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Lai Wei

Publications and source records attributed to Lai Wei.

At least 19 recordsLinked to original sources

uFlowCSP: Crystal Structure Prediction using Mean flow generative models

Crystal structure prediction (CSP) is fundamental to computational materials discovery. Generative models including CDVAE, DiffCSP, FlowMM, and CrystalFlow learn stable-crystal distributions directly, but diffusion and flow-matching inference requires tens to thousands of sequential network evaluations per candidate. We introduce uFlowCSP, a MeanFlow-based CSP model that learns the average, rather than instantaneous, probability-flow velocity. It generates a complete structure in one to five evaluations, delivering 5x-58x faster inference with equal or better performance. A chemistry- and symmetry-aware Transformer uses canonical atom ordering, global composition, and per-token chemistry embeddings. A coarse crystal-system token is used only during training; it provides additive gains, particularly improving space-group agreement despite being absent at inference, which remains formula-only. On MP-20 with 20 candidates per target, one step matches CrystalFlow (78.38% vs. 78.34%) with 100x fewer evaluations and about 10x lower wall-clock time. Five steps reach 83.64%, exceeding CrystalFlow (78.34% at 2,000 evaluations) and DiffCSP (77.93% at about 20,000), while using 20x fewer evaluations. uFlowCSP generates 10,000 structures in 0.39-1.31 minutes, versus 6.5 for CrystalFlow and 76.1 for DiffCSP. Under CSPBench's energy-ranked top-five structure-and-space-group criterion, five-step uFlowCSP reaches 72%/72%/65% structure, space-group, and consensus match rates. CrystalFlow reaches 78%/73%/68% at 100 steps but falls to 49%/32%/31% at five. Thus, uFlowCSP improves accuracy per network evaluation, not merely peak accuracy.

cond-mat.mtrl-sci

MedReaMM: Evaluating Large Multimodal Models on Expert-Level Clinical Diagnostic Synthesis

The application of Large Language Models (LLMs) to diagnostic decision-making has garnered growing interest. However, existing benchmarks largely focus on textual reasoning or isolated visual question-answering (VQA) tasks, lacking holistic integration of clinical narratives and medical imaging, and thus failing to assess the multimodal diagnostic synthesis capability central to expert clinical judgment. To bridge this gap, we introduce MedReaMM, a benchmark specifically designed to evaluate models' ability to synthesize heterogeneous clinical evidence consisting of detailed patient histories alongside multiple medical images into accurate differential diagnoses under a complete-information paradigm. Constructed from case reports sourced from top-tier medical journals and curated clinical case databases, MedReaMM comprises 625 expert-validated cases with an average of 2.79 medical images per case and a total of 1,042 standardized diagnoses annotated with ICD-11 codes. These cases predominantly represent rare, atypical, or multi-system presentations that demand expert-level evidence integration beyond routine pattern recognition. We evaluate 23 Large Multimodal Models (LMMs) and find that most achieve diagnostic accuracy scores below 50%, underscoring a substantial gap in multimodal diagnostic synthesis capability. Further analysis reveals that medical knowledge proficiency, medical image understanding, and evidence integration are all highly correlated with diagnostic performance.

cs.CV

Enhancing Localized Reasoning for Long Video Understanding via Efficient Segment-to-Video Supervision

Though Multimodal Large Language Models (MLLMs) have shown impressive potential in video understanding, long video understanding (LVU) remains challenging since distracting noise in complex and lengthy contexts can obscure localized details, misleading MLLMs to produce incorrect answers. Recent works mitigate these issues by incentivizing deep reasoning to include relevant evidence. However, these methods have two main problems: First, the reinforcement fine-tuning framework (RFT) they leveraged incurs substantial training overheads, including high annotation costs and complicated reward designs. Second, the self-reflective and iterative-perception mechanism in some methods causes lengthy outputs and high inference latency. To alleviate these problems, we propose a novel Segment-to-Video Supervision} method (S2V) to efficiently enhance fine-grained reasoning in LVU. Specifically, we generate question answer pairs (VQA) based on localized segments, and then transfer these segment-based VQA back to the whole video for training. Due to focusing on short segments, segment-based VQA can naturally notice details which tend to be overlooked from a whole-video perspective. Training on such data can enforce MLLMs to correctly associate fine-grained details with QA while avoiding distracting noise in the whole video. The S2V training involves just reinforcement learning (RL) with a simple accuracy reward based on only 10K VQA samples and the resulting S2V model predicts answer using a single forward pass with limited output tokens. Experimental results demonstrate that S2V can consistently improve LVU performance across multiple LVU benchmarks, outperforming both general MLLMs and reasoning-based methods not only in LVU accuracy but also in training and inference efficiency.

cs.CV

The Illusion of Visual Tool-Use: A Causal Audit of Thinking with Images

The "thinking-with-images" paradigm equips multimodal LLMs with active visual operations such as crop-and-zoom. However, models using these operations often achieve only marginal or negative gains over direct inference at substantially higher token cost. They may also repeatedly crop irrelevant regions and fail on questions that direct inference answers correctly. We ask whether the returned visual evidence causally affects the answer. To answer this question, we formulate visual tool-use as a causal graph that separates observation-mediated paths from action-induced shortcuts. We then audit it through interventions at the three levels: policy (comparing tool-use with direct inference), trajectory (corrupting all observations during rollout), and step (counterfactually replacing one individual observation under a fixed prefix). Our step-level estimand, Visual Evidence Gain, isolates the contribution of each returned observation. Across six representative models and five fine-grained perception benchmarks, we uncover policy miscalibration with two failure modes. In Calling Without Looking, returned observations have no causal effect on the answer. In Looking Without Planning, observations are informative but the call schedule is incoherent. A trajectory-level diagnostic decomposes the policy-level accuracy gain into per-group contributions and shows that the gain is concentrated in a Calibrated minority. We term this discrepancy the illusion of visual tool-use: despite aggregate accuracy gains, visual tool-use is not causally effective across a broad range of rollouts. The code is available at https://github.com/OpenCausaLab/CauAudit.

cs.AI

CLBench-V: Evaluating Multimodal Context Learning from Grounding to Knowledge Acquisition

Real-world tasks often require models to learn from task-specific context rather than relying only on pre-trained knowledge. While recent work has highlighted this capability as context learning, existing evaluations mainly focus on textual contexts. In many practical settings, however, the context to be learned from is multimodal: scientific findings are conveyed through figures and tables, financial indicators are scattered across converted reports, and spatial decisions depend on maps, scenes, or web pages. We introduce CLBench-V, a benchmark for multimodal context learning that addresses the difficulty of localizing where context use breaks down by organizing tasks around three dimensions: context grounding, new information application, and new knowledge learning. CLBench-V combines converted public benchmarks with newly constructed datasets spanning domains such as science, finance, long-document understanding, spatial reasoning, and web-based visual question answering. To reduce the cost of constructing domain-specific context-learning tasks, we further use automated construction and filtering procedures for our newly built datasets. Across 3,443 instances and six recent multimodal models, the best overall score is only 0.2847, indicating that multimodal context learning remains far from saturated. Moreover, InternVL3.5-30B-A3B performs best on context grounding and new knowledge learning, while Qwen3.5-Plus performs best on new information application. We further analyze judge reliability, context length, image count, and representative failure cases. Code is available at https://github.com/IamLihua/CLBench-V.

cs.CV

Parameter Scan of Multi-Fluid Equilibria in Rotating p-11B Plasmas: Effects on Fusion Power and Bremsstrahlung Losses

We present VEQ-MF, a fast spectral parameter-scan framework for two-dimensional axisymmetric multi-fluid equilibria with prescribed species-dependent toroidal rotation. The solver couples generalized Boltzmann density responses, quasineutral electrostatic polarization, and a generalized Grad--Shafranov equation, extending reduced-parameter Grad-Shafranov and VEQ formulations to multi-species rotating equilibria. Rotating $p\text{-}^{11}\text{B}$ spherical-tokamak configurations are used as a demanding test case. Independent scans of the proton and boron rotation frequencies are performed in EHL-2 and EHL-3B geometries. The computed fields are then post-processed to obtain fusion power from a drift-Maxwellian reaction-rate coefficient and bremsstrahlung power from an analytical radiation model. Three in-range EHL-3B finite-difference benchmarks give global stored-energy, bremsstrahlung-power, and fusion-power differences of $1.7$--$3.4\%$, while a representative convergence check shows sub-percent sensitivity to increasing the spectral-parameter number and negligible sensitivity to Gaussian-grid refinement. The core equilibrium solve remains fast for repeated scans, with representative nonzero EHL-3B cases requiring $0.032$--$0.050$~s per point in MATLAB, excluding post-processing, interpolation, plotting, and file export. The scans identify two competing multi-fluid effects. Under iso-rotation, outward boron accumulation increases the volume-integrated $n_e^2$, so the fusion-to-bremsstrahlung power ratio $\mathcal{R}_{\mathrm{fb}}$ decreases with increasing rotation. Species-dependent toroidal rotation weakens centrifugal polarization and lowers bremsstrahlung power, while the relative toroidal flow in the larger EHL-3B geometry raises the drift-Maxwellian reaction-rate coefficient and thereby modifies fusion power.

physics.plasm-ph

First reduced model for integrated computations of helicon wave heating and current drive in magnetic fusion plasmas

Fast predictive modelling of radio-frequency heating and current drive is important for integrated tokamak scenario design, yet kinetic calculations of helicon-wave absorption remain too computationally expensive for large-scale parameter scans. We present a reduced model for helicon-wave heating and current drive that retains the dominant parallel electron Landau-damping channel. The wave response is evaluated on the cold-plasma dispersion root, and a single-Landau-pole correction is introduced to obtain compact expressions for the local damping rate and current-drive efficiency. The model is benchmarked against the Chiu-Chan heating model using approximately 1.6 million samples covering representative conditions of EAST, HL-3, DIII-D and KSTAR. The reduction error is found to be governed primarily by the electron Landau parameter and electron beta. Within an identified sub-lower-hybrid-frequency validity window, results from different devices collapse onto a common error curve, which enables an empirical correction that is further tested using ITER-like and BEST-like extrapolation cases. Near and above the lower-hybrid frequency, the agreement deteriorates rapidly owing to changes in the cold-dispersion root structure and the breakdown of the single-branch WKB description. When coupled to a reduced current-drive source, the corrected heating model gives a median deviation of 10.8 percent from the Landau-channel Ehst-Karney reference and reproduces published CFETR current-density profiles. The resulting model provides a computationally efficient reduced closure for helicon-wave heating and current-drive calculations, together with physically interpretable limits on its range of validity.

physics.plasm-ph

CapSenseBand: Sustaining Cross-Disciplinary Creativity When Stitches Must Meet Signals

Wearable sensing systems increasingly depend on textiles that are both materially wearable and electronically functional. Their design requires collaboration between textile designers, who reason through stitches, yarn behavior, and machine constraints, and interaction designers, who reason through electrodes, signal paths, and insulation. However, these forms of expertise do not easily translate across disciplinary boundaries. This poster presents CapSenseBand, a knitted capacitive-sensing wristband developed through a research-through-design process organized around Analysis, Synthesis, and Detailing. We document an artifact chain spanning material swatches, a rapid wearable prototype, Paper Models as shared negotiation surfaces, a double-layer knitted structure, and an insulated Swept Frequency Capacitive Sensing breakout board. We show how Paper Models functioned as boundary objects, helping collaborators externalize intent, negotiate spatial and technical constraints, and preserve disciplinary expertise while converging on a shared design. We contribute a reusable swatch-to-sleeve pattern for material-centered HCI: keep discipline-specific probes open early, then converge through artifacts that make material, spatial, and electronic decisions legible before fabrication locks them in.

cs.HC

Attend to Evidence: Evidence-Anchored Spatial Attention Supervision for Multimodal RLVR

Reinforcement learning with verifiable rewards (RLVR) improves vision-language models (VLMs) by optimizing outcome rewards derived from final answers. However, such outcome-only rewards do not tell the model which image regions justify an answer. For questions that require visual grounding, these rewards cannot distinguish responses supported by relevant visual evidence from those produced by language-prior shortcuts or lucky guesses. We introduce EASE (Evidence-Anchored Spatial Attention), which augments multimodal RLVR with visual-evidence process supervision. EASE converts annotated evidence regions into a smoothed visual-token target and uses it to guide response-to-image attention during RL training, but only on high-reward trajectories. The annotations are used solely as privileged training labels, while inference requires only the original image and question. Across Qwen2.5-VL-7B, Qwen3-VL-4B, and Qwen3-VL-8B, EASE raises average scores over DAPO by 2.5 to 3.1 points on perception, hallucination, visual math, and multimodal reasoning benchmarks. Diagnostics and ablations show that EASE better aligns visual attention with annotated evidence regions.

cs.CV

InvEvolve: Evolving White-Box Inventory Policies via Large Language Models with Performance Guarantees

We study how large language models can be used to generate inventory policies in online settings with non-stationary demand. Our work is motivated by recent advances in LLM-based evolutionary search, such as AlphaEvolve, which demonstrates strong performance on static and highly structured problems such as mathematical discovery, but is not directly suited to dynamic inventory settings with online updates. We propose InvEvolve, an end-to-end inventory policy evolution and inference framework grounded in confidence-interval-based certification. Built on a large language model trained via reinforcement learning, InvEvolve can process demand data together with additional numerical and textual features, and generates white-box inventory policies with statistical safety guarantees for future deployment. We further introduce a unified framework with theoretical guarantees that connects training, inference, and deployment. This allows us to derive a lower bound on the probability that InvEvolve evolves a statistically safe and improved policy, and to characterize the multi-period performance gap relative to the oracle-safe benchmark. Tested on both synthetic data and real-world retail data, InvEvolve outperforms classical inventory policies and deep-learning-based methods. In canonical inventory settings, it generates new policies that outperform existing benchmarks.

cs.LG

Targeted Exploration via Unified Entropy Control for Reinforcement Learning

Recent advances in reinforcement learning (RL) have improved the reasoning capabilities of large language models (LLMs) and vision-language models (VLMs). However, the widely used Group Relative Policy Optimization (GRPO) consistently suffers from entropy collapse, causing the policy to converge prematurely and lose diversity. Existing exploration methods introduce additional bias or variance during exploration, making it difficult to maintain optimization stability. We propose Unified Entropy Control for Reinforcement Learning (UEC-RL), a framework that provides targeted mechanisms for exploration and stabilization. UEC-RL activates more exploration on difficult prompts to search for potential and valuable reasoning trajectories. In parallel, a stabilizer prevents entropy from growing uncontrollably, thereby keeping training stable as the model consolidates reliable behaviors. Together, these components expand the search space when needed while maintaining robust optimization throughout training. Experiments on both LLM and VLM reasoning tasks show consistent gains over RL baselines on both Pass@1 and Pass@$k$. On Geometry3K, UEC-RL achieves a 37.9\% relative improvement over GRPO, indicating that it sustains effective exploration without compromising convergence and underscoring UEC-RL as a key for scaling RL-based reasoning in large models. Our code is available at https://github.com/597358816/UEC-RL.

cs.AI

Bridging What the Model Thinks and How It Speaks: Expressive Speech Generation via Self-Aware Intent-Realization Alignment

Speech Language Models (SLMs) exhibit strong semantic understanding, yet often fail to translate this capacity into expressive acoustic realization, producing speech with flattened prosody and misaligned emotion. We identify this mismatch as the semantic understanding-acoustic realization gap. Existing approaches typically rely on externally specified proxies, such as emotion labels or style prompts, which require annotations and struggle to capture dynamically evolving expressive intent throughout dialogue. To overcome these limitations, we propose SASLM (Self-Aware Speech Language Model), a proxy-free framework that bridges what the model thinks and how it speaks through self-aware intent-realization alignment: (1) Intent-Aware Bridging self-distills expressive intent from the model's own evolving semantic generation states via a Variational Information Bottleneck (VIB), thereby guiding expressive speech realization without external expressive supervision; while (2) Realization-Aware Alignment reflectively aligns generated acoustics with intended expression through self-reward optimization, progressively improving intent-realization consistency during speech generation. Despite using only 3B parameters and 800 hours of expressive speech data, SASLM achieves state-of-the-art performance on EchoMind among open-source systems, surpassing models over 10 times larger and approaching commercial systems.

cs.CL

Mixture-of-Depths Attention

Scaling depth is a key driver for large language models (LLMs). Yet, as LLMs become deeper, they often suffer from signal degradation: informative features formed in shallow layers are gradually diluted by repeated residual updates, making them harder to recover in deeper layers. We introduce mixture-of-depths attention (MoDA), a mechanism that allows each attention head to attend to sequence KV pairs at the current layer and depth KV pairs from preceding layers. We further describe a hardware-efficient algorithm for MoDA that resolves non-contiguous memory-access patterns, achieving 97.3% of FlashAttention-2's efficiency at a sequence length of 64K. Experiments on 1.5B-parameter models demonstrate that MoDA consistently outperforms strong baselines. Notably, it improves average perplexity by 0.2 across 10 validation benchmarks and increases average performance by 2.11% on 10 downstream tasks, with a negligible 3.7% FLOPs computational overhead. We also find that combining MoDA with post-norm yields better performance than using it with pre-norm. These results suggest that MoDA is a promising primitive for depth scaling. Code is released at https://github.com/hustvl/MoDA .

cs.CL

Multi-Robot Multitask Gaussian Process Estimation and Coverage

Coverage control is essential for the optimal deployment of agents to monitor or cover areas with sensory demands. While traditional coverage involves single-task robots, increasing autonomy now enables multitask operations. This paper introduces a novel multitask coverage problem and addresses it for both the cases of known and unknown sensory demands. For known demands, we design a federated multitask coverage algorithm and establish its convergence properties. For unknown demands, we employ a multitask Gaussian Process (GP) framework to learn sensory demand functions and integrate it with the multitask coverage algorithm to develop an adaptive algorithm. We introduce a novel notion of multitask coverage regret that compares the performance of the adaptive algorithm against an oracle with prior knowledge of the demand functions. We establish that our algorithm achieves sublinear cumulative regret, and numerically illustrate its performance.

eess.SY

Zooming without Zooming: Region-to-Image Distillation for Fine-Grained Multimodal Perception

Multimodal Large Language Models (MLLMs) excel at broad visual understanding but still struggle with fine-grained perception, where decisive evidence is small and easily overwhelmed by global context. Recent "Thinking-with-Images" methods alleviate this by iteratively zooming in and out regions of interest during inference, but incur high latency due to repeated tool calls and visual re-encoding. To address this, we propose Region-to-Image Distillation, which transforms zooming from an inference-time tool into a training-time primitive, thereby internalizing the benefits of agentic zooming into a single forward pass of an MLLM. In particular, we first zoom in to micro-cropped regions to let strong teacher models generate high-quality VQA data, and then distill this region-grounded supervision back to the full image. After training on such data, the smaller student model improves "single-glance" fine-grained perception without tool use. To rigorously evaluate this capability, we further present ZoomBench, a hybrid-annotated benchmark of 845 VQA data spanning six fine-grained perceptual dimensions, together with a dual-view protocol that quantifies the global--regional "zooming gap". Experiments show that our models achieve leading performance across multiple fine-grained perception benchmarks, and also improve general multimodal cognition on benchmarks such as visual reasoning and GUI agents. We further discuss when "Thinking-with-Images" is necessary versus when its gains can be distilled into a single forward pass. Our code is available at https://github.com/inclusionAI/Zooming-without-Zooming.

cs.CV

Investigation of Toroidal Rotation Effects on Spherical Torus Equilibria using the Fast Spectral Solver VEQ-R

Standard reduced models often fail to adequately describe the complex geometric response of tokamak plasmas to strong toroidal rotation. In this work, we present VEQ-R, a computationally efficient spectral solver designed to calculate fixed-boundary equilibria with arbitrary toroidal flow. In contrast to computationally intensive grid-based codes, our model employs a 12-parameter shifted Chebyshev spectral expansion to explicitly resolve radial variations in high-order shaping profiles--such as dynamic elongation and triangularity. This capability allows the solver to accurately capture differential flux surface distortions (non-rigid effects) even in challenging sonic regimes ($M \sim 1.0$). By synergizing this compact variational formulation with a novel ``Matrix-Kernel'' acceleration technique, we transform the problem into pre-computed algebraic matrix operations. This approach achieves convergence in approximately 5 ms, maintaining exceptional geometric fidelity compared to high-resolution benchmarks while balancing speed and accuracy. Our analysis reveals that rotation-induced flux compression leads to a monotonic decrease in the core safety factor $q_0$, pushing it dangerously close to unity--a structural deformation mechanism effectively captured by this approximate yet robust solver.

physics.plasm-ph

Development of a Reduced Multi-Fluid Equilibrium Model and Its Application to Proton-Boron Spherical Tokamaks

Proton-Boron fusion requires extreme ion temperatures and robust confinement, making Spherical Tokamaks (ST) with high-power neutral beam injection primary candidates. In these devices, strong toroidal rotation and the large mass disparity between protons and boron ions drive complex multi-fluid effects - specifically centrifugal species separation and electrostatic polarization - that standard single-fluid magnetohydrodynamic (MHD) models fail to capture. While comprehensive multi-fluid models are often numerically stiff, we develop a reduced model balancing physical fidelity with computational robustness. By retaining dominant toroidal rotation and self-consistent potential while neglecting poloidal inertia and pressure anisotropy, the model couples a generalized Grad-Shafranov equation with species-specific Bernoulli relations and a quasi-neutrality constraint. The model is applied to two representative p-B ST configurations: the experimental EHL-2 and reactor-scale EHL-3B. Simulation results demonstrate that equilibrium modifications are governed by the ion Mach number ($M$). In the low-rotation regime ($M < 0.5$), multi-fluid effects are weak and solutions approach the single-fluid limit. However, at $M > 2$, strong centrifugal forces drive significant boron accumulation at the low-field side (LFS) and generate an internal electrostatic potential on the order of 10 kV. These findings confirm the necessity of multi-fluid modeling for accurate p-$^{11}$B reactor design and establish a theoretical foundation for future investigations into stability, transport, and free-boundary dynamics.

physics.plasm-ph

Post-LayerNorm Is Back: Stable, ExpressivE, and Deep

Large language model (LLM) scaling is hitting a wall. Widening models yields diminishing returns, and extending context length does not improve fundamental expressivity. In contrast, depth scaling offers theoretically superior expressivity, yet current Transformer architectures struggle to train reliably at extreme depths. We revisit the Post-LayerNorm (Post-LN) formulation, whose instability at scale caused its replacement by Pre-LN in modern LLMs. We show that the central failure mode of Post-LN arises from the ResNet-style residual pathway, which introduces gradient vanishing in deep networks. We present Keel, a Post-LN Transformer that replaces this residual path with a Highway-style connection. This modification preserves the gradient flow through the residual branch, preventing signal vanishing from the top layers to the bottom. Unlike prior methods, Keel enables stable training at extreme depths without requiring specialized initialization or complex optimization tricks. Keel trains robustly at depths exceeding 1000 layers and consistently improves perplexity and depth-scaling characteristics over Pre-LN. These findings indicate that Post-LN, when paired with a Highway-style connection, provides a simple and effective foundation for building deeply scalable LLMs, opening the possibility for future infinite-depth architectures.

cs.LG