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Lei Li

Publications and source records attributed to Lei Li.

At least 19 recordsLinked to original sources

Deep operator learning for efficient sampling from invariant measures of stochastic differential equations

We introduce an amortized neural sampler that combines operator learning with flow methods for sampling. It maps SDE coefficient functions to pushforwards from a reference measure to the invariant measures, enabling efficient sampling across families of stochastic differential equations. Our framework shifts traditional sampling cost to an initial training phase, after which new SDE instances require only one encoder pass and a few ODE solver steps, independent of mixing time. To handle problems in high dimensions, we use Lagrangian trajectory sensors for the coefficient functions and cross attention in the architecture. We also theoretically establish the expressivity and resolution invariance of our framework. Experiments on 1D and 2D SDE families show competitive accuracy with substantial speedups over MCMC in regimes with slow mixing, transfer across sensor counts, and demonstration results on a 64D interacting particle SDE where traditional grid approaches are infeasible.

math.NA

HiRAD: A Flexible Large-Scale AGV Routing System

Automatic Guided Vehicles (AGVs) substantially boost warehouse throughput, but routing large-scale AGV fleets remains challenging. Classical Multi-Agent Pathfinding solvers suffer from exploding combinatorial complexity and super-quadratic runtime, while relying on idealized grid or piecewise-linear motion models that mismatch real-world kinematics. Recent Reinforcement Learning (RL) solutions improve flexibility via decentralized agent policies but depend on discretized spatiotemporal representations, require millions of episodes to converge, and incur full-map observation at every step, which leads to large models, slow convergence, and high inference latency that violates real-time industrial control constraints. To address these bottlenecks, we propose HiRAD, a hierarchical RL framework for continuous-space AGV routing with real-time guarantees: (1) a step-level spatiotemporal representation that translates continuous motion into a differentiable RL problem, (2) a hierarchical strategy that splits heading choice from velocity control to reduce the action space, and (3) an asynchronous event-driven decision pipeline that lowers inference complexity from O(n^2) to O(n) and cuts per-step latency by as much as 71 percent. Across random graphs and two warehouse maps, HiRAD reduces makespan by 45 percent to 63 percent and shortens end-to-end runtime.

cs.RO

Numerical index one characterises commutative JB*-triples

We establish that a JB$^*$-triple $E$ is commutative if and only if its numerical index $n(E)$ is one. As a consequence, $n(E) = 1$ implies $n(E^*) = n(E^{**}) = 1$. This settles a question left open in the literature since 2008.

math.OA

PersonaForge: Realistic Multi-Turn User Simulation for Agentic Systems

Large language models are increasingly used as agentic workflow executors, yet existing training data and benchmarks largely assume informationally complete, single-turn queries. Our analysis of 16K real-world sessions shows that 75.9% of interactions are multi-turn, revealing a substantial gap between how users interact with agents and how such systems are trained and evaluated. We introduce \textbf{PersonaForge}, a user simulation framework for synthesizing realistic multi-turn user--agent interactions. PersonaForge combines a four-dimensional persona space, SOUL-driven behavioral control calibrated to real-user statistics, and Reverse Deep Construction grounded in authentic seed queries. Using PersonaForge, we construct a 6.3K-record training dataset and \textbf{PersonaForge-Bench}, a manually annotated 138-task benchmark spanning over 20 professional domains with four-dimensional scoring. Experiments on Qwen3.5-27B show that PersonaForge training improves the composite score by +4.1%, with gains across all four dimensions and the largest improvements in Task Completion (+6.0%) and Response Quality (+6.8%). Further analyses show that PersonaForge-trained agents use fewer turns and tool calls, suggesting improved interaction efficiency, while ablations confirm the contribution of SOUL components and adaptive simulation. Together, PersonaForge and PersonaForge-Bench establish a foundation for training and evaluating agents under realistic multi-turn user interaction.

cs.CL

Semantic Head Specialization Guides Hybrid ViT Attention for Multimodal LLMs

Hybrid attention dominates frontier LLMs, yet Vision Transformers (ViTs) in multimodal LLMs lack a satisfactory hybrid design, with no consensus on why certain attention patterns work better. To fill this gap, we study ViT attention heads and find they differentiate into object- and background-specialist roles, a pattern most pronounced under full attention; we call this Semantic Head Specialization (SHS). We propose SHS-Index to quantify this specialization, show that it distinguishes full-attention from chunk-window ViTs, and find that it strongly tracks downstream benchmark performance. We then identify three structural factors that shape SHS---window interaction, token serialization, and local softmax allocation---and use them as design principles for hybrid attention. Guided by these factors, we design Ariadne Attention, a hybrid that matches full attention on 22 image and video tasks at 6.5x less attention compute. Our findings establish head specialization as a measurable property for diagnosing and designing principled hybrid ViT attention at the multimodal-LLM scale.

cs.CV

WeMM-Embedding: WeChat Multi-Modal Embedding Technical Report

Universal multimodal embeddings are becoming a core component of modern AI systems, enabling heterogeneous content to be represented in a shared space for applications such as retrieval, recommendation, classification, and agentic systems. In this report, we present WeMM-Embedding, a family of universal multimodal embedding models supporting text, images, videos, visual documents, and arbitrarily interleaved multimodal inputs with flexible output dimensions. The family comprises 2B, 4B, and 9B variants and is trained in two stages: a large-scale multimodal alignment stage, followed by a refinement stage using curated data, fine-grained relevance supervision, and cross-scale knowledge transfer. Across extensive evaluations, WeMM-Embedding achieves leading performance on multiple public benchmarks. Notably, the 2B variant already surpasses the previously leading 8B open-source baseline on MMEB-v2, while the 9B variant further achieves a new state-of-the-art overall score of 80.6. WeMM-Embedding also demonstrates strong practical performance across WeChat applications, with substantial gains on a 26-task in-house benchmark and consistent improvements across 14 online A/B tests. It has been deployed at scale across recommendation and search applications, including WeChat Channels, Official Accounts, Moments, and e-commerce services. We have released the model weights and code to facilitate future research at https://github.com/Tencent/WeMM-Embedding.

cs.CV

A particle method for the Boltzmann equation via amortized sampling from Green's function of the lifted linear operator

The collision operator for the Boltzmann equation is a nonlinear nonlocal operator. When lifted in the extended 2-particle space, it is viewed as the projection of a collisional linear operator. In this paper, we propose a particle method that samples the post-collision relative velocity directly from the Green's function of this operator (the transition probability of the generated time-continuous Markov chain). The normalizing flow amortized sampling is then proposed to reduce the sampling complexity. The resulted method takes $O(N)$ each time where $N$ is the particle number, and conserves momentum and energy exactly. This method does not require the boundedness of the kernel and, more importantly, it allows learning the Green's function directly from the scattering data without selecting the kernel in a specified family.

math.NA

ES-VP : Energy-Shaped Dynamic Visual Prompting for Efficient Model Adaptation

Visual prompting (VP) has emerged as a parameter-efficient method for adapting pre-trained models to downstream tasks. However, existing approaches encounter a trade-off between flexibility and efficiency. Some methods apply a fixed prompt to all images, ignoring individual image characteristics, while others introduce auxiliary networks to generate diverse prompts. Although the latter can improve performance, it also significantly increases parameter usage and the potential for overfitting to specific datasets. Furthermore, the auxiliary networks, combined with inherent biases in pre-trained models, limit scalability and generalization. In this paper, we propose Energy-Shaped Visual Prompting (ES-VP), a novel approach that generates image-specific prompts using low-rank initialization and energy-guided dynamic adaptation, achieving superior performance with fewer parameters compared to single-prompt methods. ES-VP directly utilizes the pre-trained model for adaptive prompt generation, ensuring both parameter efficiency and improved generalization. Extensive experiments conducted on five architectures across fifteen datasets demonstrate that ES-VP consistently outperforms current state-of-the-art (SOTA) single and diverse VP methods. For instance, using the CLIP architecture across four datasets, ES-VP outperforms the SOTA method DAM-VP by an average of 2.6\% in accuracy while utilizing 590$\times$ fewer VP parameters, thereby establishing a new benchmark for efficient and generalizable model adaptation.

cs.CV

Learning to Beat: Phenotype-Guided Latent Flow with Regional Motion Priors for Biventricular Motion Synthesis

Full-cycle biventricular geometry is essential for characterizing cardiac function. However, dense and temporally consistent 3D+t biventricular meshes are not routinely available, whereas end-diastolic (ED) anatomy can often be obtained reliably. We therefore investigate full-cycle biventricular motion synthesis from a single ED mesh. This task is challenging because cardiac deformation is spatially heterogeneous and phenotype dependent, while conventional global generative models often obscure localized motion patterns. In this study, we propose a region-specific and phenotype-adaptive framework that integrates motion-informed functional parcellation with conditional latent flow. A functional partition learned from reconstructed motion organizes the ventricular surface into regions with coherent dynamics and enables topology-aware regional feature exchange. A phenotype-conditioned rectified-flow model subsequently maps the ED anatomy to full-cycle motion latents through fine-grained conditioning and prototype-routed motion adapters. An optional control branch further incorporates available motion descriptors for controllable synthesis. Experiments on ACDC, M\&Ms, and M\&Ms-2 demonstrate consistent improvements in geometric accuracy and functional fidelity. Under ED-only synthesis, our method achieves biventricular ASSD, HD95, and vRMSE of \(1.49\pm0.34\)~mm, \(3.77\pm1.06\)~mm, and \(3.31\pm1.03\)~mm, respectively, outperforming all competing methods. Complementary functional and robustness evaluations further demonstrate that the synthesized sequences preserve physiologically plausible ventricular dynamics and generalize across cohorts and disease phenotypes. The code will be released publicly upon acceptance of the manuscript for publication.

cs.CV

Reconstruction: A Blind Benchmark for Recovering Research Ideas from Pre-Publication Bibliographies

Can a language model recover the true research idea of a published paper when given only that paper's pre-publication bibliography? We introduce Reconstruction, a blind idea-recovery benchmark that withholds the seed paper and all contemporaneous or future literature, and asks models to propose hypotheses that an independent large language model judge matches against the held-out ground-truth idea. A strict anti-leakage protocol-temporal citation cutoff, anonymous reference IDs, and frozen per-paper bibliographies, which prevents prompt-time leakage of the seed idea. Across six scientific domains and 643 evaluated papers, seven frontier models achieve only modest Match rates (approx. 3-15%). We then evaluate a reference-only multi-agent (top 4) pipeline that combines cross-model review with a Swiss tournament over aligned hypothesis slots, without external web search. Cross-model review plus tournament selection raises Match rates to approx. 23-42% across all six domains, which is an observed approx. 2.4x lift over the best single-model baseline. This draft reports the protocol, anti-leakage design, and current results as an arXiv timestamp.

cs.AI

How Do Agents Fail on AutoResearch: End-to-End Diagnostic Evaluation on 100 Real-World Frontier Research Tasks

AI has long assisted scientific research, but the rapid advance of LLMs and agentic scaffolds is reshaping the landscape; a single system can now carry whole-stage research from an initial hypothesis all the way to final published paper, which is a paradigm now referred to as AutoResearch. Existing evaluations reveal little about how these agents operate or where they break down. Tasks are narrowly-scoped, evaluation measures performance but not process, and failure diagnoses lack systematic coverage or artifact-level visibility. To address this gap, we introduce AutoResearchEval, featuring 100 tasks grounded in published frontier science across 7 scientific domains and the full research lifecycle, including ideation, retrieval, execution, analysis, writing, and review. Evaluating 8 harness-model combinations yields 800 autoresearch agent trajectories, with process-level annotation. We organize these insights into AutoResearch Failure Taxonomy or ARFT, a framework of 45 empirically-grounded failure patterns. To enable scalable fine-grained attribution, we leverage a human-calibrated agent-as-a-judge pipeline to inspect complete trajectories and intermediate artifacts. Failure patterns converge on a single overarching limitation, namely that current agents lack a metacognitive loop, which entails the ability to check what they produced against what they found, revise when it does not hold up, and question whether the path they took was sound. The same patterns recur across all 8 harness-model combinations, including the strongest models tested, locating the deficit at the model level rather than in any particular scaffold; whether orchestration-level interventions can close it is an open question this work does not test. We publicly release AutoResearchEval and ARFT to facilitate continued research and development in autonomous scientific discovery.

cs.CL

The electrical transport of intrinsic two-dimensional ferroelectric metal PtBi2

Breaking the conventional stereotype that ferroelectrics are necessarily insulating, two-dimensional (2D) ferroelectric metals combine seemingly incompatible switchable electric polarization and metallic conductivity, providing a fertile ground for the discovery of novel electrical transport phenomena and the development of innovative electronic devices. Using the semiclassical Boltzmann equation and first-principles calculations, we systematically investigate the linear and nonlinear transport responses of the intrinsic 2D ferroelectric metal \ch{PtBi2} to an applied electric field. Our \textit{ab initio} molecular dynamics simulations reveal that it possesses a high Curie temperature reaching $800~\text{K}$. We propose that the crystal structure of its high-temperature paraelectric phase can be explicitly distinguished through simple measurements of the in-plane electrical conductivity. Quantitative calculations of the Edelstein effect and the intrinsic spin Hall effect demonstrate a sizable charge-to-spin conversion efficiency, highlighting its potential in spintronics. We also find that a Berry curvature dipole-induced nonlinear Hall effect emerges in uniaxially strained \ch{PtBi2}. Furthermore, we highlight the unique advantages of 2D ferroelectric metals in gate-controlled transport applications. Based on the domain wall scattering mechanism, we conceptually design a novel ferroelectric metal field-effect transistor (FEM-FET) capable of nonvolatile switching between high-resistance and low-resistance states under a gate voltage. Our work not only unveils the rich transport physics in 2D ferroelectric metals but also provides valuable insights into the design of next-generation nonvolatile memory and spintronic devices.

cond-mat.mtrl-sci

ComBodied Agents: a New Paradigm of Human-Centric Agentic AI

After an older adult misses a medication dose, a software agent can send another reminder and an embodied agent can bring the medication. Yet neither explains whether the person forgot, is confused, has side effects, or deliberately refused, nor what support is appropriate. This reveals a structural gap in Agentic AI: Digital Agents primarily transform software states, while Embodied Agents transform physical states; neither makes a person's evolving state and agency the primary object of modeling, intervention, and evaluation. We introduce Combodied Agents, a human-centered paradigm that perceives, models, predicts, and supports individual human-state trajectories over time, using software tools, sensors, wearables, robots, and human services as action channels rather than end goals. We unify fragmented capabilities across personal assistants, health agents, AI companions, and adaptive human--AI systems into a closed loop: event-based multimodal perception reconstructs meaningful personal events; longitudinal, correctable memory provides temporal context; Personal World Models estimate future personal states and outcomes under alternative decisions and interventions; and an admissible intervention policy selects proportionate support under consent, uncertainty, safety, reversibility, and user control. Feedback from the person and environment updates the loop. Rather than requiring an exhaustive Human Digital Twin, the framework uses purpose-bounded, uncertainty-aware, user-correctable representations. We organize the design space by human-state targets, relational contexts, and agent roles, and propose scenario-centered evaluation, agency-preservation metrics, benchmark requirements, edge-native personal models, and governance directions. Combodied Agents shift Agentic AI from external task completion toward sustained human benefit.

cs.AI

RAGMesh with FaME-G2E: Long-Form Text-Driven 3D Face Generation and Editing

Text-driven 3D face generation and editing remains challenging due to the difficulty of translating long-form descriptions into fine-grained facial geometry. Existing methods primarily align global textual semantics with facial structures but often struggle to capture subtle local deformations, such as eyebrow tension, cheek contraction, and asymmetric mouth motions, resulting in limited geometric fidelity and editing precision. To facilitate fine-grained text-driven facial modeling, we first construct FaME-G2E, a large-scale multimodal dataset containing detailed text--mesh annotations and paired text--blendshape samples for unified 3D facial generation and editing. Based on this dataset, we propose RAGMesh, a retrieval-augmented framework that leverages text-correlated geometric priors to improve high-fidelity facial synthesis and editing. Specifically, the Multi-Scale Retrieval Fusion (MSRF) module retrieves semantically consistent global and regional facial priors and fuses them in the blendshape space, suppressing conflicting local deformations while preserving coherent deformation patterns. Furthermore, we introduce Adaptive RAG-guided Supervision (AdaRAGS), a region-aware constraint that explicitly aligns textual semantics with corresponding facial regions, enhancing regional controllability and editing accuracy. Extensive experiments on FaME-G2E demonstrate that RAGMesh achieves superior performance over state-of-the-art methods in local geometric accuracy, text-guided controllability, regional editing precision, and inference efficiency. Video demo is available at https://youtu.be/Yr0_XkpWcNk, and the source code and dataset will be released upon paper acceptance.

cs.CV

Fractional Spin Ferroelectric and Sliding Spin Current in Magnetic Sliding Ferroelectrics

We investigate the fractional spin ferroelectric (FSFE) in magnetic sliding ferroelectrics (SFEs), where ferroelectric switching is characterized not only by the reversal of the out-of-plane electric polarization but also by a variation of fractional in-plane spin electronic polarization. We show that interlayer sliding in FSFEs can naturally lead to a symmetry-protected pure spin current, termed the sliding spin current here. The underlying mechanism is that, during switching, the contributions of valence electrons and ions to the in-plane charge transfer cancel each other, whereas the in-plane spin transfer, which stems solely from valence electrons, persists, leading to a pure spin current. We demonstrate our ideas in various material candidates, including $H$-stacked bilayer CrI$_3$, whose few-layer form has been experimentally confirmed to be a magnetic SFE, and $R$-stacked bilayers $2H$-V$X_2$ ($X=$ S, Se, Te), which have been experimentally synthesised. For a typical switching time of about $1$ ns, the estimated spin-current densities for bilayer CrI$_3$ and V$X_2$ reach $10^9 (\hbar/2e)\mathrm{A/m^2}$ and $10^8 (\hbar/2e)\mathrm{A/m^2}$, respectively. This means that by applying a periodic out-of-plane electric field, a significant alternating spin current can be generated in magnetic SFEs. Thus, our findings propose a compelling new mechanism for the all-electrical generation of pure spin current, and predict concrete realistic materials for experimental verification.

cond-mat.mtrl-sci

Relay, Don't Route: Adaptive Population Handoff for Cost-Efficient LLM-Driven Evolution

Large language model (LLM)-driven evolution has shown promise for program search and algorithm discovery, but relying on strong models throughout long evolutionary runs is costly. A natural alternative is to combine cheap and strong models under a fixed inference budget. However, existing approaches typically allocate models at the level of individual queries or mutation steps, overlooking that evolutionary search is \textit{stateful}: each generated candidate changes the population from which subsequent mutations are produced. We empirically analyze LLM-driven evolutionary trajectories and find that search progress is strongly front-loaded, early trajectory performance is informative but noisy, and cheap models recover much of the early progress achieved by strong models at lower cost. Motivated by these findings, we propose \textbf{\model}, a training-free framework that shifts budget allocation from individual calls to evolving populations through adaptive \textit{population handoff}. A cheap model explores multiple trajectories in short blocks allocated by a bandit scheduler. Relay Gain, defined as the marginal improvement of a compact, quality-diverse candidate bank constructed for handoff, serves as the scheduler reward and determines when to hand off. The curated candidates initialize a shared strong model population for refinement. Across four benchmarks and three budgets, \model achieves the highest mean score in 11 of 12 settings, outperforming competitive baselines. Our results suggest that in stateful search, budget allocation should be organized around the population, not the individual call.

cs.CL

Potential Matching Optimal Transport: Continuous Normalizing Flows for Exact $p$-Wasserstein Dynamics

We introduce Potential Matching Optimal Transport (PMOT), a potential-flow framework for general $p$-cost optimal transport with $c_p(x,y)=\|x-y\|^p$. PMOT parameterizes the CNF velocity field with a scalar potential in the generalized Benamou--Brenier form for the chosen exponent $p$. It trains the potential gradient with a self-induced matching loss along straight bridges determined by the model's own endpoints, while allowing flexible terminal distribution matching. Our main result establishes zero-loss exactness: under the stated regularity, exact terminal matching, and uniqueness assumptions, any zero-loss solution satisfies the generalized Benamou--Brenier optimality system and recovers the corresponding $p$-optimal transport map and dynamics. On synthetic benchmarks, PMOT learns $p$-specific maps that agree with the corresponding $p$-matched OT references. It also remains competitive as a likelihood-based density model on high-dimensional tabular data, and an MMD-based color transformation experiment demonstrates flexible sample-based terminal matching.

cs.LG

Neutral Atom Quantum Computing: Principles, Routes, Progress, and Challenges

Neutral atom quantum computing utilizes laser-trapped neutral atoms as qubits and realizes quantum logic gate operations through Rydberg-state interactions. In recent years, it has become one of the most vibrant directions in quantum computing hardware. This paper systematically reviews the working principles of neutral-atom quantum computers, including qubit encoding, atom trapping and manipulation, Rydberg states and interactions, the Rydberg blockade quantum gate mechanism, and atom rearrangement with reconfigurable architectures. The mainstream technical routes are surveyed, represented by optical tweezer arrays combined with Rydberg interactions, optical lattice schemes, and dipole trap arrays. A panoramic review is provided of domestic and international research progress from theoretical foundations in 2000 to the latest achievements in 2026, including thousand-qubit-scale systems, logical qubits, and quantum error correction experiments. Key breakthroughs are highlighted, such as the 6100-atom qubit array, continuous operation of a 3000-qubit system, quantum simulation of the Kitaev honeycomb model, toric code error correction demonstrations, encoding rates exceeding 1/2, and fault-tolerant architectures. The core bottlenecks are analyzed in depth, including the scalability--fidelity trade-off, engineering implementation of quantum error correction, atom loss and mid-circuit replenishment, laser system industrialization, control electronics scalability, and long-distance quantum interconnection. This paper aims to provide a systematic reference for academic research and technological development in this field.

quant-ph