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Zhenyu Li

Publications and source records attributed to Zhenyu Li.

At least 19 recordsLinked to original sources

When "Must" Becomes "Maybe": Constraint Weakening in LLM Agent Workflows

Large language model (LLM) agents coordinate complex tasks through multi-role and multi-stage workflows. Upstream state is repeatedly transformed into intermediate language artifacts, such as summaries, plans, tickets, memories, and handoff notes, from which downstream components act. For action-constraining state, topical retention is insufficient: an artifact may mention an unresolved condition while changing it from a requirement that must be resolved before execution into information that may merely inform the next action. We study this action-binding role as operational state preservation. Safety blockers provide a controlled instance because each source state has an explicit prerequisite, authority, fallback, and execution consequence. We condition on correct upstream identification, vary the handoff transformation, and evaluate an executor restricted to the resulting artifact. Across 1,296 controlled synthetic episodes, direct-handoff controls preserve every blocker, whereas compression, plan assimilation, convergence, ownership deferral, and precedent substitution repeatedly turn binding state into caveats or non-binding considerations. Normal handoff compression produces 100.0% deactivation and 54.2% forbidden action. Restoring all four state fields raises preservation to 100.0% and reduces forbidden action to 0.0%. Fixed-artifact interventions further separate preservation from containment: downstream verification eliminates forbidden action while artifact deactivation remains 95.3%. These results identify a state-transmission failure between information extraction and action. Handoff transformations can retain state content while weakening its constraints on downstream action. Semantic availability does not guarantee operational preservation.

cs.AI

TurboRetry: Mitigating Large-Scale QUIC Handshake Floods with Off-the-Shelf DPU Offloading

The modern transport protocol QUIC is designed to enhance network performance and security, but it remains vulnerable to handshake flooding attacks. Such attacks exhaust CPU resources by forcing the server to perform expensive cryptographic operations via a large number of handshaking requests. QUIC provides a built-in defense mechanism, the Retry mechanism, to mitigate these attacks. However, our experiments reveal that it can still become a performance bottleneck under large-scale QUIC handshake floods due to substantial computational overhead. In this paper, we design and implement TurboRetry, a split design, that offloads the Retry mechanism onto DPUs to efficiently mitigate QUIC handshake floods. TurboRetry partitions the tasks of the Retry into two categories, and then assigns them to the DPUs and the host, respectively. To preserve QUIC semantics and reduce the coordination overhead, TurboRetry designs an extended Retry token format and an efficient cooperation scheme. In addition, TurboRetry offloads the connection authorization task to the on-path DPA to further improve both performance and security. Our evaluation shows that TurboRetry outperforms the host-side implementation by a wide margin, improving throughput by 10-20$\times$.

cs.CR

Embedded quantum computing for many-body surface reaction

Predictive simulations of catalytic interfaces require correlated electronic-structure treatments that describe localized chemical transformations while retaining the influence of the extended metallic environment. We introduce QC-DFET, a quantum-computing density-functional embedding framework that maps surface-reaction active spaces to compact, environment-aware qubit Hamiltonians. A reaction-consistent active-space protocol preserves orbital continuity along reaction coordinates, while quantum-selected configuration interaction based on measurements from the Zuchongzhi superconducting quantum processor and strongly contracted perturbation theory capture static and dynamic correlation. On Cu(111), QC-DFET treats active spaces up to 28 qubits and is validated through a hierarchy of experimentally constrained surface-chemistry challenges. H2 dissociation/desorption tests balanced bond breaking and recombination barriers, CO adsorption tests site selectivity and metal-adsorbate bonding, and formate hydrogenation tests competing hydrogenation branches with different kinetic and thermodynamic signatures. Across these cases, QC-DFET reproduces bidirectional H2 barriers, recovers the observed top-site preference and adsorption strength of CO, and reconciles the experimentally benchmarked H2COO* reverse barrier with the lower forward barrier to HCOOH*. These results establish embedded quantum computing as a practical route to correlated surface-reaction energetics.

quant-ph

A High-Performance Pauli-Algebra Framework for Large-Scale Quantum Simulations

Efficient manipulation of Pauli-algebraic objects is a key bottleneck in the classical emulation and benchmarking of quantum algorithms for chemistry and many-body physics. This bottleneck appears in Hamiltonian construction, variational ansatz preparation, expectation-value and gradient evaluation, and real-time propagation, all of which require repeated Pauli-algebra operations. Here, we present a high-performance Pauli-algebra framework tailored to quantum many-body and quantum-chemical simulations. The framework combines compact binary symplectic encoding, canonical coefficient reduction, and grouped sparse operator representations that exploit shared bit-flip patterns among Pauli strings. The resulting Julia/C\texttt{++} implementation accelerates Pauli multiplication, Hamiltonian construction, and operator--state multiplication in sparse and symmetry-adapted many-electron spaces. Benchmarks demonstrate efficient Hamiltonian construction, large-active-space VQE and ADAPT-VQE calculations, and real-time variational dynamics on modern multicore CPU and GPU architectures. These results show that structure-aware Pauli-algebra engines provide a scalable classical backend for developing and benchmarking quantum algorithms in quantum chemistry and many-body simulation.

quant-ph

DivRL: Disentangled Self-Similarity Rewards for Diverse Subject-Driven Generation

Subject-driven image generation faces an "Identity-Diversity Paradox", where strong identity preservation often leads to rigid and low-diversity outputs. We propose a post-training framework called DivRL that jointly optimizes identity consistency and structural diversity simultaneously by leveraging disentangled visual features from a robust similarity model. Specifically, we introduce a Negative Self-Similarity Measure (nSSM) to quantify structural diversity, and Visual Semantic Matching (VSM) to evaluate identity consistency. We propose an "Explore-and-Suppress" strategy that treats VSM as a gated constraint: the model freely explores structurally diverse configurations, and only samples that violate the identity threshold are penalized via a quadratic hinge loss. This converts identity preservation from a competing objective into a feasibility constraint, allowing nSSM and VSM to improve jointly. Experiments demonstrate that our method effectively pushes the model to generate both consistent and diverse images and improves structural diversity while maintaining comparable identity consistency through a gated optimization formulation.

cs.CV

Artic-O: End-to-End Articulated Object Reconstruction via Latent Geometry Learning

Reconstructing articulated objects from sparse images requires recovering complete geometry, movable parts, and motion parameters. Recent methods typically separate geometry reconstruction, part reasoning, and articulation estimation into different stages. This separation can weaken consistency between shape, active parts, and motion, while also incurring substantial inference cost. We introduce Artic-O, an end-to-end, feed-forward framework for articulated object reconstruction via latent geometry learning. Instead of fitting geometry in image or view space, Artic-O maps sparse multi-state observations into a pretrained latent geometry space, where a frozen flow-matching decoder provides a complete-shape prior for recovering visible and occluded structures. To connect geometry with articulation, Artic-O fuses visual tokens, geometry latents, and point-wise decoder features in an image-grounded part-reasoning module for active-part segmentation and articulation prediction. We further train the model with a geometry-to-articulation curriculum and a decoupled two-pass strategy to balance reconstruction and part-level supervision. On PartNet-Mobility, Artic-O achieves strong reconstruction quality while being substantially more efficient than LARM, a strong prior method. It reduces Chamfer Distance, improves F-score, and achieves comparable or better articulation accuracy across most joint metrics, while reducing inference time from 9 minutes to about 0.3 seconds per object.

cs.CV

Physically Motivated Ansatz for Open Fermionic Systems on Quantum Computer

Determining non-equilibrium steady states (NESS) of open fermionic systems is a fundamental problem akin to finding ground states of closed systems. To address this, variational quantum algorithms can be used to solve the Lindblad master equation, much like the Schr\"odinger equation, yet ansatz design for NESS remains challenging. Existing approaches rely mostly on hardware-efficient ans\"atze (HEA), which suffer from the barren plateau problem. Here, we introduce a physically motivated ansatz named NE-UCC. Numerical simulations demonstrate that NE-UCC reliably converges to the steady state even in strongly correlated regimes far from equilibrium, reducing the infidelity by up to ten orders of magnitude compared to HEA. Furthermore, NE-UCC facilitates the exploration of excited eigenmodes with specific symmetries.

quant-ph

Adversarial Attacks on Robot Localization Systems via Deep Feature Perturbation

Robot localization systems are critical for autonomous navigation and safety. Adversarial perturbations can mislead these systems, resulting in mislocalization, navigation errors, or unsafe interactions, especially in mission-critical scenarios. This paper investigates the vulnerability of deep learning based localization pipelines to adversarial attacks. We propose a novel framework for generating adversarial queries that specifically target Product Quantization (PQ) in visual localization systems. Our method employs a Lightweight Product Quantization Network (LPQN) to perturb query feature encodings, misleading the retrieval process by returning semantically irrelevant database entries. Adversarial queries are generated via a two-phase procedure: a forward pass that perturbs feature distributions and a backward pass that refines the perturbation through optimization. The lightweight design of LPQN allows the creation of subtle yet highly effective perturbations with minimal computational overhead. Extensive experiments in both controlled and real-world robotic environments demonstrate that our approach substantially degrades PQN performance, exposing critical vulnerabilities in practical applications.

cs.CV

RIS-Assisted Survivable Backhaul Recovery in Small-Cell Systems

The increasing densification of small-cell networks substantially expands cable-based backhaul infrastructure, creating heightened vulnerability to cable link failures. This paper proposes a reconfigurable intelligent surface (RIS)-assisted backup framework that exploits a key insight: during backhaul cable failures, base station (BS) radio components remain functional, enabling wireless backhaul traffic redistribution. Our framework maintains network connectivity by redistributing disconnected BS backhaul traffic to neighboring BSs through RIS-assisted wireless links. To maximize survivability across varying traffic conditions, we formulate a joint optimization problem that maximizes total resolvable backhaul traffic by jointly deciding BS selection, RIS phase shifts, and precoding vectors. The inherent non-convexity arising from coupling and quadratic fractional term is addressed through an alternating optimization algorithm that iteratively solves tractable convex subproblems via quadratic transformation. Comprehensive numerical evaluations demonstrate that the proposed RIS-enhanced framework significantly improves survivability from 58% to 72% under challenging high-intensity hotspot traffic conditions. Moreover, RIS provides the greatest gains for antenna-constrained systems by extending coverage to access more spare capacity of the distant BSs as well as enhancing the signal strength. Consequently, high survivability is achieved even with only two antennas per BS under moderate traffic intensity.

cs.IT

Transformer refined quantum sampling for strongly correlated electronic structure

Although quantum computing offers a promising solution for strongly correlated system simulation, existing algorithms face significant bottlenecks on current noisy intermediate-scale quantum (NISQ) devices. Here, we introduce QiankunNet-QSCI, a hybrid quantum-classical framework that addresses this challenge by combining efficient quantum-sampling with a transformer neural network. An efficient unitary selected configuration Interaction (USCI) ansatz especially designed for quantum sampling is proposed to identify the most chemically significant electronic configurations on the Zuchongzhi 3.1 quantum processor. Subsequently, the transformer model QiankunNet learns from these sparse yet critical quantum data to infer and reconstruct the complete electronic wavefunction with high fidelity. Simulation of the challenging 40-qubit [2Fe-2S] ferredoxin active center achieves chemical accuracy. Simulation of the nitrogenase P-cluster in a 114-electron 73-orbital active space also reaches 12 milli-Hartree-level agreement with the best density matrix renormalization group (DMRG) result. QiankunNet-QSCI thus offers a practical route to accurate quantum-assisted electronic structure calculations on current devices.

quant-ph

CriterAlign: Criterion-Centric Rationale Alignment for Code Preference Judging

Pairwise human preference prediction is central to evaluating code-generation systems, where quality often depends on task-specific trade-offs beyond functional correctness. While rubric-based LLM judges improve interpretability by decomposing evaluation into explicit criteria, most existing pipelines remain pointwise: they score each response independently and derive preferences by comparing aggregated scores. We show that this design is poorly matched to pairwise code preference prediction and can underperform a strong monolithic judge. We propose CriterAlign, a criterion-centric framework that adapts rubric-based judging to pairwise preference evaluation through direct criterion-level pairwise judgments, tie-driven criterion refinement, swap-consistency filtering, and final pairwise synthesis. We further introduce Human-Preference-Aligned Guidance (HPAG), synthesized offline from training examples by extracting recurring rationale gaps between human preferences and monolithic judge predictions, and injected into the criterion generator, criterion judge, and final judge. On BigCodeReward, CriterAlign improves a Qwen2.5-VL-32B monolithic judge from 60.4% to 66.3% accuracy, with ablations confirming the contributions of pairwise criterion design and HPAG.

cs.SE

Towards On-Policy Data Evolution for Visual-Native Multimodal Deep Search Agents

Multimodal deep search requires an agent to solve open-world problems by chaining search, tool use, and visual reasoning over evolving textual and visual context. Two bottlenecks limit current systems. First, existing tool-use harnesses treat images returned by search, browsing, or transformation as transient outputs, so intermediate visual evidence cannot be re-consumed by later tools. Second, training data is usually built by fixed curation recipes that cannot track the target agent's evolving capability. To address these challenges, we first introduce a visual-native agent harness centered on an image bank reference protocol, which registers every tool-returned image as an addressable reference and makes intermediate visual evidence reusable by later tools. On top of this harness, On-policy Data Evolution (ODE) runs a closed-loop data generator that refines itself across rounds from rollouts of the policy being trained. This per-round refinement makes each round's data target what the current policy still needs to learn. The same framework supports both diverse supervised fine-tuning data and policy-aware reinforcement learning data curation, covering the full training lifecycle of the target agent. Across 8 multimodal deep search benchmarks, ODE improves the Qwen3-VL-8B agent from 24.9% to 39.0% on average, surpassing Gemini-2.5 Pro in standard agent-workflow setting (37.9%). At 30B, ODE raises the average score from 30.6% to 41.5%. Further analyses validate the effectiveness of image-bank reuse, especially on complex tasks requiring iterative visual refinement, while rollout-feedback evolution yields more grounded SFT traces and better policy-matched RL tasks than static synthesis.

cs.CL

Agent-World: Scaling Real-World Environment Synthesis for Evolving General Agent Intelligence

Large language models are increasingly expected to serve as general-purpose agents that interact with external, stateful tool environments. The Model Context Protocol (MCP) and broader agent skills offer a unified interface for connecting agents with scalable real-world services, but training robust agents remains limited by the lack of realistic environments and principled mechanisms for life-long learning. In this paper, we present \textbf{Agent-World}, a self-evolving training arena for advancing general agent intelligence through scalable environments. Agent-World has two main components: (1) Agentic Environment-Task Discovery, which autonomously explores topic-aligned databases and executable tool ecosystems from thousands of real-world environment themes and synthesizes verifiable tasks with controllable difficulty; and (2) Continuous Self-Evolving Agent Training, which combines multi-environment reinforcement learning with a self-evolving agent arena that automatically identifies capability gaps through dynamic task synthesis and drives targeted learning, enabling the co-evolution of agent policies and environments. Across 23 challenging agent benchmarks, Agent-World-8B and 14B consistently outperforms strong proprietary models and environment scaling baselines. Further analyses reveal scaling trends in relation to environment diversity and self-evolution rounds, offering insights for building general agent intelligence.

cs.AI

A Fully GPU-Accelerated Framework for High-Performance Configuration Interaction Selection with Neural Network Quantum States

AI-driven methods have demonstrated considerable success in tackling the central challenge of accurately solving the Schr\"odinger equation for complex many-body systems. Among neural network quantum state (NNQS) approaches, the NNQS-SCI (Selected Configuration Interaction) method stands out as a state-of-the-art technique, recognized for its high accuracy and scalability. However, its application to larger systems is severely constrained by a hybrid CPU-GPU architecture. Specifically, centralized CPU-based global de-duplication creates a severe scalability barrier due to communication bottlenecks, while host-resident coupled-configuration generation induces prohibitive computational overheads. We introduce QiankunNet-cuSCI, a fully GPU-accelerated SCI framework designed to overcome these bottlenecks. It first integrates a distributed, load-balanced global de-duplication algorithm to minimize redundancy and communication overhead at scale. To address compute limitations, it employs specialized, fine-grained CUDA kernels for exact coupled configuration generation. Finally, to break the single-GPU memory barrier exposed by this full acceleration, it incorporates a GPU memory-centric runtime featuring GPU-side pooling, streaming mini-batches, and overlapped offloading. This design enables much larger configuration spaces and shifts the bottleneck from host-side limitations back to on-device inference. Our evaluation demonstrates that our work fundamentally expands the scale of solvable problems. On an NVIDIA A100 cluster with 64 GPUs, our work achieves up to 2.32X end-to-end speedup over the highly-optimized NNQS-SCI baseline while preserving the same chemical accuracy. Furthermore, it demonstrates excellent distributed performance, maintaining over 90% parallel efficiency in strong scaling tests.

cs.DC

Riemannian and Symplectic Geometry for Hierarchical Text-Driven Place Recognition

Text-to-point-cloud localization enables robots to understand spatial positions through natural language descriptions, which is crucial for human-robot collaboration in applications such as autonomous driving and last-mile delivery. However, existing methods employ pooled global descriptors for similarity retrieval, which suffer from severe information loss and fail to capture discriminative scene structures. To address these issues, we propose SympLoc, a novel coarse-to-fine localization framework with multi-level alignment in the coarse stage. Different from previous methods that rely solely on global descriptors, our coarse stage consists of three complementary alignment levels: 1) Instance-level alignment establishes direct correspondence between individual object instances in point clouds and textual hints through Riemannian self-attention in hyperbolic space; 2) Relation-level alignment explicitly models pairwise spatial relationships between objects using the Information-Symplectic Relation Encoder (ISRE), which reformulates relation features through Fisher-Rao metric and Hamiltonian dynamics for uncertainty-aware geometrically consistent propagation; 3) Global-level alignment synthesizes discriminative global descriptors via the Spectral Manifold Transform (SMT) that extracts structural invariants through graph spectral analysis. This hierarchical alignment strategy progressively captures fine-grained to coarse-grained scene semantics, enabling robust cross-modal retrieval. Extensive experiments on the KITTI360Pose dataset demonstrate that SympLoc achieves a 19% improvement in Top-1 recall@10m compared to existing state-of-the-art approaches.

cs.CV

Owl-AuraID 1.0: An Intelligent System for Autonomous Scientific Instrumentation and Scientific Data Analysis

Scientific discovery increasingly depends on high-throughput characterization, yet automation is hindered by proprietary GUIs and the limited generalizability of existing API-based systems. We present Owl-AuraID, a software-hardware collaborative embodied agent system that adopts a GUI-native paradigm to operate instruments through the same interfaces as human experts. Its skill-centric framework integrates Type-1 (GUI operation) and Type-2 (data analysis) skills into end-to-end workflows, connecting physical sample handling with scientific interpretation. Owl-AuraID demonstrates broad coverage across ten categories of precision instruments and diverse workflows, including multimodal spectral analysis, microscopic imaging, and crystallographic analysis, supporting modalities such as FTIR, NMR, AFM, and TGA. Overall, Owl-AuraID provides a practical, extensible foundation for autonomous laboratories and illustrates a path toward evolving laboratory intelligence through reusable operational and analytical skills. The code are available at https://github.com/OpenOwlab/AuraID.

cs.AI

V2Rho-FNO: Fourier Neural Operator for Electronic Density Prediction

Density functional theory (DFT) is a cornerstone of computational chemistry and materials science, but its computational cost limits its use in large-scale and high-throughput applications. While machine learning has accelerated energy prediction for specific molecular classes, transferable prediction of electron density across diverse chemical spaces remains challenging. Here, we present a universal framework based on Fourier Neural Operators (FNOs) that directly learns the mapping from external potentials to electron density distributions. Unlike conventional approaches that rely on explicit atomic orbitals, basis sets, or handcrafted descriptors, the proposed method captures global electronic interactions and long-range correlations through operator learning in the spatial-frequency domain. Trained on datasets spanning multiple elements and molecular geometries, the model achieves zero-shot generalization to entirely unseen molecular systems and accurately predicts their electron densities without retraining. This transferability arises from the intrinsic ability of FNOs to represent global structure in continuous fields. Our work establishes neural operator learning as a promising route for fast, accurate, and transferable electronic structure prediction, with potential applications in high-throughput screening and chemical space exploration.

physics.chem-ph

EgoPoseFormer v2: Accurate Egocentric Human Motion Estimation for AR/VR

Egocentric human motion estimation is essential for AR/VR experiences, yet remains challenging due to limited body coverage from the egocentric viewpoint, frequent occlusions, and scarce labeled data. We present EgoPoseFormer v2, a method that addresses these challenges through two key contributions: (1) a transformer-based model for temporally consistent and spatially grounded body pose estimation, and (2) an auto-labeling system that enables the use of large unlabeled datasets for training. Our model is fully differentiable, introduces identity-conditioned queries, multi-view spatial refinement, causal temporal attention, and supports both keypoints and parametric body representations under a constant compute budget. The auto-labeling system scales learning to tens of millions of unlabeled frames via uncertainty-aware semi-supervised training. The system follows a teacher-student schema to generate pseudo-labels and guide training with uncertainty distillation, enabling the model to generalize to different environments. On the EgoBody3M benchmark, with a 0.8 ms latency on GPU, our model outperforms two state-of-the-art methods by 12.2% and 19.4% in accuracy, and reduces temporal jitter by 22.2% and 51.7%. Furthermore, our auto-labeling system further improves the wrist MPJPE by 13.1%.

cs.CV