arXiv subjects

Sha Li

Publications and source records attributed to Sha Li.

At least 19 recordsLinked to original sources

arXiv2026

Harness-Delta Attribution: Dissecting Gains From Harness Evolution

Harness evolution automatically optimizes the prompts, skills, tools, and orchestration code around a fixed-weight model, offering a way to improve agentic systems without updating model weights. The agent harness is iteratively optimized to achieve higher performance on the search set. But how much of this gain reflects benchmark-specific overfitting or additional inference-time compute, and how much may generalize beyond the search set? In this work, we introduce Harness-Delta Attribution (HDA), an evaluation protocol that dissects an evolution gain into artifact-driven overfitting, gains explained by test-time scaling, and the remainder, which gives an upper bound on residual generalizable improvement. We apply HDA to 11 executor models and three harness-evolution frameworks across math, coding, creativity, and agentic tasks. In 21 of these settings that show statistically significant search-set gains, we find that a large share of the improvement is explained by overfitting or test-time scaling. Specifically, among these 21 settings, overfitting and test-time scaling account for 54% and 14% of the gain on average; their combined share exceeds 50% in 14 settings. The residual and held-out transfer vary substantially across tasks, models, and frameworks. Importantly, search-set gains often fail to transfer to held-out tasks, and provide limited evidence that they will persist under practical distribution shifts. Moreover, validation-based signals are insufficient to prevent overfitting. These results motivate attribution-aware evaluation in future harness evolution research.

cs.AI↗

arXiv2026

Beyond the Verdict: Agentic Code Judging with Verifiable Feedback

Test-time scaling for large language models (LLMs) can involve generating multiple candidate solutions for selection or revising an earlier attempt. To guide selection and revision, we need a verifier that can estimate candidate correctness and provide evidence of failure. In competitive programming, however, official judging systems provide authoritative verdicts under finite submission budgets, without revealing failure explanations or failing inputs. To provide informative feedback without consuming official submissions, we formulate a task in which a model judges and diagnoses a candidate program using only the problem statement and source code, with generated counterexamples serving as checkable evidence. To evaluate this task, we build USACO-JUDGE from the USACO 2026 contests, using accepted and unaccepted programs written by human experts and multiple LLMs. We then train ARBITER, a 35B mixture-of-experts (MoE) agentic verifier, with reinforcement learning in a generic execution sandbox. Training raises counterexample success on incorrect programs from 40.61% to 62.67% and mean binary verdict accuracy on USACO-JUDGE from 71.41% to 87.41%, approaching frontier verification performance. Beyond verification, ARBITER outperforms baselines in both code selection and refinement. In an IOI 2026 case study, ARBITER-guided refinement raises GPT-OSS-120B's expected score above the gold-medal threshold under the official submission limit.

cs.AI↗

arXiv2026

STAPLE: Static Sparse Upcycling of Pretrained Checkpoints via Embedding Modules

Sparse computation can scale the parametric capacity of LLMs without proportionally increasing active computation, but pretraining sparse architectures remains expensive and data-hungry. Existing sparse upcycling methods mainly target Mixture-of-Experts models, where expert homogeneity, sample inefficiency, and system overheads can limit practical scalability. Static sparse memory offers predictable access and token-specific updates that can help address these challenges, but naively integrating it into pretrained computation yields poor returns. In this work, we introduce STAPLE, a recipe built upon STEM for integrating static sparse memory into pretrained models. Whereas STEM replaces FFN up-projections with token-indexed embeddings, STAPLE retains them and adds the embeddings as a residual pathway, preserving pretrained computation while learning complementary token-specific information in a scalable manner. On OLMo-2 1B, STAPLE improves over continued dense training by 4.27 points on HumanEval, 2.80 on MBPP, 2.27 on GSM8K, and 1.65 on DROP. Average performance increases with static capacity, and improvements persist on the larger OLMo-2 7B backbone. STAPLE also outperforms static sparse baselines such as STEM and an Engram-style model, and achieves a higher average score than an MoE upcycling baseline while decoding 2x faster with less than half its GPU model memory and measured GPU energy per token in our throughput-oriented decoding evaluation. Importantly, despite introducing billions of parameters late in training, our host-offloaded implementation keeps generation throughput within 1.5% and training throughput within 3% of the dense baseline, while caching only the ~5% most frequent embeddings on GPU. These results show that static sparse memory can provide a sample-efficient, scalable, and sustainable path for expanding pretrained models without sparse pretraining from scratch.

cs.LG↗

arXiv2026

$π^2$: Structure-Originated Reasoning Data Improves Long-Context Reasoning Ability of Large Language Models

We study a QA curation pipeline for improving long-context complex reasoning in large language models (LLMs). Our approach, $π^2$, constructs high-quality reasoning data through rigorous QA curation: 1) extracting and expanding tables from Wikipedia, 2) from the collected tables together with relevant metadata, generating complex reasoning questions whose answers are automatically determined and validated through dual-path code execution, 3) finally, back-translating chain-of-thoughts solutions grounded in realistic context. Supervised fine-tuning with gpt-oss-20b and Qwen3-4B-Instruct-2507 on $π^2$ yields consistent improvements across four long-context reasoning benchmarks and our alike $π^2$-Bench, with average absolute accuracy gains of +6.25% and +3.37% respectively. Through deeper analyses, we observe that reasoning style contributes little, while faithful reasoning patterns discovered by back translation and grounded realistic long context, as $π^2$ is designed for, are crucial for the improvement. Our code, data, and models are fully open-source at https://github.com/vtpss/pi-squared.

cs.CL↗

arXiv2026

Adaptive Graph-of-Islands Evolution for Automatic Feature Engineering with LLMs

Automatic feature engineering (AutoFE) for tabular data requires discovering informative transformations from a large program space. Existing approaches suffer from three limitations: classical methods rely on fixed operator libraries with limited expressivity, LLM-based methods generate proposals from static prompts without retaining search experience, and evolutionary methods use fixed migration policies that ignore task-specific cross-family transfer utility. We introduce TOPOFE, a framework that formulates AutoFE as graph-structured multi-island evolutionary program search. The transformation space is partitioned into semantically coherent families, each explored by an island through LLM-guided mutation and crossover. Each island maintains a Prompt Adaptation Memory that accumulates accept/reject feedback to steer proposals toward productive regions without parameter updates. To coordinate global exploration, TOPOFE dynamically learns a directed topology graph whose edge weights encode transfer utility between transformation families. Cross-island transfer is triggered by adaptive saturation detection and performed through LLM-mediated hybrid synthesis, enabling discovery of compositional feature programs that cannot emerge from isolated local search. Experiments on 29 tabular datasets show that TOPOFE consistently outperforms most state-of-the-art AutoFE methods on classification and regression tasks. Beyond predictive performance, TOPOFE produces feature sets with lower redundancy and higher representational coverage, while the learned topology graph acquires meaningful task-specific transfer structure correlated with downstream gains. The discovered feature programs transfer reliably across diverse predictors and LLM backbones, demonstrating that improvements arise from TOPOFE's structured search and adaptive coordination rather than backbone-specific generation capability.

cs.AI↗

arXiv2026

How Do Large Language Models Learn Concepts During Continual Pre-Training?

Human beings primarily understand the world through concepts (e.g., dog), abstract mental representations that structure perception, reasoning, and learning. However, how large language models (LLMs) acquire, retain, and forget such concepts during continual pretraining remains poorly understood. In this work, we study how individual concepts are acquired and forgotten, as well as how multiple concepts interact through interference and synergy. We link these behavioral dynamics to LLMs' internal concept circuits, computational subgraphs associated with specific concepts, and incorporate graph metrics to characterize circuit topology. Our analysis reveals: (1) LLMs concept circuits provide a non-trivial, consistent signal of concept learning and forgetting; (2) concept circuits exhibit a stage-wise temporal pattern during continual pretraining, with an early increase followed by gradual decrease and stabilization; (3) concepts with larger learning gains tend to exhibit greater forgetting under subsequent training; (4) semantically similar concepts induce stronger interference than weakly related ones; (5) conceptual knowledge differs in their transferability, with some significantly facilitating the learning of others. Together, our findings provide a circuit-level view of concept learning dynamics and motivate concept-aware training strategies, such as Circuit-aware Experience Replay, which uses circuit topology to prioritize concepts vulnerable to forgetting.

cs.CL↗

arXiv2026

WebCoach: Self-Evolving Web Agents with Cross-Session Memory Guidance

Multimodal LLM-powered agents have recently demonstrated impressive capabilities in web navigation, enabling agents to complete complex browsing tasks across diverse domains. However, current agents struggle with repetitive errors and lack the ability to learn from past experiences across sessions, limiting their long-term robustness and sample efficiency. We introduce WebCoach, a model-agnostic self-evolving framework that equips web browsing agents with persistent cross-session memory, enabling improved long-term planning, reflection, and continual learning without retraining. WebCoach consists of three key components: (1) a WebCondenser, which standardizes raw navigation logs into concise summaries; (2) an External Memory Store, which organizes complete trajectories as episodic experiences; and (3) a Coach, which retrieves relevant experiences based on similarity and recency, and decides whether to inject task-specific advice into the agent via runtime hooks. This design empowers web agents to access long-term memory beyond their native context window, improving robustness in complex browsing tasks. Moreover, WebCoach achieves self-evolution by continuously curating episodic memory from new navigation trajectories, enabling agents to improve over time without retraining. Evaluations on the WebVoyager benchmark demonstrate that WebCoach consistently improves the performance of browser-use agents across three different LLM backbones. With a 38B model, it increases task success rates from 47% to 61% while reducing or maintaining the average number of steps. Notably, smaller base models with WebCoach achieve performance comparable to the same web agent using GPT-4o.

cs.AI↗

arXiv2026

Process Reward Informed Tree Rollout for Effective Multi-Turn RL

Reinforcement learning (RL) has become a key approach for training LLM agents, yet popular methods such as GRPO/RLOO rely on multiple independently sampled complete trajectories for advantage estimation. In long-horizon agentic tasks, such a uniform rollout strategy can waste budget on uninformative dead-end attempts, while promising intermediate states do not receive sufficient exploration. The multi-turn structure of agentic trajectories, with interleaved actions and observations, naturally supports organizing a trajectory group as a tree, where each turn serves as a decision point for exploration. This perspective reframes effective exploration as the problem of deciding where to branch. We propose Process-Scorer Guided Adaptive Tree Rollout (PATR), a quality-aware rollout framework for multi-turn agent RL. PATR uses task-appropriate process feedback to score partial trajectories, selectively branches from promising states, reuses shared prefixes, and conservatively stops degenerate paths to reduce wasted sampling. The resulting rollout groups remain compatible with standard policy optimization while providing more efficient exploration under the same training budget. We evaluate PATR on FrozenLake and the challenging SWE-Bench, which is largely unexplored by prior tree-rollout agent RL methods. Experiments show that PATR improves performance by up to +5.0 points on SWE-Bench and +9.3 points on FrozenLake, highlighting process-guided tree rollouts as an effective strategy for scalable multi-turn RL.

cs.CL↗

arXiv2026

LLM-ACES: Closed-Loop Discovery of Dynamical Systems with LLM-Guided Adaptive Search

Recovering governing Ordinary Differential Equations (ODEs) from data is a central challenge in modeling dynamical systems across scientific domains. Existing approaches cast discovery as a static inference problem over fixed datasets, assuming that the observed trajectories are sufficiently informative. However, dynamical systems evolve over large state spaces, and limited data can make multiple equations observationally indistinguishable, leading to identifiability gaps and the recovery of incorrect governing equations. To address this, we introduce LLM-ACES, or LLM-guided Active Closed-loop Equation Search, a closed-loop framework that jointly optimizes symbolic hypothesis construction and adaptive data acquisition. In LLM-ACES, a large language model (LLM) proposes operator priors that partition the large search space into distinct regions, within which candidate equations are fit to the observed data. The disagreement among these candidates guides the acquisition of informative trajectories, creating a feedback loop that iteratively refines both the hypothesis space and the discovered dynamics. On 122 ODE systems spanning ODEBench and ODEBase, LLM-ACES achieves the lowest median NMSE, outperforming state-of-the-art baselines by several orders of magnitude while achieving a high symbolic accuracy of 46.2% and 52.4%, respectively. Our analysis further shows that LLM-ACES is sample-efficient, achieving better performance with one-tenth the data. Furthermore, LLM-ACES's feedback-driven data acquisition makes it robust to noise and recovers the correct symbolic structure, while baselines introduce spurious terms that fit the data locally but obscure the true governing relationships.

cs.LG↗

arXiv2026

Learning with Rare Success but Rich Feedback via Reflection-Enhanced Self-Distillation

Enabling Large Language Models (LLMs) to continuously improve from environmental interactions is a central challenge in post-training. While on-policy self-distillation offers a promising paradigm, existing methods predominantly treat environmental feedback as a passive conditioning signal. Consequently, they heavily rely on successful demonstrations and struggle to learn in rare-success regimes. To bridge this gap, we introduce Reflection-Enhanced Self-Distillation (RESD), a framework that transforms raw failure feedback into an active source of corrective supervision. Instead of passively appending feedback, RESD interprets failed trajectories by generating retrospective reflections to diagnose local errors, and curates a persistent global playbook to preserve reusable lessons across training steps. The enriched context enables the self-teacher to provide actionable token-level supervision even in the absence of successful rollouts. Empirical evaluations on multiple continual learning tasks demonstrate that RESD substantially outperforms standard self-distillation baselines. Furthermore, RESD achieves significantly faster early-stage improvement than GRPO with $8\times$ samples using only a single rollout per prompt, highlighting its superior interaction efficiency.

cs.LG↗

arXiv2026

Agentic Conversational Search with Contextualized Reasoning via Reinforcement Learning

Large Language Models (LLMs) have become a popular interface for human-AI interaction, supporting information seeking and task assistance through natural, multi-turn dialogue. To respond to users within multi-turn dialogues, the context-dependent user intent evolves across interactions, requiring contextual interpretation, query reformulation, and dynamic coordination between retrieval and generation. Existing studies usually follow static rewrite, retrieve, and generate pipelines, which optimize different procedures separately and overlook the mixed-initiative action optimization simultaneously. Although the recent developments in deep search agents demonstrate the effectiveness in jointly optimizing retrieval and generation via reasoning, these approaches focus on single-turn scenarios, which might lack the ability to handle multi-turn interactions. We introduce a conversational agent that interleaves search and reasoning across turns, enabling exploratory and adaptive behaviors learned through reinforcement learning (RL) training with tailored rewards towards evolving user goals. The experimental results across four widely used conversational benchmarks demonstrate the effectiveness of our methods by surpassing several existing strong baselines.

cs.CL↗

arXiv2026

Disentangling High Harmonic Generation from Surface and Bulk States of a Topological Insulator

The discovery of topological phases has introduced a new dimension to materials science. Three-dimensional (3D) topological insulators (TIs) are a remarkable class of matter that is insulating in the bulk while hosting conductive topological surface states (TSSs) with unique charge and spin properties. High-order harmonic generation (HHG) has emerged as a powerful tool to probe condensed matter systems by providing insights into their electronic structure and dynamic behavior. Here, we investigate HHG in the prototype 3D-TI Bi$_2$Se$_3$. We demonstrate that the contributions of bulk and surface states to the harmonic emission can be controlled by tuning the thickness of thin film samples. An ultrathin (6 nm) film substantially enhances HHG from the surface states, while the bulk states dominate HHG in a thicker (50 nm) film. By applying a quasi-static terahertz perturbing field, we disentangle the bulk and surface responses and reveal the significant impact of the surface states' shift vector and Berry curvature on HHG. Our study provides effective methods for isolating the optical responses of TSSs from those of the bulk, which opens the door to resolving an ongoing debate regarding whether it is possible to reliably extract topological signatures in HHG.

cond-mat.mes-hall↗

arXiv2026

Experience as a Compass: Multi-agent RAG with Evolving Orchestration and Agent Prompts

Multi-agent Retrieval-Augmented Generation (RAG), wherein each agent takes on a specific role, supports hard queries that require multiple steps and sources, or complex reasoning. Existing approaches, however, rely on static agent behaviors and fixed orchestration strategies, leading to brittle performance on diverse, multi-hop tasks. We identify two key limitations: the lack of continuously adaptive orchestration mechanisms and the absence of behavior-level learning for individual agents. To this end, we propose HERA, a hierarchical framework that jointly evolves multi-agent orchestration and role-specific agent prompts. At the global level, HERA optimizes query-specific agent topologies through reward-guided sampling and experience accumulation. At the local level, Role-Aware Prompt Evolution refines agent behaviors via credit assignment and dual-axes adaptation along operational and behavioral principles, enabling targeted, role-conditioned improvements. On six knowledge-intensive benchmarks, HERA achieves an average improvement of 38.69\% over recent baselines while maintaining robust generalization and token efficiency. Topological analyses reveal emergent self-organization, where sparse exploration yields compact, high-utility multi-agent networks, demonstrating both efficient coordination and robust reasoning.

cs.AI↗

arXiv2026

Stepwise Penalization for Length-Efficient Chain-of-Thought Reasoning

Large reasoning models improve with more test-time computation, but often overthink, producing unnecessarily long chains-of-thought that raise cost without improving accuracy. Prior reinforcement learning approaches typically rely on a single outcome reward with trajectory-level length penalties, which cannot distinguish essential from redundant reasoning steps and therefore yield blunt compression. Although recent work incorporates step-level signals, such as offline pruning, supervised data construction, or verifier-based intermediate rewards, reasoning length is rarely treated as an explicit step-level optimization objective during RL. We propose Step-wise Adaptive Penalization (SWAP), a fine-grained framework that allocates length reduction across steps based on intrinsic contribution. We estimate step importance from the model's on-policy log-probability improvement toward the correct answer, then treat excess length as a penalty mass redistributed to penalize low-importance steps more heavily while preserving high-importance reasoning. We optimize with a unified outcome-process advantage within group-relative policy optimization. Extensive experiments demonstrate that SWAP reduces reasoning length by 64.3% on average while improving accuracy by 5.7% relative to the base model.

cs.CL↗

arXiv2026

From Pixels to Policies: Reinforcing Spatial Reasoning in Language Models for Content-Aware Layout Design

We introduce LaySPA, a reinforcement learning framework that equips large language models (LLMs) with explicit and interpretable spatial reasoning for content-aware graphic layout design. LaySPA addresses two key challenges: LLMs' limited spatial reasoning and the lack of opacity in design decision making. Instead of operating at the pixel level, we reformulate layout design as a policy learning problem over a structured textual spatial environment that explicitly encodes canvas geometry, element attributes, and inter-element relationships. LaySPA produces dual-level outputs comprising interpretable reasoning traces and structured layout specifications, enabling transparent and controllable design decision making. Layout design policy is optimized via a multi-objective spatial critique that decomposes layout quality into geometric validity, relational coherence, and aesthetic consistency, and is trained using relative group optimization to stabilize learning in open-ended design spaces. Experiments demonstrate that LaySPA improves structural validity and visual quality, outperforming larger proprietary LLMs and achieving performance comparable to specialized SOTA layout generators while requiring fewer annotated samples and reduced latency.

cs.AI↗

arXiv2026

RAG without Forgetting: Continual Query-Infused Key Memory

Retrieval-augmented generation (RAG) systems commonly improve robustness via query-time adaptations such as query expansion and iterative retrieval. While effective, these approaches are inherently stateless: adaptations are recomputed for each query and discarded thereafter, precluding cumulative learning and repeatedly incurring inference-time cost. Index-side approaches like key expansion introduce persistence but rely on offline preprocessing or heuristic updates that are weakly aligned with downstream task utility, leading to semantic drift and noise accumulation. We propose Evolving Retrieval Memory (ERM), a training-free framework that transforms transient query-time gains into persistent retrieval improvements. ERM updates the retrieval index through correctness-gated feedback, selectively attributes atomic expansion signals to the document keys they benefit, and progressively evolves keys via stable, norm-bounded updates. We show that query and key expansion are theoretically equivalent under standard similarity functions and prove convergence of ERM's selective updates, amortizing optimal query expansion into a stable index with zero inference-time overhead. Experiments on BEIR and BRIGHT across 13 domains demonstrate consistent gains in retrieval and generation, particularly on reasoning-intensive tasks, at native retrieval speed.

cs.IR↗

arXiv2026

LLMs as Layout Designers: Enhanced Spatial Reasoning for Content-Aware Layout Generation

While Large Language Models (LLMs) have demonstrated impressive reasoning and planning abilities in textual domains and can effectively follow instructions for complex tasks, their ability to understand and manipulate spatial relationships remains limited. Such capabilities are crucial for content-aware graphic layout design, where the goal is to arrange heterogeneous elements onto a canvas so that final design remains visually balanced and structurally feasible. This problem requires precise coordination of placement, alignment, and structural organization of multiple elements within a constrained visual space. To address this limitation, we introduce LaySPA, a reinforcement learning-based framework that augments LLM-based agents with explicit spatial reasoning capabilities for layout design. LaySPA employs hybrid reward signals that jointly capture geometric constraints, structural fidelity, and visual quality, enabling agents to navigate the canvas, model inter-element relationships, and optimize spatial arrangements. Through group-relative policy optimization, the agent generates content-aware layouts that reflect salient regions, respect spatial constraints, and produces an interpretable reasoning trace explaining placement decisions and a structured layout specification. Experimental results show that LaySPA substantially improves the generation of structurally valid and visually appealing layouts, outperforming larger general-purpose LLMs and achieving performance comparable to state-of-the-art specialized layout models.

cs.AI↗

arXiv2026

Exploring LLMs for Scientific Information Extraction Using The SciEx Framework

Large language models (LLMs) are increasingly touted as powerful tools for automating scientific information extraction. However, existing methods and tools often struggle with the realities of scientific literature: long-context documents, multi-modal content, and reconciling varied and inconsistent fine-grained information across multiple publications into standardized formats. These challenges are further compounded when the desired data schema or extraction ontology changes rapidly, making it difficult to re-architect or fine-tune existing systems. We present SciEx, a modular and composable framework that decouples key components including PDF parsing, multi-modal retrieval, extraction, and aggregation. This design streamlines on-demand data extraction while enabling extensibility and flexible integration of new models, prompting strategies, and reasoning mechanisms. We evaluate SciEx on datasets spanning three scientific topics for its ability to extract fine-grained information accurately and consistently. Our findings provide practical insights into both the strengths and limitations of current LLM-based pipelines.

cs.AI↗