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Title: 1D topological phases in transition-metal monochalcogenide nanowires

Journal Article · · Nanoscale
DOI:https://doi.org/10.1039/d0nr03529g· OSTI ID:1800194
ORCiD logo [1];  [2]
  1. Institute for Basic Science (IBS), Pohang (Korea); Pohang Univ. of Science and Technology (POSTECH) (Korea, Republic of); Univ. of Utah, Salt Lake City, UT (United States)
  2. Univ. of Utah, Salt Lake City, UT (United States)

The Su–Schrieffer–Heeger (SSH) model is a prototypical one-dimensional (1D) diatomic lattice model for non-trivial topological phases and topological excitations. In theory, many variations and extensions of the SSH model have been proposed and explored to better understand the novel aspects of topological physics in low dimensions on the nanoscale. However, the outstanding challenge remains to find real nanomaterials with robust structural stability for realizing the 1D topological states. Here, we develop an extended version of the SSH model with multi-atomic bases of four, six and eight atoms and an imposed screw rotation symmetry. Furthermore, based on first-principles calculations, we demonstrate the realization of this model in transition metal monochalcogenide M6X6 (M = Mo and W; X = S, Se and Te) nanowires. The topological features of the doped M6X6 nanowires are confirmed with non-trivial edge modes and e/2 fractional charges, representative of the 1D non-trivial Zak phase. Our finding not only sheds new light on our fundamental understanding of 1D topological physics, but also significantly extends the scope of 1D topological materials that will attract immediate experimental interest, since isolated M6X6 nanowires have already been synthesized in experiments.

Research Organization:
Univ. of Utah, Salt Lake City, UT (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Grant/Contract Number:
FG02-04ER46148
OSTI ID:
1800194
Alternate ID(s):
OSTI ID: 1635728
Journal Information:
Nanoscale, Vol. 12, Issue 27; ISSN 2040-3364
Publisher:
Royal Society of ChemistryCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 8 works
Citation information provided by
Web of Science

References (40)

Quick iterative scheme for the calculation of transfer matrices: application to Mo (100) journal May 1984
Spin rectification by orbital polarization in Bi-bilayer nanoribbons journal January 2016
Structural evolution and the role of native defects in subnanometer MoS nanowires journal December 2019
Topological insulators and superconductors journal October 2011
Phase-Controlled Growth of One-Dimensional Mo 6 Te 6 Nanowires and Two-Dimensional MoTe 2 Ultrathin Films Heterostructures journal December 2017
Topological states in engineered atomic lattices journal March 2017
Bulk-boundary correspondence from the intercellular Zak phase journal January 2017
Soliton excitations in polyacetylene journal August 1980
First principles study of electronic and mechanical properties of molybdenum selenide type nanowires journal December 2006
Projector augmented-wave method journal December 1994
Atomic-Scale Structure of Mo 6 S 6 Nanowires journal November 2008
Re Doping in 2D Transition Metal Dichalcogenides as a New Route to Tailor Structural Phases and Induced Magnetism journal October 2017
Electrical Conductivity in Doped Polyacetylene journal October 1977
Solitons with fermion number ½ journal June 1976
wannier90: A tool for obtaining maximally-localised Wannier functions journal May 2008
Observation of the topological soliton state in the Su–Schrieffer–Heeger model journal December 2016
Assembling Nanowires from Mo−S Clusters and Effects of Iodine Doping on Electronic Structure journal August 2007
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal October 1996
Dirac cones reshaped by interaction effects in suspended graphene journal July 2011
Interplay between Structure and Magnetism in Mo 12 S 9 I 9 Nanowires journal March 2006
Berry’s phase for energy bands in solids journal June 1989
Torsional Deformations in Subnanometer MoS Interconnecting Wires journal January 2016
Tuning Topological Edge States of Bi(111) Bilayer Film by Edge Adsorption journal April 2014
Chiral solitons in a coupled double Peierls chain journal October 2015
Flexible metallic nanowires with self-adaptive contacts to semiconducting transition-metal dichalcogenide monolayers journal April 2014
Substitutional Electron and Hole Doping of WSe 2 : Synthesis, Electrical Characterization, and Observation of Band-to-Band Tunneling journal March 2017
Re doping induced 2H-1T phase transformation and ferromagnetism in MoS 2 nanosheets journal July 2018
Observation of van der Waals Driven Self-Assembly of MoSI Nanowires into a Low-Symmetry Structure Using Aberration-Corrected Electron Microscopy journal February 2007
Unique Structural and Transport Properties of Molybdenum Chalcohalide Nanowires journal August 2007
WannierTools: An open-source software package for novel topological materials journal March 2018
New Mo 6 Te 6 Sub-Nanometer-Diameter Nanowire Phase from 2H-MoTe 2 journal March 2017
Theory of polarization of crystalline solids journal January 1993
Enhancement of the superconducting transition temperature by Re doping in Weyl semimetal MoTe 2 journal September 2018
Isolation of Single-Wired Transition-Metal Monochalcogenides by Carbon Nanotubes journal February 2019
Tuning the Electronic and Photonic Properties of Monolayer MoS 2 via In Situ Rhenium Substitutional Doping journal February 2018
Electron Transport in a Multichannel One-Dimensional Conductor: Molybdenum Selenide Nanowires journal February 2006
Nanostructured topological state in bismuth nanotube arrays: inverting bonding–antibonding levels of molecular orbitals journal January 2017
Molybdenum Selenide Molecular Wires as One-Dimensional Conductors journal December 1999
Solitons in conducting polymers journal July 1988
Direct measurement of the Zak phase in topological Bloch bands journal November 2013