Theoretical Study of Interfacial and Electronic Properties of Transition Metal Dichalcogenides and Organic Molecules Based van der Waals Heterostructures

2020 ◽  
Vol 3 (6) ◽  
pp. 2000045 ◽  
Author(s):  
Mohammad Rezwan Habib ◽  
Weijia Wang ◽  
Afzal Khan ◽  
Yahya Khan ◽  
Sk Md Obaidulla ◽  
...  
Keyword(s):  
Transition Metal ◽  
Electronic Properties ◽  
Organic Molecules ◽  
Theoretical Study ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Van Der Waals Heterostructures ◽  
Metal Dichalcogenides

Theoretical characterization of the electronic properties of heterogeneous vertical stacks of 2D metal dichalcogenides containing one doped layer

2020 ◽  
Vol 22 (25) ◽  
pp. 14088-14098
Author(s):  
Amine Slassi ◽  
David Cornil ◽  
Jérôme Cornil
Keyword(s):  
Transition Metal ◽  
Electronic Properties ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Optoelectronic Devices ◽  
Metal Dichalcogenides ◽  
Theoretical Characterization ◽  
New Generation

The rise of van der Waals hetero-structures based on transition metal dichalcogenides (TMDs) opens the door to a new generation of optoelectronic devices.

scholarly journals A review of molybdenum disulfide (MoS2) based photodetectors: from ultra-broadband, self-powered to flexible devices

RSC Advances ◽  
2020 ◽  
Vol 10 (51) ◽  
pp. 30529-30602 ◽  
Author(s):  
Hari Singh Nalwa
Keyword(s):  
Transition Metal ◽  
Molybdenum Disulfide ◽  
Strong Interaction ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Two Dimensional ◽  
Van Der Waals Heterostructures ◽  
Flexible Devices ◽  
Metal Dichalcogenides ◽  
Self Powered

Two-dimensional transition metal dichalcogenides have attracted much attention in the field of optoelectronics due to their tunable bandgaps, strong interaction with light and tremendous capability for developing diverse van der Waals heterostructures with other nanomaterials.

Tunable coupling of terahertz Dirac plasmons and phonons in transition metal dichalcogenide-based van der Waals heterostructures

2D Materials ◽  
2021 ◽  
Author(s):  
Icaro Rodrigues Lavor ◽  
Andrey Chaves ◽  
Francois M Peeters ◽  
Ben Van Duppen
Keyword(s):  
Transition Metal ◽  
Fermi Energy ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Transition Metal Dichalcogenide ◽  
Phonon Coupling ◽  
Van Der Waals Heterostructures ◽  
Composition And Structure ◽  
Metal Dichalcogenides ◽  
Tunable Coupling

Abstract Dirac plasmons in graphene hybridize with phonons of transition metal dichalcogenides (TMDs) when the materials are combined in so-called van der Waals heterostructures (vdWh), thus forming surface plasmon-phonon polaritons (SPPPs). The extend to which these modes are coupled depends on the TMD composition and structure, but also on the plasmons' properties. By performing realistic simulations that account for the contribution of each layer of the vdWh separately, we calculate how the strength of plasmon-phonon coupling depends on the number and composition of TMD layers, on the graphene Fermi energy and the specific phonon mode. From this, we present a semiclassical theory that is capable of capturing all relevant characteristics of the SPPPs. We find that it is possible to realize both strong and ultra-strong coupling regimes by tuning graphene's Fermi energy and changing TMD layer number.

Unveiling the layer-dependent electronic properties in transition-metal dichalcogenides heterostructures assisted by machine learning

Nanoscale ◽  
2022 ◽  
Author(s):  
Tao Wang ◽  
Xiaoxing Tan ◽  
Yadong Wei ◽  
Hao Jin
Keyword(s):  
Machine Learning ◽  
Transition Metal ◽  
Electronic Properties ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Two Dimensional ◽  
Layer Number ◽  
Metal Dichalcogenides ◽  
Computational Resources

The electronic properties of layered two-dimensional (2D) transition-metal dichalcogenides (TMDs) van der Waals (vdW) heterostructures are strongly dependent on their layer number (N). However, it requires extremely large computational resources...

Two-dimensional transition-metal dichalcogenides-based ferromagnetic van der Waals heterostructures

Nanoscale ◽  
2017 ◽  
Vol 9 (44) ◽  
pp. 17585-17592 ◽  
Author(s):  
Juan Du ◽  
Congxin Xia ◽  
Wenqi Xiong ◽  
Tianxing Wang ◽  
Yu Jia ◽  
...  
Keyword(s):  
Transition Metal ◽  
Electric Field ◽  
Ground State ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Two Dimensional ◽  
Van Der Waals Heterostructures ◽  
Metal Dichalcogenides ◽  
Band Alignments ◽  
Curie Temperatures

TMDs-based vdW semiconducting heterostructures have stable ferromagnetic (FM) ground state, high Curie temperatures and electric field-tunable multi-band alignments.

Black phosphorene/monolayer transition-metal dichalcogenides as two dimensional van der Waals heterostructures: a first-principles study

2016 ◽  
Vol 18 (10) ◽  
pp. 7381-7388 ◽  
Author(s):  
Baiqing You ◽  
Xiaocha Wang ◽  
Zhida Zheng ◽  
Wenbo Mi
Keyword(s):  
Electronic Structure ◽  
Transition Metal ◽  
First Principles ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Two Dimensional ◽  
Van Der Waals Heterostructures ◽  
First Principles Study ◽  
Black Phosphorene ◽  
Metal Dichalcogenides

The electronic structure of black phosphorene/XT2(X = Mo, W; T = S, Se, Te) two dimensional heterostructures is presented using the first-principles method.

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