavior. Along with MoSSe, WSSe is also available commercially for experimental efforts. The study of Janus WSSe material shows that it is an excellent photocatalyst for water splitting, and doped WSSe nanosheet is an efficient nanosensor. However, the electronic nature of this material’s interface with metals is not investigated yet. In this work, we have examined the interfacial properties of monolayer WSSe with bulk metal electrodes. Using density functional theory-based electronic structure calculation, we evaluated the structural and electronic properties of top contacts of WSSe with six metals Ag, Au, Ru, Pd, Pt, and Ti, considering both the S and Se sides. For the side contacts, we have selected three metals Ag, Au, and Ti, and investigated the electronic properties using ab-initio quantum transport simulation. Band structures of the Janus material contacted with Ru, Pd, Pt, and Ti are highly hybridized, leading to no Schottky barrier height in the vertical direction. However, with Au and Ag, Schottky contacts are formed in both lateral and vertical directions. The contacts' nature and barrier heights differ for Au and Ag. This investigation gives insight into the interfacial properties of Janus materials to use in future nanoelectronics devices.
650 ## - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name as entry element 2D materials
650 ## - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name as entry element Semiconductor metal interface
650 ## - SUBJECT ADDED ENTRY--TOPICAL TERM
Topical term or geographic name as entry element Transition Metal Dichalcogenides
700 ## - ADDED ENTRY--PERSONAL NAME
Personal name Mahapatra, Santanu advised
856 ## - ELECTRONIC LOCATION AND ACCESS
Uniform Resource Identifier https://etd.iisc.ac.in/handle/2005/6144
942 ## - ADDED ENTRY ELEMENTS (KOHA)
Koha item type Thesis
Holdings
Withdrawn status Lost status Source of classification or shelving scheme Damaged status Not for loan Home library Current library Date acquired Total Checkouts Full call number Barcode Date last seen Koha item type
    Dewey Decimal Classification     JRD Tata Memorial Library JRD Tata Memorial Library 28/06/2023   621.3 MAY ET00157 28/06/2023 E-BOOKS

                                                                                                                                                                                                    Facebook    Twitter

                             Copyright © 2023. J.R.D. Tata Memorial Library, Indian Institute of Science, Bengaluru - 560012

                             Contact   Phone: +91 80 2293 2832

Powered by Koha