Papers

Automating theoretical research requires generating candidate results and evaluating them reliably. Models keep getting better at the first, while the second remains hard. A common approach asks one large language model (LLM) to review what another produced, yet such reviewers are empirically unreliable: they may accept fabricated papers and catch the fabrication at close to chance rates~\citep{badscientist2025}. We present CausalSmith, a framework for automated theoretical research in causal inference built on the Lean proof assistant, where a proof is checked by a program rather than read by a referee. CausalSmith rests on Causalean, a foundational Lean library for causal inference holding 8,179 machine-checked definitions and theorems, developed with language-model assistance under human design and review. Around it, we build a self-improving agentic pipeline that selects research topics, proposes results, formalizes statements, constructs proofs, and presents the resulting artifacts for human inspection. Moreover, the pipeline pairs Lean verification with a statement audit that compares each formal theorem against the informal claim behind it. We evaluate the system using artifacts produced by completed autonomous research runs. The source code, formal library, and run records are available at https://github.com/Jiyuan-Tan/CausalSmith.

Low-Rank Adaptation (LoRA) has become a widely adopted technique for efficient neural network fine-tuning, decomposing model updates into low-rank matrices. However, LoRA remains computationally costly because it updates all matrices uniformly, regardless of their actual contribution to adaptation. This cost is especially prohibitive for large-scale models with billions of parameters and for resource-constrained settings such as edge deployment and on-device fine-tuning. We show for the first time that not all LoRA matrices are equally worth tuning: matrices with smaller condition numbers (the ratio of largest to smallest singular value) are already well-balanced across directions and contribute only marginally to adaptation, whereas matrices with larger condition numbers contain underdeveloped directions that span richer subspaces and drive most of the performance gains. This observation itself is a key contribution of our work, and it motivates a more selective approach to fine-tuning. Building on this insight, we propose ąppa}-LoRA, a method that optimizes LoRA by focusing updates on the matrices with the largest condition numbers, which capture the most informative directions of change. By restricting LoRA updates to the top 50% of weight matrices ranked by condition number, ąppa}-LoRA halves the trainable parameter count and correspondingly reduces compute and memory cost. Extensive experiments across multiple benchmarks show that this design cuts fine-tuning time by 16.2% on average while matching the accuracy of standard LoRA and reducing memory cost by 4.5%. Further analysis reveals that the condition numbers of the selected matrices consistently decrease over training, suggesting that ąppa}-LoRA's effectiveness stems from targeted spectral rebalancing rather than parameter selection alone.

Large Language Model (LLM)-based Test-Driven Development (TDD) has advanced automated code generation. However, existing approaches depend heavily on human-crafted test cases and cannot operate effectively when only natural-language requirements are available. Although recent work enables automatic test generation, it often overlooks the inherent stochasticity of LLMs, leading to two key defects: faulty tests generate misleading feedback that distorts code optimization, while mixed-quality test cases produce conflicting evaluation signals that hinder reliable code selection. To address these challenges, we propose MineValiCoder, a collaborative closed-loop TDD framework based on the mutual reinforcement of test-case quality and code quality. MineValiCoder comprises three modules. The Test Case Quality Mining (TCQM) module filters faulty test cases through self-validation, providing reliable optimization supervision. The Parallel TDD Refinement module iteratively optimizes code and generates diverse high-quality code candidates using validated test-case feedback. The Bipartite Graph-Based Code-Test Mutual Validation (BiCoTeV) module dynamically models code-test interactions and performs mutual validation scoring for stable and reliable optimal-code selection. Extensive evaluations across four LLMs and mainstream benchmarks show that MineValiCoder significantly outperforms state-of-the-art methods. Specifically, it achieves Pass@1 scores of 96.34% on HumanEval, 87.40% on MBPP, 64.00% on APPS, and 51.33% on LiveCodeBench. These results demonstrate the effectiveness of MineValiCoder in mitigating LLM stochasticity and improving the reliability of automated code generation.

Quantum state preparation is a key component of many quantum algorithms. Performing this step efficiently is essential for realizing practical quantum advantage in quantum chemistry applications. Iterative algorithms like ADAPT-VQE can produce shallow ground-state preparation circuits, but become computationally prohibitive for the larger molecules relevant to materials science and pharmaceutical development. Here, we introduce ADAPT-GQE, a generative AI framework that learns to synthesize ground-state preparation circuits for electronic structure calculations. We first use ADAPT-VQE to generate high-quality reference circuits, which are then used as targets for training models for circuit generation. Once trained, the model can efficiently propose and score circuits, enabling reinforcement learning (RL) to drive circuit generation accuracy beyond the accuracy of the ADAPT-VQE training data. This pipeline achieves order-of-magnitude reductions in circuit generation time relative to ADAPT-VQE while maintaining comparable or improved state-preparation accuracy. We demonstrate ADAPT-GQE on imipramine, a well-established tricyclic antidepressant that serves as a representative, challenging target for computational modelling in drug stability protocols. We execute generated circuits on Quantinuum Helios-1, representing a milestone for AI-generated quantum chemistry circuits on state-of-the-art quantum hardware. These results establish a pathway toward automated quantum circuit synthesis for utility-scale quantum computational chemistry.

Modern enterprise agent deployments consist of a heterogeneous pool of large language models (LLMs) having diverse capabilities and cost. Existing model routing strategies optimize the quality-cost trade-off, while providing request-level static decisions. More recent solutions address agentic routing as a task-level selection with a serial verifier based router feedback loop. However, their fixed verifier suitable for homogeneous workloads may not generalize to heterogeneous batches of agentic tasks (example: coding, general conversational). Additionally, due to the verifier placement in the critical path of the loop, serving quality may be affected during multiple concurrent requests routing. To mitigate these issues, we present ORACLE. It is a concurrency-aware online routing mechanism that aligns adaptive routing with adaptive verification for feedback. ORACLE acts as a training-free drop-in 'feedback loop' on top of any model-selection policy to first classify the task type and then dynamically assigns a task-appropriate verifier. Further, we develop a delayed feedback strategy for concurrent requests that largely removes verifier latency from the dispatch critical path. We then present a post-routing dispatch scheduler, namely DISC. DISC reserves each task's peak KV footprint at admission and dispatches to an alternate backend when the reward gain from reduced wait exceeds the reward loss from lower accuracy. Extensive evaluation on SWE-bench, tau2-bench, and Terminal-Bench 2.0 shows that ORACLE improves the accuracy-cost frontier by up to 7 percentage points over state-of-the-art routing baselines, while ORACLE with DISC improves program throughput by up to 1.8x. To facilitate reproducibility and support future development, we open-source the code-base of ORACLE at https://github.com/ORACLE-org/ORACLE.

Generative AI is reshaping programming education, yet educators often infer students' AI-supported learning from classroom observations alone. This experience report presents a trio-ethnography involving two computing educators with different teaching philosophies and one undergraduate computer science student to examine how these interpretations evolve through dialogue. Across three conversations, the educators reflected on students' AI use, discussed changes to programming pedagogy, and revisited their assumptions after engaging with the student's lived experiences. Rather than simply confirming or contradicting the educators' perspectives, the student's narratives revealed learning processes that were largely invisible in the classroom, prompting both educators to reconsider assumptions about AI use, assessment, transparency, and programming instruction. We argue that trio-ethnography offers a valuable reflective approach for helping computing educators move beyond observable student behaviors toward a richer understanding of AI-supported learning and for informing instructional adaptation in the era of generative AI.

Do learned audio embeddings encode structure that nobody told them to encode? We probe four large pretrained audio models (AST, CLAP, BEATs-bio and BirdNET) with a downstream task none of them saw during training: recovering phylogenetic distance from species vocalizations. If the geometry of the embedding space tracks the tree of life, the representation is picking up something deeper than the labels the model was optimized for. We run Mantel tests across two independent radiations. In 32 marine mammal species (1,754 recordings from the Watkins Marine Mammal Sound Database) the foundation models recover strong phylogenetic signal within the 26 cetaceans (CLAP r=0.82, BEATs-bio r=0.82, AST r=0.74; all p<0.001), among the highest acoustic-phylogenetic correlations reported for any taxon. Hand-crafted MFCC features (105d) find nothing (r=0.040, p=0.338). The gap survives after PCA-projecting every embedding down to 105 dimensions, so it is not an artefact of representation size. It also survives a partial Mantel test controlling for dominant frequency (partial Mantel r=0.404, keeping 97% of the variance explained), so it is not just pitch in disguise. We repeat the analysis on 20 bird species using the Jetz et al. (2012) phylogeny, and this time add BirdNET, a classifier trained end-to-end on around 6,000 bird species. The general-purpose foundation models recover the signal again (AST r=0.55, CLAP r=0.52). The unexpected result is that neither BirdNET nor the bioacoustic BEATs-bio beat them (r around 0.32 to 0.36). Matching the training domain to the target taxon does not, by itself, help. Pretrained audio embeddings carry evolutionary information across two independent radiations, and domain-specific pretraining is not required for it to emerge.

Enterprise AI agents are typically granted static credential sets at configuration time, holding every tool the role might need for every task they perform. This persistent over-privilege expands the attack surface. We argue that capability scoping must follow a dynamic least-privilege principle and be treated as a prevention mechanism before a detection one. A credential that does not exist in an agent's context cannot be misused regardless of the agent's reasoning or evasion sophistication. We outline a three-source architecture instantiating this principle: role-based ceilings, a task-context classifier, and policy-derived combination prohibitions creating a layered proactive defense against LLM agent misalignment and misuse cases. The architecture supports both enforcing and observe-only deployment; the latter records agent permission requests inconsistent with task context, producing a behavioral signal usable in misalignment research. As a first step toward evaluating this architecture, we contribute a synthetic dataset of 600 enterprise task prompts grounded in a multi-department company policy, labeled with minimum required permissions across a 15-permission tool-based taxonomy that maps directly to deployable credentials or enforceable guardrails. The dataset is constructed via a two-pass pipeline that separates prompt generation from permission labeling to avoid circularity, and is validated against a 60-record/688 decisions human-reviewed sample (Cohen's $\kappa = 0.917$ pre-review and $\kappa = 0.967$ post-review). Iterating between dataset and policy reduced ceiling violations from 46 to 3, a 93% reduction. This shows that synthetic prompt generation can drive policy refinement when the two are developed together. The dataset, environment specification, and generation pipeline are released to support evaluation of dynamic scoping mechanisms.

For scale-invariant deep networks, Hyperball-style optimizers have shown strong performance in large-scale training by fixing the norms of matrix-valued parameters and normalizing updates. However, the source of their advantage remains unclear. Starting from the angular displacement between consecutive parameter states, we derive an angular effective learning rate that accounts for the parameter-update angle, parameter norm, and update norm. We also show that the conventional norm-based measure is a special case under parameter-update orthogonality. We then decompose optimizer updates into radial and tangential components and analyze how radial updates affect one-step angular displacement. Under the training configurations considered, numerical results show that the radial component has only a limited direct effect on the angular effective learning rate. It therefore cannot explain why MuonH converges more slowly than MuonWD early in training but overtakes it later. To further isolate the underlying mechanism, we devise a heuristic experiment that modifies only the learning-rate schedule so that the dynamics of each optimizer reproduce those of the other. The results suggest that their main difference stems from the evolution of the effective step size rather than an intrinsically superior update direction induced by Hyperball. Our pretraining experiments further show that more aggressive learning-rate decay can accelerate MuonH early in training but may impair its later performance. Thus, maintaining a constant angular velocity does not eliminate the learning-rate-scheduling problem; careful scheduling remains essential to realizing the potential of Hyperball-style optimizers. Our code is publicly available at https://github.com/mangocrazz/hyperball-may-not-be-a-free-lunch.

Humans routinely communicate through abstractions of their bodies, including shadows, silhouettes, and reflections. Yet robots remain largely confined to expressing themselves through their physical morphology. Enabling robots to communicate through such projected visual abstractions requires reasoning not only about bodily motion but also about how that motion is transformed into an external representation perceived by an observer. Among these abstractions, shadows provide a particularly compelling example because they emerge directly from the robot's embodiment while remaining visually distinct from the body itself. Here, we present a robotic system capable of dynamic shadow expression using a 21-degree-of-freedom dexterous hand with compliant soft skin and a learned shadow self-model. The soft-skinned embodiment reduces light leakage to produce visually continuous silhouettes, while the differentiable self-model learns the mapping between hand configurations and projected shadow appearance through task-agnostic self-exploration. Given a target shadow image or video, the robot optimizes its hand configurations through gradient-based search over 1 the learned self-model and refines the solution through collision-aware simulation to obtain physically feasible motions. For dynamic shadow performance, we further introduce expressive-region objectives, temporal smoothness regularization, and keyframe-based optimization to preserve visually important motion cues while reducing optimization complexity. We demonstrate robotic shadow expression across sign-language gestures, hand-shadow puppetry, and animal motion imitation in both simulation and physical experiments. These results establish a framework for enabling robots to manipulate projected visual abstractions of themselves for communication and visual storytelling.

Explainable AI (XAI) in creative practice can be less about technocentric explanation and more about enabling artists to inspect modify and debug models as part of making Yet largescale texttoimage diffusion systems are typically presented as opaque endtoend tools limiting this kind of material engagement We argue that even large models can function as creative materials when their internal structure is made visible and manipulable To support this we propose a handson approach to explainability centred on experimentation and intervention We instantiate this approach with a model bending and an interactive (inspection) interface integrated into ComfyUIs nodebased workflow including interactive layer selection and intervention controls Through qualitative and quantitative analysis of bending interventions in Stable Diffusion 15 we show how manipulating specific components of a diffusion pipeline produces relatively consistent families of visual effects allowing artists to build practical layerlevel intuition about how different parts of the model shape generated images

Accurate on-device fluid identification is essential for microfluidic applications, yet maintaining reliability under varying flow, pressure, and temperature remains a key challenge. Existing learning-based methods often treat sensor signals as domain-agnostic features, neglecting the underlying physical relationships that govern fluid behavior, thereby limiting generalization and interpretability. To address this, we propose PRIMS, a physics-aware multimodal Transformer that integrates physical knowledge into representation learning and attention mechanisms through three dedicated modules: (1) Physics-based Token Vectorization transforms raw Coriolis and pressure sensor signals into physically meaningful token embeddings; (2) Physical Component Synthesizer models viscosity-related dependencies among flow, pressure, and density; and (3) Physics-guided Fusion captures cross-physical correlations through attention-based integration. By embedding these physics-based relationships directly into the model architecture, PRIMS bridges analytical fluid mechanics and deep learning, enabling interpretable, data-efficient, and resilient fluid classification. Evaluations on a five-fluid benchmark under dynamic flow, pressure, and temperature conditions show that PRIMS achieves 98.92% average F1-score with only 0.46 million parameters, a 14 times reduction compared to state-of-the-art Transformer-based methods. PRIMS also consistently outperforms prior SOTA models under out-of-distribution shifts to unseen temperature ranges and unseen flow-rate ranges, indicating strong robustness to operating conditions not observed during training. These findings suggest that designing architectures that explicitly mirror governing physical relationships can make them learn transferable, environment-independent representations, improving real-world reliability for microfluidic sensing.

Large Language Models (LLMs) are increasingly deployed as autonomous agents, transitioning from static conversational interfaces to dynamic systems capable of complex reasoning, tool execution, and decision-making. However, the operational reliability of these agentic AI systems is fundamentally challenged by the absence of reliable ground truth in open-ended environments and the risk of increasing operational drift over time. To address this challenge, we propose and experimentally evaluate an agentic AI framework, designed to enforce autonomous integrity within LLM-driven systems. We design a self-calibration mechanism that mitigates drift and dynamically approximates ground truth by incorporating an ARIMA forecaster, without requiring continuous human oversight. To demonstrate the effectiveness and reliability of our methodology, we apply it to the complex domain of profiling the resource usage of zero-knowledge workloads in edge computing networks. Experimental results show that the proposed self-calibrating agentic framework successfully profiles the zero-knowledge workloads, achieving a higher accuracy than baseline LLM agents by 91.7% for resource usage prediction and improving the prediction speed by 71.7% compared to pure profiling, establishing a robust foundation for deploying autonomous AI in decentralized infrastructures. Furthermore, the ground truth generation using the proposed ARIMA leaping algorithm is 52% faster than a standard ARIMA forecasting algorithm, while achieving the same accuracy.

Vision-language model (VLM) agents increasingly use tools to act on 3D scenes rather than only describe them. Existing 3D benchmarks score textual responses or single-object operations, leaving agent action on complete multi-object 3D scenes under evaluated. We present SceneActBench, a benchmark for visually conditioned action across five 3D tasks under a unified agent-environment loop. Given PNG images or sampled video frames and, where applicable, supplied 3D assets, an agent acts on a 3D environment. We evaluate each final output against hidden ground truth with task-specific geometric metrics. SceneActBench comprises five tasks built from 210 source instances, yielding 520 task cases including paired input conditions. Every task runs through one fixed agent loop to keep the comparison fair. Across eleven proprietary VLM configurations, Overall scores span 38.6-50.2, and none performs consistently well across tasks. We further analyse where and how failures manifest.

With the rapid adoption of long-context large language models (LLMs), the continuously growing KV cache during decoding has become the critical memory bottleneck. To tackle this challenge, we propose HiKV, a novel algorithm-hardware co-design that exploits KV cache redundancy through hierarchical importance awareness. Algorithmically, HiKV compresses the KV cache at two granularities: Stage I evicts unimportant tokens within a fixed budget, and Stage II further loads only the significant elements of each retained token, reaching compression ratios unattainable at a single granularity. Architecturally, we develop a dedicated accelerator centered on a reconfigurable importance sorter that switches between the distinct sorting datapaths each stage requires, unifying the two-stage acceleration in one circuit with minimal overhead. Evaluated on representative LLMs, HiKV achieves up to 7.95x speedup and 90% energy reduction in the attention computation over the vanilla KV cache baseline within negligible 1% accuracy loss. Under iso-accuracy constraints, HiKV outperforms state-of-the-art importance-based methods by achieving an additional 1.82~4.87x reduction in external memory accesses. These benefits are enabled by specialized hardware components that add only 8% to the system area.

Diagnosing the root cause of anomalies is essential for safe industrial operation. Despite extensive sensor instrumentation, formulating hypotheses and gathering evidence remains a manual process, creating a major operational bottleneck. While existing data-driven approaches aim to automate this, two critical limitations restrict their deployment: their operate as black boxes unable to justify their diagnosis, and they require scarce labeled examples of faulty operation. To address this gap, we introduce AgentRCA, a zero-shot agentic framework for evidence-grounded root cause analysis. Rather than learning fault-specific mappings, AgentRCA performs inference-time reasoning by combining a data-driven digital twin (modeling normal system dynamics) with a tool-augmented large language model. The agent iteratively gathers statistical evidence, evaluates competing hypotheses, and identifies the physical fault that best explains the observed behavior. Evaluated on a real-world multiphase-flow facility and a large-scale chemical plant, AgentRCA achieves diagnostic performance competitive with fully supervised baselines without relying on fault-specific training. Crucially, it produces transparent reasoning traces that explicitly link observed symptoms to their underlying physical causes. These results establish autonomous hypothesis-driven reasoning as a practical foundation for scalable industrial root cause analysis.

Large Language Models (LLMs) have significantly advanced the automation of scientific discovery. However, existing systems share a core limitation: they optimize ideas independently for either Quality or Diversity. This often results in closely related ideas or large sets of trivial, unsound, or unclear concepts. We instead argue that research ideation should be framed as a conjunction of Quality and Diversity objectives, i.e., a Quality-Diversity (QD) search. Accordingly, we introduce IDEAgent, a multi-agent framework that tracks idea evolution through lineages. We jointly drive Quality using multi-objective feedback for repair and refinement, while Diversity is achieved through lightweight sequential memory and explicit comparison against completed ideas, historical variants, and rejected proposals. To evaluate this joint objective, we develop Yield, a metric that computes the largest mutually diverse set of ideas satisfying predefined quality thresholds. Across 32 topics spanning 8 CS domains, IDEAgent outperforms the best baseline by 3.89x on Yield, while achieving Yield of at least 2 on 8x as many topics. We further analyze quality improvements, showing that repair and refinement improve logical rigor and clarity while preserving non-obviousness. Lastly, we extend IDEAgent to two algorithm discovery tasks for verifiable quality judgment and find that it still consistently outperforms all baselines, and yields the largest set of high-quality and diverse programs that beat a trivial/standard baseline. To encourage future research on QD-search-based ideation, we open-source IDEAgent at https://github.com/declare-lab/IDEAgent.

Agent benchmarks increasingly evaluate repository editing, web research, terminal use, and long-horizon interaction. Their scores support capability claims only when the evaluation protocol keeps the intended capability necessary for success. Recent reward-hacking benchmarks and system reports show that agents can instead recover public solutions, read evaluation artifacts, infer generator structure, manipulate feedback, or benefit from invalid scoring paths; existing responses do not provide a common procedure for attributing these shortcuts and quantifying their effect across benchmarks. We formulate protocol validity and introduce HackDetect, a post-hoc audit that identifies an exposure, determines how the agent used it, and assesses whether the resulting score is misleading. We quantify score inflation with the Mislead gap, defined as the exploit score minus the intended score. We audit 2,385 traces across 15 agent benchmarks and find evidence of exposures and reward hacking in 67.0% of Frontier Science traces and 66.7% of AutoLab tasks. Across paired comparisons, we measure score inflation of 0.45-1.00, showing that benchmark reports should provide evidence that scores reflect the intended capability.

Feature-attribution methods assign scores relating input variables to a model's output, but do not by themselves characterize how explicitly defined interaction operators compose across its intermediate layers. We introduce interior interpretability, a propagation-based perspective on internal model organization, and instantiate it for tabular Transformers using attention rollout. We interpret rollout as a row-stochastic operator encoding attention-mediated propagation between feature tokens. By applying classical Doeblin–Dobrushin contraction theory, we show that a rollout operator with a small Dobrushin coefficient is quantitatively close to a rank-one stochastic matrix whose common row is determined by its normalized column sums. This result gives a structural interpretation to the corresponding rollout propagation profile. In Transformers trained for metabolomic age prediction, the measured rollout contraction strengthens with depth. Trained and randomly initialized models also exhibit different propagation profiles, although the present experiments do not establish the predictive relevance of individual rollout-ranked variables. Exploratory comparisons with PCA and GradientExplainer approximations to SHAP reveal localized agreement among highly ranked variables but weak agreement across complete rankings. Attention rollout is therefore used here as a diagnostic of attention-mediated propagation, not as a causal explanation or faithful attribution of the complete Transformer.

High-complexity operational environments require methods that characterize temporally distributed patterns rather than classify isolated events. This paper introduces TRACTA (Temporal Reasoning and Capability-Trajectory Analysis), a knowledge-aligned synthetic benchmark for temporal structural reasoning, instantiated through Multi-Domain Operations (MDO)-like scenarios. TRACTA defines offline structural annotations over contextual direct-impact and accumulated capability trajectories and evaluates three tasks: early_warning, pattern_detection, and run_classification. The frozen comparison includes raw-event neural references, a contract-lite rule comparator, and a recurrent semantic-input reference. The semantic-input recurrent reference has the highest aggregate macro-F1 point estimates, with the largest margins on the two temporal tasks, while raw-event references remain predictive and lead in four individual early-warning target–lead settings. Component-zeroing diagnostics show that both semantic trajectory blocks contain useful signal within the evaluated recurrent configuration. Run-local aliasing removes stable cross-run target and location identities from the primary raw input, although executed diagnostics retain shallow predictivity. These results are configuration-level: semantic inputs are aligned with the benchmark's target-generation space, and the evaluated systems also differ in architecture, training, and available information. TRACTA therefore provides a reproducible testbed for examining knowledge-aligned temporal prediction, not evidence of a causal representation advantage, statistically resolved superiority, or operational readiness.

We study information bottlenecks in modern deep-learning architectures – RNNs, softmax transformers, linear-attention transformers and state-space models – through the lens of the indexing primitive. In this primitive, the input consists of $n$ bits and one integer $i$ from $1$ to $n$ called the index, and the output equals the value of the $i$-th bit. We introduce causal complexity for masked architectures. We show that architectures with low causal complexity cannot solve the indexing primitive in any constant number of layers when the index appears at the end of the input. In particular, this limitation applies to low-parameter RNNs, SSMs and masked linear-attention transformers. In contrast, small softmax transformers can solve it in one layer, while non-masked linear-attention transformers can solve it in 2, which separates them from their masked counterparts. In turn, when the index appears at the beginning, we show that small RNNs are capable of solving this task in 1 layer, while all the other architectures require 2. All our impossibility results are unconditional and apply even to models that employ infinite-precision real arithmetic. Moreover, experiments for up to $n=64$ qualitatively align with our theory: configurations with low-parameter theoretical solutions learn the indexing task easily, while configurations that do not admit such theoretical solutions struggle to learn as the sequence length grows.

Inferring physical properties such as mass, stiffness, and elasticity from a single image is essential for simulation and embodied AI, yet most existing approaches rely on multi-view reconstruction or physics-based supervision. We introduce SiPhy, a unified framework for single-image physical property reasoning that aligns 3D-aware visual cues, depth with language-based material knowledge. From one RGB image, SiPhy samples pseudo-voxel points, extracts CLIP features, and grounds them to material candidates proposed by a VLM. A part-based contrastive aggregator enforces region consistency, while a heaviness-aware refinement improves thickness and volume estimation for dense objects. Across ABO-500, MVImgNet-100, and PhysXNet-100, SiPhy achieves state-of-the-art single-image performance, surpassing multi-view reconstruction methods by improving mass MnRE by up to 93% (vs. PUGS), reducing density MAE by 35.5% (vs. NeRF2Physics), and lowering Young's modulus error by 23.5%. We further validate SiPhy on real hand-object interaction datasets, demonstrating its potential as a data annotation engine for physical understanding from single-view imagery.

We introduce time-reversed imaging, a new paradigm that infers what just happened in a scene from fading multimodal traces. Instead of extrapolating or interpolating video frames, our goal is to infer past human-environment interactions from residual physical imprints observable in thermal, ultraviolet, and visible spectra. To study this problem, we present TRACE-HEI, the first proof-of-concept dataset for time-reversed imaging, containing synchronized tri-modal video sequences of actions such as sitting, touching, moving objects, and liquid spills, captured across diverse materials and recorded up to three minutes after contact. To establish the benchmark, we propose a multimodal inference approach that extracts structured textual descriptions of detected traces and uses them to constrain a vision-language-guided diffusion model for reconstructing plausible past frames. Experiments show that inferring recent events from fading traces is challenging but feasible when complementary modalities reduce solution ambiguity. This work defines the first computational and experimental foundation for time-reversed imaging, bridging vision, physics, and generative reasoning, and opening new directions for scene understanding beyond instantaneous observation.

Generative social robots (GSRs) powered by large language models offer new possibilities for personalized tutoring in higher education, but also introduce risks related to misinformation, missing transparency, or reinforcing incorrect student responses. Prior work identified knowledge-based design (KBD) requirements that define the informational prerequisites for GSRs to manifest responsible and effective tutoring behavior in higher education. In this paper, we operationalized selected KBD requirements in the Reachy Mini robot platform through system prompting, retrieval-augmented generation, and stateful prompt orchestration. As a result, we present Teachy Mini, a GSR tutoring system that was developed using KBD. To test the system, we conducted a preliminary evaluation study. Participants (N = 24) completed a robot-guided learning session about research methodologies. They learned either with Teachy Mini or with a control version that did not follow KBD principles. Teachy Mini was perceived as significantly more aligned with responsible tutoring behavior than the control robot. Moreover, a manipulation check illustrated that Teachy Mini used personalization, slide-grounded explanations, Socratic questioning, affective support, and learner-anchored feedback more consistently than the control robot. No significant between-condition differences were found in system acceptance, intrinsic motivation, or learning effectiveness, although exploratory analyses suggested a positive effect of KBD on objective learning gains when accounting for learner preferences. Overall, the study offered an initial implementation and preliminary evaluation of KBD for GSR tutoring, indicating that KBD can shape responsible robot behavior and potentially increase learning effectiveness in robot-supported learning.

Open-weight language models from different families exhibit complementary capabilities, motivating their consolidation into a compact student through on-policy distillation (OPD). However, full-vocabulary OPD typically assumes a shared tokenizer, while existing cross-tokenizer methods may discard teacher probability mass or assign it to student tokens with unrelated content. We introduce Byte-Prefix Marginalization (BPM), which re-expresses the teacher's next-token distribution over the student vocabulary in a shared byte space. Specifically, BPM assigns each teacher token's probability to the longest student token whose byte representation is a prefix of the teacher token's bytes, aggregates mass mapped to the same student token, and places otherwise unmatched mass in an explicit residual category. This produces a vocabulary-complete, byte-aligned, and mass-preserving target for dense OPD. The target exactly recovers the teacher-induced byte-prefix marginal when the relevant prefix does not span multiple teacher tokens (a condition satisfied at more than 99% of training positions) and uses a mass-preserving, chain-factorized lower bound otherwise. Across Qwen3-32B, GLM-Z1-9B-0414, and MiniMax-M2.7 as teachers, BPM consistently outperforms current cross-tokenizer methods on six mathematics and programming benchmarks, improving six-benchmark avg@8 by 3.7-6.6 points over the strongest baselines.

Large language models (LLMs) and AI agents have demonstrated strong potential for data integration in zero-shot and few-shot settings. However, they continue to face significant accuracy and cost challenges in enterprise environments due to a persistent knowledge gap. This paper envisions trustworthy, scalable, and cost-efficient integration through knowledge-grounded LLMs and agents operating within a retrieval-augmented generation (RAG) workflow. Here, trustworthiness refers to evidence-grounded, verifiable reasoning, where integration decisions are transparently supported by retrieved knowledge, robust against hallucination, and consistent across tasks. We trace the evolution from classic RAG to GraphRAG and KG-RAG (knowledge graph-based RAG), highlighting how these paradigms bridge parametric and contextual knowledge. Building on this trajectory, we explore the shift toward Agentic RAG, where autonomous multi-agent systems adaptively plan, retrieve, refine, and reason for complex integration tasks. We examine optimization strategies for cost-efficient integration, addressing computational bottlenecks in large-scale enterprise settings. Finally, we outline open challenges and future directions toward building reliable, explainable, and scalable knowledge-grounded integration systems.

Much research on responsible AI aims to change the behavior of AI systems that billions of people use. Pluralistic value alignment—the goal of building AI systems that represent and serve diverse human values and perspectives—has emerged as one such active research agenda. Yet, in an audit of the major frontier labs and open-weight developers, we find no public evidence that it has shaped how their models are trained or evaluated. Pluralistic alignment requires adoption to achieve its main goals, so we identify three barriers and lay out a roadmap of research to address each: 1. The justifications for pluralistic alignment so far are mostly normative or theoretical. Studies are needed that measure the benefits and drawbacks of pluralistic AI for users and society. 2. The pluralistic alignment research community has not settled when pluralistic behavior is warranted or what it should look like in practice. Research is needed to specify this behavior concretely enough for developers to operationalize. 3. Existing pluralism evaluations and methods are not ready for deployment. Evaluations and methods are needed that report their effects on other model properties and meet the requirements of production systems. These barriers are not unique to pluralistic alignment, so our roadmap applies to other areas of responsible AI research with similar theories of change. As people hand more decisions to AI systems and AI agents act on their behalf, we hope our roadmap helps this research reach the deployed models making those decisions.

Compressible multiphase flows involving shocks and material interfaces arise in applications such as bubble collapse and droplet breakup, where strong nonlinear interactions produce complex interface deformation, mixing, and multiscale dynamics. Developing reliable machine learning surrogates for these flows remains challenging due to the simultaneous presence of compressibility, sharp discontinuities, and multiphase effects. In this work, we introduce the first large-scale benchmark specifically designed for shock-driven compressible multiphase flows, comprising 3 TB of high-fidelity 2D and 3D datasets featuring shock-induced bubble collapse and droplet breakup. We evaluate diverse surrogate model families on our benchmarking framework: Neptuna, including convolutional, spectral, transformer-based, and pre-trained PDE foundation models. Beyond standard MSE training, we investigate composite losses that combine MSE with Sobolev, interface-aware, and structure-aware terms, along with adaptive loss balancing using SoftAdapt and GradNorm. Evaluation includes pointwise, spectral, feature-focused, structural, and physics-informed metrics. Results show that no single model performs best across all datasets and metrics, while composite losses significantly improve interface preservation and spectral fidelity. Among adaptive weighting strategies, SoftAdapt provides the most consistent improvements with almost no overhead compared to MSE-only training. The benchmarking repository and the dataset are made available at \url{https://tumaer.github.io/Neptuna/}

A data-driven inverse optimization problem (DDIOP) is the problem of estimating the objective-function parameters (weights) that explain observed optimal-solution data, and it arises in many applications, including integer linear programming (ILP). It is known that, by applying gradient-based optimization methods to the suboptimality loss, the inverse optimization of ILPs can be solved exactly within finitely many oracle iterations, and that the required number of iterations is bounded as $T=O(1/\gamma(\ell_{\mathrm{sub}})^2)$ in terms of a problem-dependent geometric constant $\gamma(\ell_{\mathrm{sub}})$. However, no means of bounding $\gamma(\ell_{\mathrm{sub}})$ from below as a function of the problem size has been available, and hence the number of iterations could not be given as an explicit function of the problem size. We therefore give, when the forward problem is an integer linear program (ILP), the number of iterations sufficient for projected subgradient descent applied to the suboptimality loss to achieve exact consistency with the observed data, as a fully explicit function of the number of samples, the dimension of the features, the ranges of the features, and the structure of the constraint coefficient matrix, up to polynomial factors in the basic constants (the diameter of the weight set, the step-size parameter, and the Lipschitz constant of the suboptimality loss).

Reuse-based development has become increasingly important in the creation of complex systems, offering significant opportunities to reduce costs, improve quality, and accelerate time-to-market. Product Line Engineering (PLE) provides a systematic approach to realizing this potential by enabling the efficient creation, management, and customization of product families by reusing shared assets and capabilities. PLE involves addressing numerous complex decisions, including feature selection, variability management, and configuration optimization, which are critical to the success of a product line. Despite its promise, the systematic integration of Artificial Intelligence (AI) into PLE processes has not yet been comprehensively explored. In this paper, we propose a methodological framework to support the systematic integration of AI into PLE and evaluate its effectiveness through a multi-case study conducted in an industrial context.