arXiv subjects

Xuan Zheng

Publications and source records attributed to Xuan Zheng.

At least 19 recordsLinked to original sources

arXiv2026

SIGMA: SHAP-Guided Implicit-Trajectory Generation for Metadata-Free LLM-Based AutoFE

Recent research has leveraged Large Language Models (LLMs) to enhance Automated Feature Engineering (AutoFE) through semantic descriptions and trajectory-based prompting. However, there exist two challenges that limit their applicability and scalability in long-horizon optimization: (1) semantic metadata is unavailable in many practical settings, and (2) trajectory accumulation increases the risk of exceeding the context window, while without it, the generation process can become unstable, leading to becoming stuck in the local optima and a high duplicate rate of generated features. To this end, we propose a SHAP-enhanced Implicit-trajectory Generation for Metadata-free AutoFE (SIGMA), a scalable constant-context optimization framework. SIGMA leverages SHAP values to provide task-aware signals for guiding group feature generation instead of semantic information. In addition, we adopt an EXposed-feature Implicit Trajectory (EXIT) approach, where the exposed features in the prompt implicitly represent the trajectory. Empirical results demonstrate that SIGMA achieves performance comparable to the state-of-the-art (SOTA) LLM baselines with a nearly constant prompt length. Notably, EXIT significantly reduces the duplicate ratio of generated features from 37.2% to 6.8%. At the same time, SIGMA matches traditional SOTA performance with only 5.4 features on average, demonstrating substantial efficiency gains in feature utilization.

cs.LG↗

arXiv2026

Autonomous Generation of Metamaterial Databases Based on Multimodal Agents

Artificial intelligence (AI) is revolutionizing material research and discovery. However, its development in metamaterials is bottlenecked by a shortage of high-quality and executable structure-response databases, which are locked within scientific literatures as a mixture of text and images. Converting the rapidly growing body of scientific literatures into executable and reusable databases for machine-driven discovery is still a fundamental challenge. Here, we propose MetaDataGenAgent, a multimodal multi-agent framework that autonomously converts unstructured scientific literatures directly into metamaterial structure-response databases. MetaDataGenAgent establishes a complete literature-to-simulation pipeline through the coordinated operation of specialized agents for multimodal parameter extraction, physics-guided validation, topology-aware structural analysis, and solver-executable encoding. The framework introduces a closed-loop plan-execute-reflect mechanism that enables dynamic task decomposition, iterative validation, and feedback-driven model construction. Experimental results validate that MetaDataGenAgent can generate high-fidelity structure-response data for representative meta-atoms, which are further used to realize diverse electromagnetic functions, including far-field beam deflection, near-field holographic imaging and topologically protected surface-wave transport. By establishing an autonomous route from scientific literatures to AI-ready databases, the framework provides a general and efficient strategy that could be extended to a broad range of data-scarce scientific domains, including photonics, materials science, chemistry, computational science, and scientific automation.

physics.optics↗

arXiv2026

Resolving problems on polynomial characterizations of daisy cubes and extensions

Let $X\subseteq\{0,1\}^n$ be a set of binary strings of length $n$. The daisy cube $Q_n(X)$ is the subgraph of the hypercube $Q_n$ induced by the union of the intervals $I(0^n,x)$ for $x\in X$. As a subclass of partial cubes, it generalizes Fibonacci cubes and Lucas cubes. For a graph $G$ and a vertex $u\in V(G)$, the generating function of the number of $k$-cubes (resp. $k$-cubes at distance $d$ from $u$, and vertices at distance $d$ from $u$) is called the cube polynomial $C_G(x)$ (resp. the distance cube polynomial $D_{G,u}(x,y)$, and the distance polynomial $W_{G,u}(x)$). Let $G$ be a partial cube embedded into the hypercube $Q_n$ with $0^n \in V(G)$. In this paper, we prove that $G$ is a daisy cube if and only if one of the following equivalent conditions holds: (1) $C_{G}(x)=W_{G,0^n}(x+1)$; (2) $D_{G,0^n}(x,y)=W_{G,0^n}(x+y)$; (3) $D_{G,0^n}(x,y)=C_{G}(x+y-1)$. In particular, the results related to (1) and (3) give affirmative answers to two open problems posed by Klav\v{z}ar and Mollard (2019). Meanwhile, our results yield non-constructive characterizations of daisy cubes, which answer the question posed by Taranenko (2020). Further, we prove that $D_{G, u}(x, y)\leq W_{G, u}(x+y)$ and $C_{G}(x)\leq W_{G, u}(x+1)$ among the whole class of partial cubes. Besides, combined with another sharp upper bound $Cl_{G^\#}(x+1)$ for $C_G(x)$ due to Xie et al.(2024), we obtain polynomial characterizations of simplex graphs (a subclass of daisy cubes): $G$ is a simplex graph if and only if $W_{G, 0^n}(x)=Cl_{G^\#}(x)$, here $Cl_{G^\#}(x)$ is the clique polynomial of the crossing graph $G^\#$ of $G$.

math.CO↗

arXiv2025

Generative model for information metamaterial design

Generative models such as AlphaFold and MatterGen can directly generate novel material structures with desired properties, accelerating the new materials discovery and revolutionizing the material design paradigm from traditional trial-and-error approach to intelligent on-demand generation. AlphaFold is focused on protein prediction with specific aperiodic structures; while MatterGen is focused on predicting periodic and stable crystal structures. The universal design of metamaterials is much more complicated, since it involves to design meta-atoms (similar to the periodic structures) and their arbitrarily inhomogeneous distributions in space. Here, we propose InfoMetaGen, a universal generative model for information metamaterial design, which combines a pre-trained foundation model with lightweight functional adapters to intelligently generate artificial structures on-demand spanning from meta-atoms to arbitrary space coding patterns. In contrast to conventional intelligent metamaterial design methods that require training dedicated models for specific functionalities, InfoMetaGen enables a single universal generative model capable of switching across diverse functionalities by fine-tuning the lightweight adapters, significantly improving both efficiency and generalizability. Experimental results demonstrate that InfoMetaGen can not only accelerate the diverse discovery of new metamaterials, but also achieve breakthroughs in metamaterial performance. This work fills the gap of universal generative framework in designing artificial materials, and opens up unprecedented opportunities to expand the capability of generative models from the passive discovery of microscopic natural material to the active creation of macroscopic artificial materials.

physics.optics↗

arXiv2025

Intrinsic Strain-Driven Topological Evolution in SrRuO3 via Flexural Strain Engineering

Strain engineering offers a powerful route to tailor topological electronic structures in correlated oxides, yet conventional epitaxial strain approaches introduce extrinsic factors such as substrate-induced phase transitions and crystalline quality variations, which makes the unambiguous identification of the intrinsic strain effects challenging. Here, we develop a flexural strain platform based on van der Waals epitaxy and flexible micro-fabrication, enabling precise isolation and quantification of intrinsic strain effects on topological electronic structures in correlated oxides without extrinsic interference. Through strain-dependent transport measurements of the Weyl semimetal SrRuO3, we observed a significant enhancement of anomalous Hall conductivity by 21% under a tiny strain level of 0.2%, while longitudinal resistivity remains almost constant -- a hallmark of intrinsic topological response. First-principles calculations reveal a distinct mechanism where strain-driven non-monotonic evolution of Weyl nodes across the Fermi level, exclusively governed by lattice constant modulation, drives the striking AHC behavior. Our work not only highlights the pivotal role of pure lattice strain in topological regulation but also establishes a universal platform for designing flexible topological oxide devices with tailored functionalities.

cond-mat.mtrl-sci↗

arXiv2025

Characterizing circle graphs with binomial partial Petrial polynomials

The partial Petrial polynomial was first introduced by Gross, Mansour, and Tucker as a generating function that enumerates the Euler genera of all possible partial Petrials on a ribbon graph. Yan and Li later extended this polynomial invariant to circle graphs by utilizing the correspondence between circle graphs and bouquets. Their explicit computation demonstrated that paths produce binomial polynomials, specifically those containing exactly two non-zero terms. This discovery led them to pose a fundamental characterization problem: identify all connected circle graphs whose partial Petrial polynomial is binomial. In this paper, we solve this open problem in terms of local complementation and prove that for connected circle graphs, the binomial property holds precisely when the graph is a path.

math.CO↗

arXiv2025

Insulator-to-Metal Transition via Magnetic Reconstruction at Oxide Interfaces

Ultrathin two-dimensional (2D) electronic systems at the interfaces of layered materials are highly desirable platforms for exploring of novel quantum phenomena and developing advanced device applications. Here, we investigate ultrathin heterostructures composed of SrIrO3 (SIO) and SrRuO3 (SRO) layers to uncover their emergent properties. Strikingly, despite the fact that both individual layers are antiferromagnetic insulators, the interfaced heterostructure exhibits emergent metallicity. Through transport measurements, magnetic characterization, and angle-resolved photoemission spectroscopy (ARPES), we analyze the underlying mechanisms governing this insulator-to-metal transition. Our findings reveal that the transition is driven by interface-induced magnetic reconstruction, which is further corroborated by density functional theory (DFT) calculations. The staggered Dzyaloshinskii-Moriya interaction at the SIO/SRO interface is identified as the key driving force for this spin reorganization, as it stabilizes ferromagnetism in the coupled antiferromagnetic insulating layers. These findings highlight the significant potential of engineering interfacial magnetic interactions as a powerful approach to generate and control emergent electronic properties, paving the way for novel functionalities that are unattainable in individual ultrathin films.

cond-mat.mes-hall↗

arXiv2024

Unveiling the anisotropy of linear and nonlinear charge-spin conversion in Weyl semimetal TaIrTe4

In Weyl semimetals, the nonlinear planar Hall effect (NPHE) and spin-orbit torque (SOT) are prominent manifestations of nonlinear and linear charge-spin conversion, respectively. However, simultaneous investigations of these phenomena within a single material system are scarce, limiting our understanding of their intrinsic connection and underlying mechanisms. Here, we report the first simultaneous observation of NPHE and SOT in a TaIrTe4/Py heterostructure. By employing harmonic Hall measurements and developing a magnetic field-dependent method, we successfully separated the contributions from NPHE, field-like SOT, and damping-like SOT, enabling accurate characterization of both linear and nonlinear charge-spin conversion properties. Our experiments revealed significant anisotropy along the [100] and [010] crystallographic directions of TaIrTe4, with stronger nonlinear responses and field-like SOT along the [100] direction, and larger damping-like SOT along the [010] direction. The distinct directional dependence of these phenomena provides new insights into the interplay between surface and bulk contributions to charge-spin conversion in Weyl semimetals. These findings enhance our understanding of anisotropic charge-spin conversion mechanisms in Weyl semimetals, which may inform future research and development of spintronic devices based on topological materials.

cond-mat.mtrl-sci↗

arXiv2024

Manipulating Momentum-Space and Real-Space Topological States in Metallic Strontium Ruthenate Ultrathin Films

SrRuO3, a 4d transition metal oxide, has gained significant interest due to its topological states in both momentum space (Weyl points) and real space (skyrmions). However, probing topological states in ultrathin SrRuO3 faces challenges such as the metal-insulator transition and questioned existence of skyrmions due to possible superposition of opposite anomalous Hall effect (AHE) signals. To address these issues, we investigate ultrathin SrRuO3/SrIrO3 heterostructures and their AHE and topological Hall effect (THE). Our results reveal metallized ultrathin SrRuO3 down to the monolayer limit with an AHE signal. ARPES measurements confirm the metallic and topological band structure of ultrathin SrRuO3. Furthermore, the AHE sign remains negative over a wide thickness range, where THE is still observed. This observation excludes the two-channel explanation of THE and provides evidence for the existence of skyrmions in ultrathin SrRuO3.

cond-mat.mtrl-sci↗

arXiv2024

Detecting Stimuli with Novel Temporal Patterns to Accelerate Functional Coverage Closure

Novel test selectors have demonstrated their effectiveness in accelerating the closure of functional coverage for various industrial digital designs in simulation-based verification. The primary advantages of these test selectors include performance that is not impacted by coverage holes, straightforward implementation, and relatively low computational expense. However, the detection of stimuli with novel temporal patterns remains largely unexplored. This paper introduces two novel test selectors designed to identify such stimuli. The experiments reveal that both test selectors can accelerate the functional coverage for a commercial bus bridge, compared to random test selection. Specifically, one selector achieves a 26.9\% reduction in the number of simulated tests required to reach 98.5\% coverage, outperforming the savings achieved by two previously published test selectors by factors of 13 and 2.68, respectively.

cs.SE↗

arXiv2024

Cooperatively Modulating Magnetic Anisotropy and Colossal Magnetoresistance via Atomic-Scale Buffer Layers in Highly Strained La0.7Sr0.3MnO3 Films

Simultaneous control of magnetic anisotropy and magnetoresistance, especially with atomic scale precision, remains a pivotal challenge for realizing advanced spintronic functionalities. Here we demonstrate cooperative continuous control over both magnetoresistance and magnetic anisotropy in highly strained La0.7Sr0.3MnO3 (LSMO) thin films. By inserting varying perovskite buffer layers, compressively strained LSMO films transition from a ferromagnetic insulator with out-of-plane magnetic anisotropy to a metallic state with in-plane anisotropy. Atomic-scale buffer layer insertion enables remarkably acute, precise control to sharply modulate this magnetic phase transformation. A gigantic 10,000% modulation of the colossal magnetoresistance (CMR) and an exceptionally sharp transition from out-of-plane to in-plane magnetic anisotropy are attained in just a few contiguous layers. These atomic-scale correlations among electronic, magnetic, and structural order parameters yield flexible multifunctional control promising for next-generation oxide spintronics.

cond-mat.mtrl-sci↗

arXiv2024

DIRA: Dynamic Domain Incremental Regularised Adaptation

Autonomous systems (AS) often use Deep Neural Network (DNN) classifiers to allow them to operate in complex, high-dimensional, non-linear, and dynamically changing environments. Due to the complexity of these environments, DNN classifiers may output misclassifications during operation when they face domains not identified during development. Removing a system from operation for retraining becomes impractical as the number of such AS increases. To increase AS reliability and overcome this limitation, DNN classifiers need to have the ability to adapt during operation when faced with different operational domains using a few samples (e.g. 2 to 100 samples). However, retraining DNNs on a few samples is known to cause catastrophic forgetting and poor generalisation. In this paper, we introduce Dynamic Incremental Regularised Adaptation (DIRA), an approach for dynamic operational domain adaption of DNNs using regularisation techniques. We show that DIRA improves on the problem of forgetting and achieves strong gains in performance when retraining using a few samples from the target domain. Our approach shows improvements on different image classification benchmarks aimed at evaluating robustness to distribution shifts (e.g.CIFAR-10C/100C, ImageNet-C), and produces state-of-the-art performance in comparison with other methods from the literature.

cs.LG↗

arXiv2023

Using Neural Networks for Novelty-based Test Selection to Accelerate Functional Coverage Closure

Novel test selectors used in simulation-based verification have been shown to significantly accelerate coverage closure regardless of the number of coverage holes. This paper presents a configurable and highly-automated framework for novel test selection based on neural networks. Three configurations of this framework are tested with a commercial signal processing unit. All three convincingly outperform random test selection with the largest saving of simulation being 49.37% to reach 99.5% coverage. The computational expense of the configurations is negligible compared to the simulation reduction. We compare the experimental results and discuss important characteristics related to the performance of the configurations.

cs.SE↗

arXiv2022

Room temperature spin-orbit torque efficiency and magnetization switching in SrRuO3-based heterostructures

Spin-orbit torques (SOTs) from transition metal oxides (TMOs) in conjunction with magnetic materials have recently attracted tremendous attention for realizing high-efficient spintronic devices. SrRuO3 is a promising candidate among TMOs due to its large and tunable SOT-efficiency as well as high conductivity and chemical stability. However, a further study for benchmarking the SOT-efficiency and realizing SOT-driven magnetization switching in SrRuO3 is still highly desired so far. Here, we systematically study the SOT properties of high-quality SrRuO3 thin film heterostructuring with different magnetic alloys of both IMA and PMA configuration by the harmonic Hall voltage technique. Our results indicate that SrRuO3 possesses pronounced SOT-efficiency of about 0.2 at room temperature regardless of the magnetic alloys, which is comparable to typical heavy metals (HMs). Furthermore, we achieve SOT-driven magnetization switching with a low threshold current density of 3.8x10^10 A/m^2, demonstrating the promising potential of SrRuO3 for practical devices. By making a comprehensive comparison with HMs, our work unambiguously benchmarks the SOT properties and concludes the advantages of SrRuO3, which may bring more diverse choices for SOT applications by utilizing hybrid-oxide/metal and all-oxide systems.

cond-mat.mtrl-sci↗

arXiv2022

Anisotropic linear and nonlinear charge-spin conversion in topological semimetal SrIrO3

Over the past decade, utilizing spin currents in the linear response of electric field to manipulate magnetization states via spin-orbit torques (SOTs) is one of the core concepts for realizing a multitude of spintronic devices. Besides the linear regime, recently, nonlinear charge-spin conversion under the square of electric field has been recognized in a wide variety of materials with nontrivial spin textures, opening an emerging field of nonlinear spintronics. Here, we report the investigation of both linear and nonlinear charge-spin conversion in one single topological semimetal SrIrO3(110) thin film that hosts strong spin-orbit coupling and nontrivial spin textures in the momentum space. In the nonlinear regime, the observation of crystalline direction dependent response indicates the presence of anisotropic surface states induced spin-momentum locking near the Fermi level. Such anisotropic spin textures also give rise to spin currents in the linear response regime, which mainly contributes to the fieldlike SOT component. Our work demonstrates the power of combination of linear and nonlinear approaches in understanding and utilizing charge-spin conversion in topological materials.

cond-mat.mtrl-sci↗

arXiv2022

Emergence of insulating ferrimagnetism and perpendicular magnetic anisotropy in 3d-5d perovskite oxide composite films for insulator spintronic

Magnetic insulators with strong perpendicular magnetic anisotropy (PMA) play a key role in exploring pure spin current phenomena and developing ultralow-dissipation spintronic devices, thereby it is highly desirable to develop new material platforms. Here we report epitaxial growth of La2/3Sr1/3MnO3 (LSMO)-SrIrO3 (SIO) composite oxide films (LSMIO) with different crystalline orientations fabricated by sequential two-target ablation process using pulsed laser deposition. The LSMIO films exhibit high crystalline quality with homogeneous mixture of LSMO and SIO at atomic level. Ferrimagnetic and insulating transport characteristics are observed, with the temperature-dependent electric resistivity well fitted by Mott variable-range-hopping model. Moreover, the LSMIO films show strong PMA. Through further constructing all perovskite oxide heterostructures of the ferrimagnetic insulator LSMIO and a strong spin-orbital coupled SIO layer, pronounced spin Hall magnetoresistance (SMR) and spin Hall-like anomalous Hall effect (SH-AHE) were observed. These results illustrate the potential application of the ferrimagnetic insulator LSMIO in developing all-oxide ultralow-dissipation spintronic devices.

cond-mat.mtrl-sci↗

arXiv2021

Cooperative control of perpendicular magnetic anisotropy via crystal structure and orientation in single-crystal flexible SrRuO3 membranes

Flexible magnetic materials with robust and controllable perpendicular magnetic anisotropy (PMA) are highly desirable for developing flexible high-performance spintronic devices. However, it is still challenge to fabricate PMA films through current techniques of direct deposition on polymers. Here, we report a facile method for synthesizing single-crystal freestanding SrRuO3 (SRO) membranes with controlled crystal structure and orientation using water-soluble Ca3-xSrxAl2O6 sacrificial layers. Through cooperative effect of crystal structure and orientation engineering, flexible SrRuO3 membranes reveal highly tunable magnetic anisotropy from in-plane to our-of-plane with a remarkable PMA energy of 7.34*106 erg/cm3. Based on the first-principles calculations, it reveals that the underlying mechanism of PMA modulation is intimately correlated with structure-controlled Ru 4d-orbital occupation, as well as the spin-orbital matrix element differences, dependent on the crystal orientation. In addition, there are no obvious changes of the magnetism after 10,000 bending cycles, indicating an excellent magnetism reliability in the prepared films. This work provides a feasible approach to prepare the flexible oxide films with strong and controllable PMA.

cond-mat.str-el↗

arXiv2021

Isostructural Metal-Insulator Transition Driven by Dimensional-Crossover in SrIrO3 Heterostructures

Dimensionality reduction induced metal-insulator transitions in oxide heterostructures are usually coupled with structural and magnetic phase transitions, which complicate the interpretation of the underlying physics. Therefore, achieving isostructural MIT is of great importance for fundamental physics and even more for applications. Here, we report an isostructural metal-insulator transition driven by dimensional-crossover in spin-orbital coupled SrIrO3 films. By using in-situ pulsed laser deposition and angle-resolved photoemission spectroscopy, we synthesized and investigated the electronic structure of SrIrO3 ultrathin films with atomic-layer precision. Through inserting orthorhombic CaTiO3 buffer layers, we demonstrate that the crystal structure of SrIrO3 films remains bulk-like with similar oxygen octahedra rotation and tilting when approaching the ultrathin limit. We observe that a dimensional-crossover metal-insulator transition occurs in isostructural SrIrO3 films. Intriguingly, we find the bandwidth of Jeff=3/2 states reduces with lowering the dimensionality and drives the metal-insulator transition. Our results establish a bandwidth controlled metal-insulator transition in the isostructural SrIrO3 thin films.

cond-mat.str-el↗