Obtaining the free energies of condensed phase chemical reactions remains computationally prohibitive for high-level quantum mechanical methods. We introduce a hierarchical machine learning framework that bridges this gap by distilling knowledge from a small number of high-fidelity quantum calculations into increasingly coarse-grained, machine-learned quantum Hamiltonians. By retaining explicit electronic degrees of freedom, our approach further enables a faithful embedding of quantum and classical degrees of freedom that captures long-range electrostatics and the quantum response to a classical environment to infinite order. As validation, we compute the proton dissociation constants of weak acids and the kinetic rate of an enzymatic reaction entirely from first principles, reproducing experimental measurements within chemical accuracy or their uncertainties. Our work demonstrates a path to condensed phase simulations of reaction free energies at the highest levels of accuracy with converged statistics.

Abstract-- Compared with gears and linkages, wires constitute a lightweight, low-friction transmission mechanism. However, because wires are flexible materials, they tend to introduce large modeling errors, and their adoption in industrial and research robots remains limited. In this study, we built a Universal Wire T esting Machine that enables measurement and adjustment of wire characteristics to improve the performance of wire-driven mechanisms. Using this testing machine, we carried out removal of initial wire stretch, measurement of tension transmission efficiency for eight different diameters of passive pulleys, and measurement of the dynamic behavior of variable-length wires. Finally, we applied the data obtained from this testing machine to the force control of an actual wire-driven robot, reducing the end-effector force error . Compared with gears and linkages, wires offer a low-friction, low-inertia transmission mechanism.

Science Archaeology Wisconsin'ghost ship' uncovered after 139 years It took citizen scientists only two hours to find the F.J. King's final resting place. Breakthroughs, discoveries, and DIY tips sent every weekday. A group of Wisconsin maritime historians and citizen scientists uncovered a Lake Michigan shipwreck "hidden in plain sight" for nearly 140 years. The team uncovered the waterlogged wreckage of the three-masted wooden schooner in the waters off Bailey's Harbor, Wisconsin. On September 15, 1886, the 144-foot left Escanaba, Michigan, bound for Chicago with 600 tons of iron ore onboard.

Machine learning interatomic potentials have revolutionized complex materials design by enabling rapid exploration of material configurational spaces via crystal structure prediction with ab initio accuracy. However, critical challenges persist in ensuring robust generalization to unknown structures and minimizing the requirement for substantial expert knowledge and time-consuming manual interventions. Here, we propose an automated crystal structure prediction framework built upon the attention-coupled neural networks potential to address these limitations. The generalizability of the potential is achieved by sampling regions across the local minima of the potential energy surface, where the self-evolving pipeline autonomously refines the potential iteratively while minimizing human intervention. The workflow is validated on Mg-Ca-H ternary and Be-P-N-O quaternary systems by exploring nearly 10 million configurations, demonstrating substantial speedup compared to first-principles calculations. These results underscore the effectiveness of our approach in accelerating the exploration and discovery of complex multi-component functional materials.

Learning to plan in grounded environments typically requires carefully designed reward functions or high-quality annotated demonstrations. Recent works show that pretrained foundation models, such as large language models (LLMs) and vision language models (VLMs), capture background knowledge helpful for planning, which reduces the amount of reward design and demonstrations needed for policy learning. We evaluate how well LLMs and VLMs provide feedback across symbolic, language, and continuous control environments. We consider prominent types of feedback for planning including binary feedback, preference feedback, action advising, goal advising, and delta action feedback. We also consider inference methods that impact feedback performance, including in-context learning, chain-of-thought, and access to environment dynamics. We find that foundation models can provide diverse high-quality feedback across domains. Moreover, larger and reasoning models consistently provide more accurate feedback, exhibit less bias, and benefit more from enhanced inference methods. Finally, feedback quality degrades for environments with complex dynamics or continuous state spaces and action spaces.

After natural disasters, accurate evaluations of damage to housing are important for insurance claims response and planning of resources. In this work, we introduce a novel multimodal retrieval-augmented generation (MM-RAG) framework. On top of classical RAG architecture, we further the framework to devise a two-branch multimodal encoder structure that the image branch employs a visual encoder composed of ResNet and Transformer to extract the characteristic of building damage after disaster, and the text branch harnesses a BERT retriever for the text vectorization of posts as well as insurance policies and for the construction of a retrievable restoration index. To impose cross-modal semantic alignment, the model integrates a cross-modal interaction module to bridge the semantic representation between image and text via multi-head attention. Meanwhile, in the generation module, the introduced modal attention gating mechanism dynamically controls the role of visual evidence and text prior information during generation. The entire framework takes end-to-end training, and combines the comparison loss, the retrieval loss and the generation loss to form multi-task optimization objectives, and achieves image understanding and policy matching in collaborative learning. The results demonstrate superior performance in retrieval accuracy and classification index on damage severity, where the Top-1 retrieval accuracy has been improved by 9.6%.

This research introduces a novel psychometric method for analyzing textual data using large language models. By leveraging contextual embeddings to create contextual scores, we transform textual data into response data suitable for psychometric analysis. Treating documents as individuals and words as items, this approach provides a natural psychometric interpretation under the assumption that certain keywords, whose contextual meanings vary significantly across documents, can effectively differentiate documents within a corpus. The modeling process comprises two stages: obtaining contextual scores and performing psychometric analysis. In the first stage, we utilize natural language processing techniques and encoder based transformer models to identify common keywords and generate contextual scores. In the second stage, we employ various types of factor analysis, including exploratory and bifactor models, to extract and define latent factors, determine factor correlations, and identify the most significant words associated with each factor. Applied to the Wiki STEM corpus, our experimental results demonstrate the method's potential to uncover latent knowledge dimensions and patterns within textual data. This approach not only enhances the psychometric analysis of textual data but also holds promise for applications in fields rich in textual information, such as education, psychology, and law.

Materials characterization is fundamental to acquiring materials information, revealing the processing-microstructure-property relationships that guide material design and optimization. While multimodal large language models (MLLMs) have recently shown promise in generative and predictive tasks within materials science, their capacity to understand real-world characterization imaging data remains underexplored. To bridge this gap, we present MatCha, the first benchmark for materials characterization image understanding, comprising 1,500 questions that demand expert-level domain expertise. MatCha encompasses four key stages of materials research comprising 21 distinct tasks, each designed to reflect authentic challenges faced by materials scientists. Our evaluation of state-of-the-art MLLMs on MatCha reveals a significant performance gap compared to human experts. These models exhibit degradation when addressing questions requiring higher-level expertise and sophisticated visual perception. Simple few-shot and chain-of-thought prompting struggle to alleviate these limitations. These findings highlight that existing MLLMs still exhibit limited adaptability to real-world materials characterization scenarios. We hope MatCha will facilitate future research in areas such as new material discovery and autonomous scientific agents. MatCha is available at https://github.com/FreedomIntelligence/MatCha.

The demand for lightweight and high-strength composite structures is rapidly growing in aerospace and robotics, particularly for optimized drone frames. However, conventional composite manufacturing methods struggle to achieve complex 3D architectures for weight savings and rely on assembling separate components, which introduce weak points at the joints. Additionally, maintaining continuous fiber reinforcement remains challenging, limiting structural efficiency. In this study, we demonstrate the lightweight Face Centered Cubic (FFC) lattice structured conceptualization of drone frames for weight reduction and complex topology fabrication through 3D Fiber Tethering (3DFiT) using continuous single tow fiber ensuring precise fiber alignment, eliminating weak points associated with traditional composite assembly. Mechanical testing demonstrates that the fabricated drone frame exhibits a high specific strength of around four to eight times the metal and thermoplastic, outperforming other conventional 3D printing methods. The drone frame weighs only 260 g, making it 10% lighter than the commercial DJI F450 frame, enhancing structural integrity and contributing to an extended flight time of three minutes, while flight testing confirms its stability and durability under operational conditions. The findings demonstrate the potential of single tow lattice truss-based drone frames, with 3DFiT serving as a scalable and efficient manufacturing method.

The Download: Trump's impact on science, and meet our climate and energy honorees How Trump's policies are affecting early-career scientists--in their own words Every year MIT Technology Review celebrates accomplished young scientists, entrepreneurs, and inventors from around the world in our Innovators Under 35 list. We've just published the 2025 edition . This year, though, the context is different: The US scientific community is under attack. Since Donald Trump took office in January, his administration has fired top government scientists, targeted universities and academia, and made substantial funding cuts to the country's science and technology infrastructure. We asked our six most recent cohorts about both positive and negative impacts of the administration's new policies. Their responses provide a glimpse into the complexities of building labs, companies, and careers in today's political climate.