We examine the charge and spin properties of an effective single-band model representing a moiré superlattice of the WSe$_{2}$/WS$_{2}$ heterobilayer. We focus on the $2/3$ electron filling, which refers to the formation of a generalized Wigner crystal, as evidenced experimentally. Our approach is based on the extended-Hubbard model on a triangular lattice with non-interacting part effectively describing a spin-split band due to Ising-type spin-orbit coupling. We investigate the system in the regime of strong on-site Coulomb repulsion and the ground state of the Hamiltonian is obtained with the use of the Density Matrix Renormalization Group formulated within the Matrix Product State approach. According to our analysis, based on the density-density correlation functions resolved in the momentum space, a transition from the metallic to the insulating state appears with increasing intersite electron-electron interactions. This transition is identified as being concomitant with the emergence of a generalized Wigner crystal that realizes the honeycomb lattice pattern. We investigate the magnetic properties of such a Wigner crystal state and find that the presence of spin-valley polarization and the increased intersite repulsion induce spin canting of the out-of-plane antiferromagnetic ordering.
Moiré superlattices formed in two-dimensional semiconductor heterobilayers provide a new realization of Hubbard model physics in which the number of electrons per effective atom can be tuned at will. We report on an exact diagonalization study of the electronic properties of half-filled narrow moiré bands in which correlation strengths are varied by changing twist angles or interaction strengths. We construct a phase diagram for the bilayer, identifying where the metal-insulator phase transition occurs, estimating the sizes of the charge gaps in the insulating phase, and commenting on the natu…
Moiré superlattice systems such as transition metal dichalcogenide heterobilayers have garnered significant recent interest due to their promising utility as tunable solid state simulators. Recent experiments on a WSe$_2$/WS$_2$ heterobilayer detected incompressible charge ordered states that one can view as generalized Wigner crystals. The tunability of the hetero-TMD Moiré system presents an opportunity to study the rich set of possible phases upon melting these charge-ordered states. Here we use Monte Carlo simulations to study these intermediate phases in between incompressible charge-orde…
We study untwisted heterobilayers of ferromagnetic and antiferromagnetic van der Waals materials, with in particular a Dzyaloshinskii-Moriya interaction in the ferromagnetic layer. A continuum low energy field theory is utilized to study such systems. We develop a phase diagram as a function of the strength of inter-layer exchange and Dzyaloshinskii-Moriya interactions, combining perturbative and strong coupling analyses with numerical simulations using Landau-Lifshitz-Gilbert equations. Various moiré-periodic commensurate phases are found, and the commensurate-incommensurate transition is dis…
Charge separated interlayer excitons in transition metal dichalcogenide (TMDC) heterobilayers are being explored for moiré exciton lattices and exciton condensates. The presence of permanent dipole moments and the poorly screened Coulomb interaction make many body interactions particularly strong for interlayer excitons. Here we reveal two distinct phase transitions for interlayer excitons in the MoSe2/WSe2 heterobilayer using time and spatially resolved photoluminescence imaging: from trapped excitons in the moiré-potential to the modestly mobile exciton gas as exciton density increases to ne…
Moiré heterobilayer transition metal dichalcogenides (TMDs) emerge as an ideal system for simulating the single-band Hubbard model and interesting correlated phases have been observed in these systems. Nevertheless, the moiré bands in heterobilayer TMDs were believed to be topologically trivial. Recently, it was reported that both a quantum valley Hall insulating state at filling $ν=2$ (two holes per moiré unit cell) and a valley-polarized quantum anomalous Hall state at filling $ν=1$ were observed in AB stacked moiré MoTe$_2$/WSe$_2$ heterobilayers. However, how the topologically nontrivial s…
We propose a new mechanism to explain the quantum anomalous Hall (QAH) effect and the electric-field-induced topological phase transition in AB-stacked MoTe${}_2$/WSe${}_2$ moiré heterobilayers at $ν=1$ hole filling. We suggest that the Chern band of the QAH state is generated from an intrinsic band inversion composed of the highest two moiré hole bands with opposite valley numbers and a gap opening induced by two Coulomb-interaction-driven magnetic orders. These magnetic orders, including an in-plane $120^{\circ}$-Néel order and an in-plane ferromagnetic order, interact with moiré bands via c…
We propose a new mechanism for quantum anomalous Hall (QAH) effect in the AB stacked MoTe$_2$/WSe$_2$ system. Based on the observation that the inter-layer tunneling is suppressed in the AB stacking, we consider a model with two layers coupled through the Coulomb interaction. The moiré lattices of the two layers are shifted to form a honeycomb lattice together. Initially, the system is in a layer-polarized Mott insulator at $ν_T=1$. But with a displacement field, an equal number of holes and electrons are doped into the two layers respectively and they form inter-layer exciton condensation. Th…
Moiré superlattices of van der Waals materials, such as twisted graphene and transitional metal dichalcogenides, have recently emerged as a fascinating platform to study strongly correlated states in two dimensions, thanks to the strong electron interaction in the moiré minibands. In most systems, the correlated states appear when the moiré lattice is filled by integer number of electrons per moiré unit cell. Recently, correlated states at fractional fillings of 1/3 and 2/3 holes per moiré unit cell has been reported in the WS2/WSe2 heterobilayer, hinting the long range nature of the electron …
Moiré materials formed in two-dimensional semiconductor heterobilayers are quantum simulators of Hubbard-like physics with unprecedented electron-density and interaction-strength tunability. Compared to atomic scale Hubbard-like systems, electrons or holes in moiré materials are less strongly attracted to their effective lattice sites because these are defined by finite-depth potential extrema. As a consequence, non-local interaction terms like interaction-assisted hopping and intersite-exchange are more relevant. We theoretically demonstrate the possibility of tuning the strength of these cou…
We demonstrate a generic mechanism to realize topological flat minibands by confining massive Dirac fermions in a periodic moiré potential, which can be achieved in a heterobilayer of transition metal dichalcogenides. We show that the topological phase can be protected by the symmetry of moiré potential and survive to arbitrarily large Dirac band gap. We take the MoTe$_2$/WSe$_2$ heterobilayer as an example and find that the topological phase can be driven by a vertical electric field. By projecting the Coulomb interaction onto the topological fat minibands, we identify a correlated Chern insu…
Quantum particles on a lattice with competing long-range interactions are ubiquitous in physics. Transition metal oxides, layered molecular crystals and trapped ion arrays are a few examples out of many. In the strongly interacting regime, these systems often exhibit a rich variety of quantum many-body ground states that challenge theory. The emergence of transition metal dichalcogenide moiré heterostructures provides a highly controllable platform to study long-range electronic correlations. Here we report an observation of nearly two-dozen correlated insulating states at fractional fillings …
Semiconductor moiré heterostructures exhibit rich correlation-induced many-body phenomena with signatures of emergent magnetism, Mott insulating states or generalized Wigner crystals observed in optical spectroscopy by probing intralayer excitons. However, as the staggered band alignment in the underlying WSe$_2$/WS$_2$ heterobilayer system separates photoexcited electrons and holes to form lowest-energy interlayer excitons, direct access to interactions between correlated charge states and ground state moiré excitons remained elusive. Here, we use MoSe$_2$/WS$_2$ heterostacks with type-I band…
Gossamer Superconductivity in Moiré WSe$_2$ Bilayer
ShanghaiTech University（上海科技大学）；Peking University（北京大学）；Beijing National Laboratory for Condensed Matter Physics and Institute of Physics, Chinese Academy of Sciences（中国科学院物理研究所）；Kavli Institute for Theoretical Sciences, University of Chinese Academy of Sciences（中国科学院大学理论科学研究中心）
The optical properties of weakly-doped two-dimensional materials are dominated by strong exciton and trion absorption and luminescence features. In this article we examine the influence of moiré patterns in semiconductor heterobilayers on exciton and trion states in the limit of strong moiré modulation potentials, commenting on similarities and differences compared to the case of excitons and trions in semiconductor quantum dots. We discuss strategies for using optical properties as quantitative probes of moiré materials, and the prospects for exploiting moiré materials to design unique light …
Heterobilayer transition metal dichalcogenide (TMDC) moiré systems provide an ideal framework to investigate strongly correlated physics. Here we theoretically study bosonic many-body phases of excitons in moiré TMDCs. By using two moiré models and cluster mean-field theory, we reveal that, due to non-local Coulomb interactions, moiré excitons can feature exotic supersolid phases, i.e. superfluids of broken translational invariance, and correlated insulating states. The correlated phases exist at experimentally accessible temperatures and are tunable via the twist angle and exciton density.
Transition metal dichalcogenide (TMD) moiré heterostructures provide an ideal platform to explore the extended Hubbard model1 where long-range Coulomb interactions play a critical role in determining strongly correlated electron states. This has led to experimental observations of Mott insulator states at half filling2-4 as well as a variety of extended Wigner crystal states at different fractional fillings5-9. Microscopic understanding of these emerging quantum phases, however, is still lacking. Here we describe a novel scanning tunneling microscopy (STM) technique for local sensing and manip…
The Wigner crystal state, first predicted by Eugene Wigner in 1934, has fascinated condensed matter physicists for nearly 90 years2-14. Studies of two-dimensional (2D) electron gases first revealed signatures of the Wigner crystal in electrical transport measurements at high magnetic fields2-4. More recently optical spectroscopy has provided evidence of generalized Wigner crystal states in transition metal dichalcogenide (TMDC) moiré superlattices. Direct observation of the 2D Wigner crystal lattice in real space, however, has remained an outstanding challenge. Scanning tunneling microscopy (S…
Moiré materials provide fertile ground for the correlated and topological quantum phenomena. Among them, the quantum anomalous Hall (QAH) effect, in which the Hall resistance is quantized even under zero magnetic field, is a direct manifestation of the intrinsic topological properties of a material and an appealing attribute for low-power electronics applications. The QAH effect has been observed in both graphene and transition metal dichalcogenide (TMD) moiré materials. It is thought to arise from the interaction-driven valley polarization of the narrow moiré bands. Here, we show surprisingly…
Tunable Interlayer Charge-transfer States in MoSe$_2$/WS$_2$ Moiré Superlattices
University of California at Berkeley（加州大学伯克利分校）；Lawrence Berkeley National Laboratory（劳伦斯伯克利国家实验室）；The University of Texas at Austin（德克萨斯大学奥斯汀分校）；National Institute for Materials Science（物质材料研究机构）
Transition metal dichalcogenide (TMD) bilayers have recently emerged as a robust and tunable moiré system for studying and designing correlated electron physics. In this work, by combining large-scale first principle calculation and continuum model approach, we provide an electronic structure theory that maps long-period heterobilayer TMD superlattices onto diatomic crystals with cations and anions. We find that the interplay between moiré potential and Coulomb interaction leads to filling-dependent charge transfer between MM and MX regions several nanometers apart. We show that the insulating…
Two-dimensional moire superlattices have recently emerged as a fertile ground for creating novel electronic phases of matter with unprecedented control. Despite intensive efforts, theoretical investigation of correlated moire systems has been challenged by the large number of atoms in a superlattice unit cell and the inherent difficulty of treating electron correlation. The physics of correlated moire systems is governed by low-energy electrons in a coarse-grained long-wavelength potential, unlike the singular Coulomb potential of atomically-spaced ions in natural solids. Motivated by the sepa…
We present a theoretical study of single-particle and many-body properties of twisted bilayer WSe$_2$. For single-particle physics, we calculate the band topological phase diagram and electron local density of states (LDOS), which are found to be correlated. By comparing our theoretical LDOS with those measured by scanning tunneling microscopy, we comment on the possible topological nature of the first moiré valence band. For many-body physics, we construct a generalized Hubbard model on a triangular lattice based on the calculated single-particle moiré bands. We show that a layer potential di…
Recent experiments on the twisted transition metal dichalcogenide (TMD) material, $\rm WSe_2/WS_2$, have observed insulating states at fractional occupancy of the moiré bands. Such states were conceived as generalized Wigner crystals (GWCs). In this article, we investigate the problem of Wigner crystallization in the presence of an underlying (moiré) lattice. Based on the best estimates of the system parameters, we find a variety of homobilayer and heterobilayer TMDs to be excellent candidates for realizing GWCs. In particular, our analysis based on $r_{s}$ indicates that $\rm MoSe_{2}$ (among…
