arXiv subjects

Guang Bian

Publications and source records attributed to Guang Bian.

At least 19 recordsLinked to original sources

arXiv2026

Symmetry-Enforced Dirac Fermions and Structural Metastability in Pentagonal Monolayers of Transition-Metal Ditellurides

The recent synthesis of pentagonal PdTe$_2$ monolayer motivates broader research interests in transition-metal ditellurides whose electronic phases are governed by symmetry and structural reconstruction. The pentagonal phase of transition-metal ditellurides exhibits electronic properties that are dramatically different from those of its hexagonal counterpart due to its lower crystalline symmetry. Using first-principles calculations, we study monolayer $X$Te$_2$ ($X=\mathrm{Pd},\mathrm{Pt},\mathrm{Ni}$) in both hexagonal and pentagonal polymorphs. By constructing a continuous structural interpolation between the hexagonal and pentagonal phases, we show that the semimetal (hex)-to-semiconductor (penta) transition occurs only after an intermediate structural threshold rather than at the onset of symmetry reduction. The gap opening coincides with the formation of Te--Te dimers, which drive the bonding--antibonding splitting of the Te $p$ states and reorganize the band edges. In addition, the nonsymmorphic symmetry of the pentagonal phase enforces band degeneracies at the Brillouin-zone boundary, leading to symmetry-protected two-dimensional (2D) Dirac states. These results establish pentagonal $X$Te$_2$ monolayers as a new class of 2D semiconductors in which symmetry constraints and local bonding collectively shape the unconventional semiconducting electronic structure.

cond-mat.mtrl-sci↗

arXiv2025

Altermagnetism, Kagome Flat Band, and Weyl Fermion States in Magnetically Intercalated Transition Metal Dichalcogenides

Altermagnetic (AM) compounds have recently emerged as a promising platform for realizing unconventional quantum phases, enabled by their unique spin-split band structure at zero net magnetization. Here, we present a first-principles investigation of magnetically intercalated transition metal dichalcogenides (TMDs) of the form XY$_4$Z$_8$ (X $=$ Mn, Fe, Co, Ni, Cr, or V; Y $=$ Nb or Ta; and Z $=$ Se or S), identifying a subset of new versatile AM candidates. Our results establish a systematic correlation between interatomic geometry, quantified by the ratio of interlayer to intralayer spacing, and the magnetic ground states. Systems with A-type antiferromagnetic order exhibit momentum-dependent spin splitting consistent with AM behavior. The combination of the AM spin-splitting and the spin-orbit coupling leads to the emergence of Weyl nodes together with the corresponding topological Fermi arc surface states. Moreover, we identify flat bands near the Fermi level that originate from the intercalant-induced formation of an effective kagome-like sublattice in the TMD layer. These results collectively establish magnetically intercalated TMDs as a promising platform for engineering altermagnetism, flat bands, and Weyl fermions within a single material family, facilitating the development of topological and spintronic applications.

cond-mat.mtrl-sci↗

arXiv2025

Observation of Anomalous Hall Effect in Bulk Single Crystals of n-type Cr-doped Sb$_{2}$Te$_{3}$ Magnetic Topological Insulator

The exploration of topological Dirac surface states is significant in the realms of condensed matter physics and future technological innovations. Among the materials garnering attention is Sb$_{2}$Te$_{3}$, a compound that theoretically exhibits topological insulating properties. However, its inherent p-type nature prevents the direct experimental verification of its Dirac surface state due to the Fermi level alignment with the valence band. In this study, by doping Cr atoms into Sb$_{2}$Te$_{3}$, n-type behavior is observed in the Hall resistance measurements. Remarkably, the Cr-doped Sb$_{2}$Te$_{3}$ not only shows ferromagnetism with a high transition temperature of approximately 170 K but also exhibits an anomalous Hall effect (AHE). The Cr doping also allows for a controlled method for Fermi level tuning into the band gap. These properties spotlight its potential as an n-type magnetic topological insulator (MTI) as well as a material candidate for the quantum anomalous Hall effect (QAHE), opening new avenues for applications in spintronics and quantum devices.

cond-mat.mtrl-sci↗

arXiv2025

Programmable phase selection between altermagnetic and non-centrosymmetric polymorphs of MnTe on InP via molecular beam epitaxy

Phase selecting nearly degenerate crystalline polymorphs during epitaxial growth can be challenging yet is critical to targeting physical properties for specific applications. Here, we establish how phase selectivity of altermagnetic and non-centrosymmetric polymorphs of MnTe with high structural quality and phase purity can be programmed by subtle changes to the surface of lattice-matched InP substrates in molecular beam epitaxial (MBE) growth. Bulk altermagnetic MnTe is thermodynamically stable in the hexagonal NiAs-structure and is synthesized here on the (111)A surface (In-terminated) of InP, while the non-centrosymmetric, cubic ZnS-structure with wide band gap (> 3eV) is stabilized on the (111)B surface (P-terminated). Here we use electron microscopy, photoemission spectroscopy, and reflection high-energy electron diffraction, which together indicate that the phase selection is triggered at the interface and proceeds along the growing surface. First principles calculations suggest that interfacial termination and strain have a significant effect on the interfacial energy; stabilizing the NiAs polymorph on the In-terminated surface and the ZnS structure on the P-terminated surface. Selectively grown, high-quality films of MnTe polymorphs are key platforms that will enable our understanding of the novel properties of these materials, thereby facilitating their use in new applications ranging from spintronics to microelectronic devices.

cond-mat.mtrl-sci↗

arXiv2024

Moving Protocol of Majorana Corner Modes in a Superconducting 2D Weyl Semimetal Heterostructure

Second-order topological superconductors host Majorana corner modes (MCMs), which are confined to specific corners of the system. This spatial restriction presents challenges for manipulating and relocating MCMs. We propose a novel protocol for dynamically controlling the movement of time-reversal symmetric MCMs in a heterostructure consisting of a 2D Weyl semimetal and a $d$-wave superconductor. By leveraging the energy asymmetry of topological edge states in the 2D Weyl semimetal, the position of MCMs can be effectively tuned via chemical potential adjustments. We further introduce a device architecture that integrates multiple heterostructure blocks, each controlled by independent gate voltages, to enable the adiabatic movement and exchange of MCMs. This approach demonstrates a robust mechanism for Majorana manipulation and provides a scalable framework for future experimental studies of topological quantum computation.

cond-mat.mes-hall↗

arXiv2024

Emergent Spin Fluctuation and Structural Metastability in Self-Intercalated Cr$_{1+x}$Te$_2$ Compounds

Intercalated van der Waals (vdW) magnetic materials host unique magnetic properties due to the interplay of competing interlayer and intralayer exchange couplings, which depend on the intercalant concentration within the van der Waals gaps. Magnetic vdW compound chromium telluride, Cr$_{1+x}$Te$_2$, has demonstrated rich magnetic phases at various Cr concentrations, such as the coexistence of ferromagnetic and antiferromagnetic phases in Cr$_{1.25}$Te$_2$ (equivalently, Cr$_{5}$Te$_8$). The compound is induced by intercalating 0.25 Cr atom per unit cell within the van der Waals gaps of CrTe$_2$. In this work, we report a notably increased Curie Temperature and an emergent in-plane spin fluctuation by slightly reducing the concentration of Cr intercalants in Cr$_{1.25}$Te$_2$. Moreover, the intercalated Cr atoms form a metastable 2$\times$2 supercell structure that can be manipulated by electron beam irradiation. This work offers a promising approach to tuning magnetic and structural properties by adjusting the concentration of intercalated magnetic atoms.

cond-mat.mtrl-sci↗

arXiv2023

Tunable High Spin Chern-Number Insulator Phases in Strained Sb Monolayer

High spin Chern-number insulators (HSCI) have emerged as a novel 2D topological phase of condensed matter that is beyond the classification of topological quantum chemistry. In this work, we report the observation of a semimetallic Sb monolayer carrying the same band topology as HSCI with a spin Chern number equal to 2. Our calculations further indicate a moderate lattice strain can make Sb monolayer an insulator or a semimetal with a tunable spin Chern number from 0 to 3. The results suggest strained Sb monolayers as a promising platform for exploring exotic properties of the HSCI topological matter.

cond-mat.mtrl-sci↗

arXiv2023

Ferroelectric Semimetals with $α$-Bi/SnSe van der Waals heterostructures and its Topological Currents

We show that proximity effects can be utilized to engineer van der Waals heterostructures (vd- WHs) displaying spin-ferroelectricity locking, where ferroelectricity and spin states are confined to different layers, but are correlated by means of proximity effects. Our findings are supported by first principles calculations in $α$-Bi/SnSe bilayers. We show that such systems support ferroelectrically switchable non-linear anomalous Hall effect originating from large Berry curvature dipoles as well as direct and inverse spin Hall effects with giant bulk spin-charge interconversion efficiencies. The giant efficiencies are consequences of the proximity-induced semimetallic nature of low energy electron states, which are shown to behave as two-dimensional pseudo-Weyl fermions by means of symmetry analysis, first principles calculations as well as direct angle-resolved photoemission spectroscopy measurements.

cond-mat.mtrl-sci↗

arXiv2023

Frequency-dependent Faraday and Kerr rotation in anisotropic nonsymmorphic Dirac semimetals

We calculate the frequency-dependent longitudinal and Hall conductivities and the Faraday and Kerr rotation angles for a single sheet of anisotropic Dirac semimetal protected by nonsymmorphic symmetry in the presence of a Zeeman term coupling to the out-of-plane component of the spin. While the Zeeman term causes a rotation of the plane of polarization of the light, the anisotropy causes the appearance of an elliptically polarized component in an initially linearly polarized beam. The two effects can be combined in a single complex Faraday rotation angle. At the zero-frequency limit, we find a finite value of the Faraday rotation angle, which is given by $2α_F$, where $α_F$ is the effective fine structure constant associated with the velocity of the linearly dispersing Dirac fermions. We also find a logarithmic enhancement of the Faraday (and Kerr) rotation angles as the frequency of the light approaches the absorption edge associated with the Zeeman-induced gap. While the enhancement is reduced by impurity scattering, it remains significant for an attainable level of material purity. These results indicate that two-dimensional Dirac materials protected by nonsymmorphic symmetry are responsive to Zeeman couplings and can be used as platforms for magneto-optic applications, such as the realization of polarization-rotating devices.

cond-mat.mes-hall↗

arXiv2023

Multi-layered atomic relaxation in van der Waals heterostructures

When two-dimensional van der Waals materials are stacked to build heterostructures, moiré patterns emerge from twisted interfaces or from mismatch in lattice constant of individual layers. Relaxation of the atomic positions is a direct, generic consequence of the moiré pattern, with many implications for the physical properties. Moiré driven atomic relaxation may be naively thought to be restricted to the interfacial layers and thus irrelevant for multi-layered heterostructures. However, we provide experimental evidence for the importance of the three dimensional nature of the relaxation in two types of van der Waals heterostructures: First, in multi-layer graphene twisted on graphite at small twist angles ($θ\approx0.14^\circ$) we observe propagation of relaxation domains even beyond 18 graphene layers. Second, we show how for multi-layer PdTe$_2$ on Bi$_2$Se$_3$ the moiré lattice constant depends on the number of PdTe$_2$ layers. Motivated by the experimental findings, we developed a continuum approach to model multi-layered relaxation processes based on the generalized stacking fault energy functional given by ab-initio simulations. Leveraging the continuum property of the approach enables us to access large scale regimes and achieve agreement with our experimental data for both systems. Furthermore it is well known that the electronic structure of graphene sensitively depends on local lattice deformations. Therefore we study the impact of multi-layered relaxation on the local density of states of the twisted graphitic system. We identify measurable implications for the system, experimentally accessible by scanning tunneling microscopy. Our multi-layered relaxation approach is not restricted to the discussed systems, and can be used to uncover the impact of an interfacial defect on various layered systems of interest.

cond-mat.mes-hall↗

arXiv2023

Observation of 2D Weyl Fermion States in Epitaxial Bismuthene

A two-dimensional (2D) Weyl semimetal featuring a spin-polarized linear band dispersion and a nodal Fermi surface is a new topological phase of matter. It is a solid-state realization of Weyl fermions in an intrinsic 2D system. The nontrivial topology of 2D Weyl cones guarantees the existence of a new form of topologically protected boundary states, Fermi string edge states. In this work, we report the realization of a 2D Weyl semimetal in monolayer-thick epitaxial bismuthene grown on SnS(Se) substrate. The intrinsic band gap of bismuthene is eliminated by the space-inversion-symmetry-breaking substrate perturbations, resulting in a gapless spin-polarized Weyl band dispersion. The linear dispersion and spin polarization of the Weyl fermion states are observed in our spin and angle-resolved photoemission measurements. In addition, the scanning tunneling microscopy/spectroscopy reveals a pronounced local density of states at the edge, suggesting the existence of Fermi string edge states. These results open the door for the experimental exploration of the exotic properties of Weyl fermion states in reduced dimensions.

cond-mat.mtrl-sci↗

arXiv2023

Edge States of α-Bismuthene Nanostructures

We present a systematic investigation of the edge states of two-dimensional α-bismuthene (α-Bi) structures self-assembled on HOPG substrates, using scanning tunnelling microscopy and scanning tunnelling spectroscopy. The measurements are carried out for 3ML, 5ML and 7ML thick Bi structures. Our spectroscopy studies reveal clear features at the edges of the 5ML and 7ML thick structures, and the positions of the edge states (ESs) coincide with the topographical step edges. In contrast, in 3ML structures the ESs appear to be absent and instead new states are sometimes observed, far from the topographical edge. These states are associated with a moiré pattern and result from strain-induced modulation of the topology. Our observations demonstrate the impact on the edge states of coupling to adjacent structures.

cond-mat.mes-hall↗

arXiv2022

Observation of Gapped Topological Surface States and Isolated Surface Resonances in PdTe$_2$ Ultrathin Films

The superconductor PdTe$_2$ is known to host bulk Dirac bands and topological surface states. The coexistence of superconductivity and topological surface states makes PdTe$_2$ a promising platform for exploring topological superconductivity and Majorana bound states. In this work, we report the layer-by-layer molecular beam epitaxy growth and spectroscopic characterization of high quality PdTe$_2$ films with thickness down to 3 monolayers (ML). In the 3 ML PdTe$_2$ film, we observed spin-polarized surface resonance states, which are isolated from the bulk bands due to the quantum size effects. In addition, the hybridization of surface states on opposite faces leads to a thickness-dependent gap in the topological surface Dirac bands. Our photoemission results show clearly that the size of the hybridization gap increases as the film thickness is reduced. The success in growing high quality PdTe$_2$ films by state-of-art molecular beam epitaxy technique and the observation of surface resonances and gaped topological surface states sheds light on the applications of PdTe$_2$ quantum films in spintronics and topological computation.

cond-mat.mes-hall↗

arXiv2022

Moiré Modulated Lattice Strain and Thickness-Dependent Lattice Expansion in Epitaxial Ultrathin Films of PdTe$_2$

We report the epitaxial growth of PdTe$_2$ ultrathin films on topological insulator Bi$_2$Se$_3$. A prominent Moiré pattern was observed in STM measurements. The Moiré periodicity increases as film thickness decreases, indicating a lattice expansion of epitaxial PdTe$_2$ thin films with lower thicknesses. In addition, our simulations based on Moiré Metrology reveal uniaxial lattice strains at the edge of PdTe$_2$ domains, and anisotropic strain distributions throughout the Moiré supercell with a net change in lattice strain up to ~2.9%. Our DFT calculations show that this strain effect leads to a narrowing of the band gap at $Γ$ point near the Fermi level. Under a strain of ~2.8%, the band gap at $Γ$ closes completely. Further increasing the lattice strain makes the band gap reopen and the order of conduction band and valence bands inverted in energy. The results offer a proof of concept for constructing quantum grids of topological materials under the modulation of Moiré potentials.

cond-mat.mes-hall↗

arXiv2022

Photon Absorption of Two-dimensional Nonsymmorphic Dirac Semimetals

Two-dimensional Dirac semimetals have attracted much attention because of their linear energy dispersion and non-trivial Berry phase. Graphene-like 2D Dirac materials are gapless only within certain approximations, e.g., if spin-orbit coupling (SOC) is neglected. It has recently been reported that materials with nonsymmorphic crystal lattice possess symmetry-enforced Dirac-like band dispersion around certain high-symmetry momenta even in the presence of SOC. Here we calculate the optical absorption coefficient of nonsymmorphic semimetals, such as $α$-bismuthene, which hosts two anisotropic Dirac cones with different Fermi velocities along $x$ and $y$ directions.We find that the optical absorption coefficient depends strongly on the anisotropy factor and the photon polarization. When a magnetic field is applied perpendicular to the plane of the material, the absorption coefficient also depends on an internal parameter we termed the mixing angle of the band structure. We further find that an in-plane magnetic field, while leaving the system gapless, can induce a Van-Hove singularity in the joint density of states: this causes a significant enhancement of the optical absorption at the frequency of the singularity for one direction of polarization but not for the orthogonal one, making the optical properties even more strongly dependent on polarization. Due to the anisotropy present in our model, the Dirac cones at two high-symmetry momenta in the Brillouin zone contribute very differently to the optical absorbance. Consequently, it might be possible to preferentially populate one valley or the other by varying photon polarization and frequency. These results suggest that nonsymmorphic 2D Dirac semimetals are excellent candidate materials for tunable magneto-optic devices.

cond-mat.mes-hall↗

arXiv2021

Observation of Unpinned Two-Dimensional Dirac States in Antimony Single Layers with Phosphorene Structure

The discovery of graphene has stimulated enormous interest in two-dimensional (2D) electron gas with linear band structure. 2D Dirac materials possess many intriguing physical properties such as high carrier mobility and zero-energy Landau level thanks to the relativistic dispersion and chiral spin/pseudospin texture. 2D Dirac states discovered so far are exclusively pinned at high-symmetry points of the Brillouin zone, for example, surface Dirac states at $\overlineΓ$ in topological insulators Bi$_2$Se(Te)$_3$ and Dirac cones at $K$ and $K'$ in graphene. In this work, we report the realization of 2D Dirac states at generic $k$-points in antimony atomic layers with phosphorene structure ($i.e.$ $α$-antimonene). The unpinned nature enables versatile ways to control the locations of the Dirac points in momentum space. In addition, dispersions around the unpinned Dirac points exhibit intrinsically anisotropic behaviors due to the reduced symmetry of generic momentum points. These properties make the $α$-antimonene films a promising platform for exploring interesting physics in unpinned 2D Dirac fermions that are distinct from the conventional Dirac states in graphene.

cond-mat.mes-hall↗

arXiv2021

Observation of Symmetry-Protected Dirac States in Nonsymmorphic $α$-Antimonene

Two-dimensional (2D) Dirac states with linear band dispersion have attracted enormous interest since the discovery of graphene. However, to date, 2D Dirac semimetals are still very rare due to the fact that 2D Dirac states are generally fragile against perturbations such as spin-orbit couplings. Nonsymmorphic crystal symmetries can enforce the formation of Dirac nodes, providing a new route to establishing symmetry-protected Dirac states in 2D materials. Here we report the symmetry-protected Dirac states in nonsymmorphic alpha-antimonene. The antimonene was synthesized by the method of molecular beam epitaxy. Two Dirac cones with large anisotropy were observed by angle-resolved photoemission spectroscopy. The Dirac state in alpha-antimonene is of spin-orbit type in contrast to the spinless Dirac states in graphene. The result extends the 'graphene' physics into a new family of 2D materials where spin-orbit coupling is present.

cond-mat.mes-hall↗

arXiv2021

Giant Topological Hall Effect in van der Waals Heterostructures of CrTe2/Bi2Te3

Discoveries of interfacial topological Hall effect (THE) provide an ideal platform for exploring physics arising from the interplay between topology and magnetism. The interfacial topological Hall effect is closely related to the Dzyaloshinskii-Moriya interaction (DMI) at interface and topological spin textures. However, it is difficult to achieve a sizable THE in heterostructures due to the stringent constraints on the constituents of THE heterostructures such as strong spin-orbit coupling (SOC). Here we report the observation of a giant THE signal of 1.39 $μΩ\cdot$cm in the van der Waals heterostructures of CrTe2/Bi2Te3 fabricated by molecular beam epitaxy, a prototype of two-dimensional (2D) ferromagnet (FM)/topological insulator (TI). This large magnitude of THE is attributed to an optimized combination of 2D ferromagnetism in CrTe2, strong SOC in Bi2Te3, and an atomically sharp interface. Our work reveals CrTe2/Bi2Te3 as a convenient platform for achieving large interfacial THE in hybrid systems, which could be utilized to develop quantum science and high-density information storage.

cond-mat.mes-hall↗