The spatial texture of internal degree of freedom of electrons has profound effects on the properties of materials. Such texture in real space can manifest as an emergent magnetic field (or Berry curvature), which is expected to induce interesting valley/spin-related transport phenomena. Moiré pattern, which emerges as a spatial variation at the interface of 2D atomic crystals, provides a natural platform for investigating such real space Berry curvature effects. Here we study moiré structures formed in homobilayer transition metal dichalcogenides (TMDs) due to twisting, various uniform strain profiles, and their combinations, where electrons can reside in either layer with the layer index serving as an internal degree of freedom. The layer pseudo-spin exhibits vortex/antivortex textures in the moiré supercell, leading to a giant geometric magnetic field and a scalar potential. Within a geometric picture, the moiré magnetic field is found as the cross product of the gradients of the out-of-plane pseudo-spin and the in-plane pseudo-spin orientation respectively. We discover dual roles of uniform strain: Besides being a cause of the moire atomic texture in the homobilayer, it also contributes a pseudo-gauge potential that modifies the local phase of interlayer coupling. Consequently, strain can be employed to tune the in-plane pseudo-spin texture, while interlayer bias tunes the out-of-plane pseudo-spin, and we show how the moiré magnetic field's spatial profile, intensity, and flux per supercell can be engineered. Through the geometric scalar correction, the landscape of the scalar potential can also be engineered along with the moiré magnetic field, forming distinct effective lattice structures. These properties render TMD moiré structures promising to build tunable flux lattices for transport and topological material applications.
In long-wavelength moiré patterns of homobilayer semiconductors, the layer pseudospin of electrons is subject to a sizable Zeeman field that is spatially modulated from the interlayer coupling in moiré. By interference of this spatial modulation with a homogeneous but dynamically tunable component from out-of-plane electric field, we show that the spatial-temporal profile of the overall Zeeman field therefore features a topological texture that can be controlled in an ultrafast timescale by a terahertz field or an interlayer bias. Such dynamical modulation leads to the emergence of an in-plane…
In twisted homobilayer transition metal dichalcogenides, intra- and inter-layer valley excitons hybridize with the layer configurations spatially varying in the moiré. The ground state valley excitons are trapped at two high-symmetry points with opposite electric dipoles in a moiré supercell, forming a honeycomb superlattice of nearest-neighbor dipolar attraction. We find that the spatial texture of layer configuration results in a luminescence anomaly of the moiré trapped excitons, where a tiny displacement by interactions dramatically increases the brightness and changes polarization from ci…
Moiré superlattices in twisted van der Waals materials constitute a promising platform for engineering electronic and optical properties. However, a major obstacle to fully understanding these systems and harnessing their potential is the limited ability to correlate the local moiré structure with optical properties. By using a recently developed scanning electron microscopy technique to image twisted WSe$_2$/WSe$_2$ bilayers, we directly correlate increasing moiré periodicity with the emergence of two distinct exciton species. These can be tuned individually through electrostatic gating, and …
We show that moiré bands of twisted homobilayers can be topologically nontrivial, and illustrate the tendency by studying valence band states in $\pm K$ valleys of twisted bilayer transition metal dichalcogenides, in particular, bilayer MoTe$_2$. Because of the large spin-orbit splitting at the monolayer valence band maxima, the low energy valence states of the twisted bilayer MoTe$_2$ at $+K$ ($-K$) valley can be described using a two-band model with a layer-pseudospin magnetic field $\boldsymbolΔ(\boldsymbol{r})$ that has the moiré period. We show that $\boldsymbolΔ(\boldsymbol{r})$ has a to…
We predict that in a twisted homobilayer of transition-metal dichalcogenide MoS$_2$, spin-orbit coupling in the conduction band states from $\pm K$ valleys can give rise to moiré flat bands with nonzero Chern numbers in each valley. The nontrivial band topology originates from a unique combination of angular twist and local mirror symmetry breaking in each individual layer, which results in unusual skyrmionic spin textures in momentum space with skyrmion number $\mathcal{S} = \pm 2$. Our Hartree-Fock analysis further suggests that density-density interactions generically drive the system at $1…
Graphene-metal nanoparticle hybrid materials potentially display not only the unique properties of metal nanoparticles and those of graphene, but also additional novel properties due to the interaction between graphene and nanoparticles. This study shows that gold nanoislands can be used to tailor the local electronic properties of graphene. Graphene on crystalline gold nanoislands exhibits moiré superlattices, which generate secondary Dirac points in the local density of states. Conversely, the graphene covered gold regions undergo a polycrystalline to Au(111) phase transition upon annealing.…
Periodicity of long wavelength moiré patterns is very often destroyed by the inhomogeneous strain introduced in fabrications of van der Waals layered structures. We present a framework to describe massive Dirac fermions in such distorted moiré pattern of transition metal dichalcogenides homobilayers, accounting for the dynamics of layer pseudospin. In decoupled bilayers, we show two causes of in-plane layer pseudospin precession: By the coupling of layer antisymmetric strain to valley magnetic moment; and by the Aharonov-Bohm effect in the SU(2) gauge potential for the case of R-type bilayer u…
Recent experiments have observed correlated insulating and possible superconducting phases in twisted homobilayer transition metal dichalcogenides (TMDs). Besides the spin-valley locked moire bands due to the intrinsic Ising spin-orbit coupling, homobilayer moire TMDs also possess either logarithmic or power-law divergent Van Hove singularities (VHS) near the Fermi surface, controllable by an external displacement field. The former and the latter are dubbed conventional and higher-order VHS, respectively. Here, we perform a perturbative renormalization group (RG) analysis to unbiasedly study t…
The Continuum Model for Uniaxially Strained Bilayer Graphene Moiré Systems
Hong Kong University of Science and Technology（香港科技大学）；Chinese University of Hong Kong (Shenzhen)（香港中文大学（深圳））；Southern University of Science and Technology（南方科技大学）
Moiré superlattices in graphene supported on various substrates have opened a new avenue to engineer graphene's electronic properties. Yet, the exact crystallographic structure on which their band structure depends remains highly debated. In this scanning tunneling microscopy and density functional theory study, we have analysed graphene samples grown on multilayer graphene prepared onto SiC and on the close-packed surfaces of Re and Ir with ultra-high precision. We resolve small-angle twists and shears in graphene, and identify large unit cells comprising more than 1,000 carbon atoms and exhi…
Twistronic assembly of 2D materials employs the twist angle between adjacent layers as a tuning parameter for designing the electronic and optical properties of van der Waals heterostructures. Here, we study how interlayer hybridization, weak ferroelectric charge transfer between layers, and piezoelectric response to deformations set the valence and conduction band edges across the moir{é} supercell in twistronic homobilayers of MoS$_2$, MoSe$_2$, WS$_2$ and WSe$_2$. We show that, due to the lack of inversion symmetry in the monolayer crystals, bilayers with parallel (P) and anti-parallel (AP)…
Recent advances in the field of vertically stacked 2D materials have revealed a rich exciton landscape. In particular, it has been demonstrated that out-of-plane electrical fields can be used to tune the spectral position of spatially separated interlayer excitons. Other studies have shown that there is a strong hybridization of exciton states, resulting from the mixing of electronic states in both layers. However, the connection between the twist-angle dependent hybridization and field-induced energy shifts has remained in the dark. Here, we investigate on a microscopic footing the interplay …
Lattice reconstruction in twisted transition-metal dichalcogenide (TMD) bilayers gives rise to piezo- and ferroelectric moiré potentials for electrons and holes, as well as a modulation of the hybridisation across the bilayer. Here, we develop hybrid $\mathbf{k}\cdot \mathbf{p}$ tight-binding models to describe electrons and holes in the relevant valleys of twisted TMD homobilayers with parallel (P) and anti-parallel (AP) orientations of the monolayer unit cells. We apply these models to describe moiré superlattice effects in twisted WSe${}_2$ bilayers, in conjunction with microscopic \emph{ab…
Moiré systems have emerged in recent years as a rich platform to study strong correlations. Here, we will discuss a simple, experimentally feasible setup based on periodically strained graphene that reproduces several key aspects of twisted moiré heterostructures -- but without introducing a twist. We consider a monolayer graphene sheet subject to a $C_2$-breaking periodic strain-induced psuedomagnetic field (PMF) with period $L_M \gg a$, along with a scalar potential of the same period. This system has {\it almost ideal} flat bands with valley-resolved Chern number $\pm 1$, where the deviatio…
Interaction-driven charge textures and unconventional superconductivity in strained monolayer graphene
Posgrado en Ciencias Físicas, Universidad Nacional Autónoma de México (UNAM)（墨西哥国立自治大学物理科学研究生院）；Department of Physics, University of Arkansas（阿肯色大学物理系）；Donostia International Physics Center（圣塞巴斯蒂安国际物理中心）；IMDEA Nanoscience（马德里IMDEA纳米科学研究所）；Center for Theoretical Physics, Hainan University（海南大学理论物理中心）；Department of Physics, Colorado State University（科罗拉多州立大学物理系）；Depto. de Sistemas Complejos, Instituto de Física, Universidad Nacional Autónoma de México (UNAM)（墨西哥国立自治大学物理学院复杂系统系）
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…
The valence band maxima of most group-VI transition metal dichalcogenide thin films remain at the $Γ$-point all the way from bulk to bilayer. In this paper we develop a continuum theory of the moirè minibands that are formed in the valence bands of $Γ$-valley homobilayers by a small relative twist. Our effective theory is benchmarked against large-scale ab initio electronic structure calculations that account for lattice relaxation. As a consequence of an emergent $D_6$ symmetry we find that low-energy $Γ$-valley moirè holes differ qualitatively from their K-valley counterparts addressed previ…
We propose a realization of Kondo-lattice physics in moiré superlattices at the interface between a WX$_2$ homobilayer and MoX$_2$ monolayer (where X=S,Se). Under appropriate gating conditions, the interface-WX$_2$-layer forms a triangular lattice of local moments that couple to itinerant electrons in the other WX$_2$-layer via a gate-tunable Kondo exchange interaction. Using a parton mean-field approach we identify a range of twist-angles which support a gate-tuned quantum phase transition between a heavy-fermion liquid with large anomalous Hall conductance and a fractionalized chiral spin-li…
While it is known that the double-layer Bi$_2$Sr$_2$CaCu$_2$O$_{8+y}$ (BSCCO) cuprate superconductor exhibits a one-dimensional (1D) incommensurate superlattice (IS), the effect of IS on the electronic structure remains elusive. Following the recent shift of the interest from underdoped to optimum and overdoped phase in BSCCO by increasing the hole doping $x$, controlled by the oxygen interstitials concentration $y$, here we focus on the multiple splitting of the density of states (DOS) peaks and emergence of higher order van Hove singularities (VHS) due to the 1D incommensurate superlattice. …
Experimental signature of layer skyrmions and implications for band topology in twisted WSe2 bilayers
University of Texas at Austin（德克萨斯大学奥斯汀分校）；The University of Hong Kong（香港大学）；National Yang Ming Chiao Tung University（阳明交通大学）；Pennsylvania State University（宾夕法尼亚州立大学）；National Institute for Materials Science（日本物质材料研究机构）
Geometrical moiré patterns, generic for almost aligned bilayers of two-dimensional (2D) crystals with similar lattice structure but slightly different lattice constants, lead to zone folding and miniband formation for electronic states. Here, we show that moiré superlattice (mSL) effects in $\mathrm{MoSe}_2/\mathrm{WS}_2$ and $\mathrm{MoTe}_2/\mathrm{MoSe}_2$ heterobilayers that feature alignment of the band edges are enhanced by resonant interlayer hybridization, and anticipate similar features in twisted homobilayers of TMDs, including examples of narrow minibands close to the actual band ed…
Moiré superlattices serve as a playground for emerging phenomena, such as localization of band states, superconductivity, and localization of excitons. These superlattices are large and are often modeled in the zero angle limit, which obscures the effect of finite twist angles. Here, by means of first-principles calculations we quantify the twist-angle dependence of the moiré potential in the MoS$_2$ homobilayer and identify the contributions from the constituent elements of the moiré potential. Furthermore, by considering the zero-angle limit configurations, we show that the moiré potential i…
We present a comprehensive dynamical mean field study of the triangular lattice moiré Hubbard model, which is believed to represent the physics of moiré bilayer transition metal dichalcogenides. In these materials, important aspects of the band structure including the bandwidth and the order and location of van Hove singularities can be tuned by varying the interlayer potential. We present a magnetic and metal-insulator phase diagram and a detailed study of the dependence of the resistivity on temperature, band filling and interlayer potential. We find that transport displays Fermi liquid, str…
Twisted Van der Waals systems offer the unprecedented possibility to tune different states of correlated quantum matter with an external non-invasive electrostatic doping. The nature of the superconducting order presents a recurring open question in this context. In this work, we quantitatively assess the case of spin-fluctuation-mediated pairing for $Γ$-valley twisted transition metal dichalcogenide homobilayers. We self-consistently and dynamically calculate the doping dependent superconducting transition temperature $T_{\mathrm{c}}$ revealing a superconducting dome with a maximal $T_{\mathr…
Recently, it has been pointed out that the twisting of bilayer WSe$_2$ would generate topologically non-trivial flat bands near the Fermi energy. In this work, we show that twisted bilayer WSe$_2$ (tWSe$_2$) with uniaxial strain exhibits a large nonlinear Hall (NLH) response due to the non-trivial Berry curvatures of the flat bands. Moreover, the NLH effect is greatly enhanced near the topological phase transition point which can be tuned by a vertical displacement field. Importantly, the nonlinear Hall signal changes sign across the topological phase transition point and provides a way to ide…
