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The combined effect of a lateral square superlattice potential and the Coulomb interaction on the ground state of a two-dimensional electron gas in a perpendicular magnetic field is studied for different rational values of $\Gamma$, the…

Mesoscale and Nanoscale Physics · Physics 2016-11-23 R. Côté , Xavier Bazier-Matte

Transition metal dichalcogenides have recently emerged as promising two-dimensional materials with intriguing electronic properties. Existing calculations of intrinsic phonon-limited electronic transport so far have concentrated on the…

Materials Science · Physics 2017-10-05 Nicki Frank Hinsche , Kristian Sommer Thygesen

Doped transition-metal dichalcogenides monolayers exhibit exciting magnetic properties for the benefit of two-dimensional spintronic devices. Using density functional theory (DFT) incorporating Hubbard-type of correction (DFT$+U$) to…

Materials Science · Physics 2021-05-12 Adlen Smiri , Sihem Jaziri , Samir Lounis , Iann C. Gerber

2D materials with nontrivial energy bands are highly desirable for exploring various topological phases of matter, as low dimensionality opens unprecedented opportunities for manipulating the quantum states. Here, it is reported that…

Mesoscale and Nanoscale Physics · Physics 2020-01-17 Chenqiang Hua , Si Li , Zhu-An Xu , Yi Zheng , Shengyuan A. Yang , Yunhao Lu

If a material with an odd number of electrons per unit cell turns out to be insulating, Mott localisation may be invoked as an explanation. This is widely accepted for the layered compound 1T-TaS2, which has a low-temperature insulating…

Strongly Correlated Electrons · Physics 2020-06-24 C. J. Butler , M. Yoshida , T. Hanaguri , Y. Iwasa

Two-dimensional transition metal dichalcogenides (TMDs) of Mo and W in their 1T' crystalline phase host the quantum spin Hall (QSH) insulator phase. We address the electronic properties of the QSH edge states by means of first-principles…

Materials Science · Physics 2019-07-30 Artem Pulkin , Oleg V. Yazyev

Abstract: Layered transition-metal dichalcogenides (TMDCs) down to the monolayer (ML) limit provide a fertile platform for exploring charge-density waves (CDWs). Though bulk NbTe2 is known to harbor a single axis 3*1 CDW coexisting with…

We review recent experimental progresses on layered topological materials, mainly focusing on transitional metal dichalcogenides with various lattice types including 1T, Td and 1T' structural phases. Their electronic quantum states are…

Mesoscale and Nanoscale Physics · Physics 2019-03-25 Junchao Ma , Ke Deng , Lu Zheng , Sanfeng Wu , Zheng Liu , Shuyun Zhou , Dong Sun

Two-dimensional (2D) materials are known to possess emergent properties that are not found in their bulk counterparts. Recent experiments have shown a $\sqrt7 \times \sqrt3$ charge density wave (CDW) in monolayer 1T-VSe$_2$, in contrast to…

Materials Science · Physics 2021-11-03 Zishen Wang , Jun Zhou , Kian Ping Loh , Yuan Ping Feng

We use density functional theory to explore the possibility of making the semiconducting transition-metal dichalcogenide MoS$_2$ ferromagnetic by introducing holes into the narrow Mo $d$ band that forms the top of the valence band. In the…

Materials Science · Physics 2019-12-25 Yuqiang Gao , Nirmal Ganguli , Paul J. Kelly

The metastable 1$T'$ phase of layered transition metal dichalcogenides has recently attracted considerable interest due to electronic properties, possible topological electronic phases and catalytic activity. We report a comprehensive…

Materials Science · Physics 2018-04-13 Michele Pizzochero , Oleg V. Yazyev

Two-dimensional materials and their heterostructures have opened up new possibilities for magnetism at the nanoscale. In this study, we utilize first-principles simulations to investigate the structural, electronic, and magnetic properties…

Materials Science · Physics 2022-10-11 Diem Thi-Xuan Dang , Ranjan Kumar Barik , Manh-Huong Phan , Lilia M. Woods

The spin density wave instabilities in the quasi-one-dimensional metal (TMTSF)_2ClO_4 are studied in the framework a matrix random phase approximation for intra-band and inter-band order parameters. Depending on the anion ordering potential…

Strongly Correlated Electrons · Physics 2009-11-07 D. Zanchi , A. Bjelis

Either in bulk form, or when exfoliated into atomically thin crystals, layered transition metal dichalcogenides are continuously leading to the discovery of new phenomena. The latest example is provided by 1T'-WTe$_2$, a semimetal recently…

Mesoscale and Nanoscale Physics · Physics 2017-08-23 Lin Wang , Ignacio Gutiérrez-Lezama , Céline Barreteau , Nicolas Ubrig , Enrico Giannini , A. F. Morpurgo

In a certain regime of low carrier densities and strong correlations, electrons can crystallize into a periodic arrangement of charge known as Wigner crystal. Such phases are particularly interesting in one dimension (1D) as they display a…

Strongly Correlated Electrons · Physics 2021-11-01 Anuva Aishwarya , Sean Howard , Bikash Padhi , Lihai Wang , Sang-Wook Cheong , Philip W. Phillips , Vidya Madhavan

Systems that simultaneously exhibit superconductivity and spin-orbit coupling are predicted to provide a route toward topological superconductivity and unconventional electron pairing, driving significant contemporary interest in these…

We use density functional theory (DFT) to explore the physical properties of an $Er_{ W}$ point defect in monolayer $WS_{ 2}$. Our calculations indicate that electrons localize at the dangling bonds associated with a tungsten vacancy…

Charge density wave (CDW) is a periodic modulation of electronic charge leading to a reconstruction of the lattice, an emergence of zone folded mode along with collective excitations.1 Transition metal chalcogenides have shown a great…

Materials Science · Physics 2023-11-07 Divya Rawat , Juhi Pandey , Ajay Soni

The ground state of spin-1 ultracold bosons trapped in a periodic one-dimensional optical superlattice is studied. The two sites of the unit cell have an energy shift between them, whose competition with the spin-dependent strength is the…

Quantum Gases · Physics 2019-12-04 G. J. Cruz , R. Franco , J. Silva-Valencia

Transition-metal dichalcogenides (TMDs) are valuable as solid lubricants because of their layered structure, which allows for easy shearing along the basal planes. Using Density Functional Theory (DFT) we conducted a first-principles study…