Improving energy efficiency in industrial foundry processes is a critical challenge, as these operations are highly energy-intensive and marked by complex interdependencies among process variables. Correlation-based analyses often fail to distinguish true causal drivers from spurious associations, limiting their usefulness for decision-making. This paper applies a time-series causal inference framework to identify the operational factors that directly affect energy efficiency in induction furnace melting. Using production data from a Danish foundry, the study integrates time-series clustering to segment melting cycles into distinct operational modes with the PCMCI+ algorithm, a state-of-the-art causal discovery method, to uncover cause-effect relationships within each mode. Across clusters, robust causal relations among energy consumption, furnace temperature, and material weight define the core drivers of efficiency, while voltage consistently influences cooling water temperature with a delayed response. Cluster-specific differences further distinguish operational regimes: efficient clusters are characterized by stable causal structures, whereas inefficient ones exhibit reinforcing feedback loops and atypical dependencies. The contributions of this study are twofold. First, it introduces an integrated clustering-causal inference pipeline as a methodological innovation for analyzing energy-intensive processes. Second, it provides actionable insights that enable foundry operators to optimize performance, reduce energy consumption, and lower emissions.

We introduce AA-Omniscience, a benchmark designed to measure both factual recall and knowledge calibration across 6,000 questions. Questions are derived from authoritative academic and industry sources, and cover 42 economically relevant topics within six different domains. The evaluation measures a model's Omniscience Index, a bounded metric (-100 to 100) measuring factual recall that jointly penalizes hallucinations and rewards abstention when uncertain, with 0 equating to a model that answers questions correctly as much as it does incorrectly. Among evaluated models, Claude 4.1 Opus attains the highest score (4.8), making it one of only three models to score above zero. These results reveal persistent factuality and calibration weaknesses across frontier models. Performance also varies by domain, with the models from three different research labs leading across the six domains. This performance variability suggests models should be chosen according to the demands of the use case rather than general performance for tasks where knowledge is important.

Deploying embodied agents that can answer questions about their surroundings in realistic real-world settings remains difficult, partly due to the scarcity of benchmarks that faithfully capture practical operating conditions. We propose infrastructure inspection as a compelling domain for open-vocabulary Embodied Question Answering (EQA): it naturally demands multi-scale reasoning, long-range spatial understanding, and complex semantic relationships, while offering unique evaluation advantages via standardized National Bridge Inventory (NBI) condition ratings (0-9), professional inspection reports, and egocentric imagery. We introduce BridgeEQA, a benchmark of 2,200 open-vocabulary question-answer pairs (in the style of OpenEQA) grounded in professional inspection reports across 200 real-world bridge scenes with 47.93 images on average per scene. Questions require synthesizing visual evidence across multiple images and aligning responses with NBI condition ratings. We further propose a new EQA metric Image Citation Relevance to evaluate the ability of a model to cite relevant images. Evaluations of state-of-the-art vision-language models reveal substantial performance gaps under episodic memory EQA settings. To address this, we propose Embodied Memory Visual Reasoning (EMVR), which formulates inspection as sequential navigation over an image-based scene graph: images are nodes, and an agent takes actions to traverse views, compare evidence, and reason within a Markov decision process. EMVR shows strong performance over the baselines. We publicly release both the dataset and code.

Abstract-- Multilayer piezoelectric polyvinylidene fluoride (PVDF) actuators are a promising approach to enhance performance of soft microrobotic systems. In this work, we develop and characterize multilayer PVDF actuators with parallel voltage distribution across each layer, bridging a unique design space between brittle high-force PZT stacks and compliant but lower-bandwidth soft polymer actuators. We show the effects of layer thickness and number of layers in actuator performance and their agreement with a first principles model. By varying these parameters, we demonstrate actuators capable of >3 mm of free deflection, >20 mN of blocked force, and >=500 Hz, while operating at voltages as low as 150 volts. T o illustrate their potential for robotic integration, we integrate our actuators into a planar, translating microrobot that leverages resonance to achieve locomotion with robustness to large perturbations.

The extensive use of pesticides and synthetic dyes poses critical threats to food safety, human health, and environmental sustainability, necessitating rapid and reliable detection methods. Raman spectroscopy offers molecularly specific fingerprints but suffers from spectral noise, fluorescence background, and band overlap, limiting its real-world applicability. Here, we propose a deep learning framework based on ResNet-18 feature extraction, combined with advanced classifiers, including XGBoost, SVM, and their hybrid integration, to detect pesticides and dyes from Raman spectroscopy, called MLRaman. The MLRaman with the CNN-XGBoost model achieved a predictive accuracy of 97.4% and a perfect AUC of 1.0, while it with the CNN-SVM model provided competitive results with robust class-wise discrimination. Dimensionality reduction analyses (PCA, t-SNE, UMAP) confirmed the separability of Raman embeddings across 10 analytes, including 7 pesticides and 3 dyes. Finally, we developed a user-friendly Streamlit application for real-time prediction, which successfully identified unseen Raman spectra from our independent experiments and also literature sources, underscoring strong generalization capacity. This study establishes a scalable, practical MLRaman model for multi-residue contaminant monitoring, with significant potential for deployment in food safety and environmental surveillance.

We apply preference learning to the task of language model-guided design of novel structural alloys. In contrast to prior work that focuses on generating stable inorganic crystals, our approach targets the synthesizeability of a specific structural class: BCC/B2 superalloys, an underexplored family of materials with potential applications in extreme environments. Using three open-weight models (LLaMA-3.1, Gemma-2, and OLMo-2), we demonstrate that language models can be optimized for multiple design objectives using a single, unified reward signal through Direct Preference Optimization (DPO). Unlike prior approaches that rely on heuristic or human-in-the-loop feedback (costly), our reward signal is derived from thermodynamic phase calculations, offering a scientifically grounded criterion for model tuning. To our knowledge, this is the first demonstration of preference-tuning a language model using physics-grounded feedback for structural alloy design. The resulting framework is general and extensible, providing a path forward for intelligent design-space exploration across a range of physical science domains.

Text-conditioned molecular generation aims to translate natural-language descriptions into chemical structures, enabling scientists to specify functional groups, scaffolds, and physicochemical constraints without handcrafted rules. Diffusion-based models, particularly latent diffusion models (LDMs), have recently shown promise by performing stochastic search in a continuous latent space that compactly captures molecular semantics. Yet existing methods rely on one-shot conditioning, where the entire prompt is encoded once and applied throughout diffusion, making it hard to satisfy all the requirements in the prompt. We discuss three outstanding challenges of one-shot conditioning generation, including the poor interpretability of the generated components, the failure to generate all substructures, and the overambition in considering all requirements simultaneously. We then propose three principles to address those challenges, motivated by which we propose Chain-of-Generation (CoG), a training-free multi-stage latent diffusion framework. CoG decomposes each prompt into curriculum-ordered semantic segments and progressively incorporates them as intermediate goals, guiding the denoising trajectory toward molecules that satisfy increasingly rich linguistic constraints. To reinforce semantic guidance, we further introduce a post-alignment learning phase that strengthens the correspondence between textual and molecular latent spaces. Extensive experiments on benchmark and real-world tasks demonstrate that CoG yields higher semantic alignment, diversity, and controllability than one-shot baselines, producing molecules that more faithfully reflect complex, compositional prompts while offering transparent insight into the generation process.

Molecular property prediction is fundamental to chemical engineering applications such as solvent screening. We present Socrates-Mol, a framework that transforms language models into empirical Bayesian reasoners through context engineering, addressing cold start problems without model fine-tuning. The system implements a reflective-prediction cycle where initial outputs serve as priors, retrieved molecular cases provide evidence, and refined predictions form posteriors, extracting reusable chemical rules from sparse data. We introduce ranking tasks aligned with industrial screening priorities and employ cross-model self-consistency across five language models to reduce variance. Experiments on amine solvent LogP prediction reveal task-dependent patterns: regression achieves 72% MAE reduction and 112% R-squared improvement through self-consistency, while ranking tasks show limited gains due to systematic multi-model biases. The framework reduces deployment costs by over 70% compared to full fine-tuning, providing a scalable solution for molecular property prediction while elucidating the task-adaptive nature of self-consistency mechanisms.

Large Language Models have shown strong potential as rerankers to enhance the overall performance of RAG systems. However, existing reranking paradigms are constrained by a core theoretical and practical dilemma: Pointwise methods, while simple and highly flexible, evaluate documents independently, making them prone to the Ranking Myopia Trap, overlooking the relative importance between documents. In contrast, Listwise methods can perceive the global ranking context, but suffer from inherent List Rigidity, leading to severe scalability and flexibility issues when handling large candidate sets. To address these challenges, we propose Groupwise, a novel reranking paradigm. In this approach, the query and a group of candidate documents are jointly fed into the model, which performs within-group comparisons to assign individual relevance scores to each document. This design retains the flexibility of Pointwise methods while enabling the comparative capability of Listwise methods. We further adopt GRPO for model training, equipped with a heterogeneous reward function that integrates ranking metrics with a distributional reward aimed at aligning score distributions across groups. To overcome the bottleneck caused by the scarcity of high quality labeled data, we further propose an innovative pipeline for synthesizing high quality retrieval and ranking data. The resulting data can be leveraged not only for training the reranker but also for training the retriever. Extensive experiments validate the effectiveness of our approach. On two reasoning intensive retrieval benchmarks, BRIGHT and R2MED.

Emergency responders managing hazardous material HAZMAT incidents face critical, time-sensitive decisions, manually navigating extensive chemical guidelines. We investigate whether today's language models can assist responders by rapidly and reliably understanding critical information, identifying hazards, and providing recommendations. We introduce the Chemical Emergency Response Evaluation Framework (ChEmREF), a new benchmark comprising questions on 1,035 HAZMAT chemicals from the Emergency Response Guidebook and the PubChem Database. ChEmREF is organized into three tasks: (1) translation of chemical representation between structured and unstructured forms (e.g., converting C2H6O to ethanol), (2) emergency response generation (e.g., recommending appropriate evacuation distances) and (3) domain knowledge question answering from chemical safety and certification exams. Our best evaluated models received an exact match of 68.0% on unstructured HAZMAT chemical representation translation, a LLM Judge score of 52.7% on incident response recommendations, and a multiple-choice accuracy of 63.9% on HAMZAT examinations. These findings suggest that while language models show potential to assist emergency responders in various tasks, they require careful human oversight due to their current limitations.