The rapid advancement of perovskite solar cells (PSCs) has led to an exponential growth in research publications, creating an urgent need for efficient knowledge management and reasoning systems in this domain. We present a comprehensive knowledge-enhanced system for PSCs that integrates three key components. First, we develop Perovskite-KG, a domain-specific knowledge graph constructed from 1,517 research papers, containing 23,789 entities and 22,272 relationships. Second, we create two complementary datasets: Perovskite-Chat, comprising 55,101 high-quality question-answer pairs generated through a novel multi-agent framework, and Perovskite-Reasoning, containing 2,217 carefully curated materials science problems. Third, we introduce two specialized large language models: Perovskite-Chat-LLM for domain-specific knowledge assistance and Perovskite-Reasoning-LLM for scientific reasoning tasks. Experimental results demonstrate that our system significantly outperforms existing models in both domain-specific knowledge retrieval and scientific reasoning tasks, providing researchers with effective tools for literature review, experimental design, and complex problem-solving in PSC research.

Despite recent advances in learning-based controllers for legged robots, deployments in human-centric environments remain limited by safety concerns. Most of these approaches use position-based control, where policies output target joint angles that must be processed by a low-level controller (e.g., PD or impedance controllers) to compute joint torques. Although impressive results have been achieved in controlled real-world scenarios, these methods often struggle with compliance and adaptability when encountering environments or disturbances unseen during training, potentially resulting in extreme or unsafe behaviors. Inspired by how animals achieve smooth and adaptive movements by controlling muscle extension and contraction, torque-based policies offer a promising alternative by enabling precise and direct control of the actuators in torque space. In principle, this approach facilitates more effective interactions with the environment, resulting in safer and more adaptable behaviors. However, challenges such as a highly nonlinear state space and inefficient exploration during training have hindered their broader adoption. To address these limitations, we propose SATA, a bio-inspired framework that mimics key biomechanical principles and adaptive learning mechanisms observed in animal locomotion. Our approach effectively addresses the inherent challenges of learning torque-based policies by significantly improving early-stage exploration, leading to high-performance final policies. Remarkably, our method achieves zero-shot sim-to-real transfer. Our experimental results indicate that SATA demonstrates remarkable compliance and safety, even in challenging environments such as soft/slippery terrain or narrow passages, and under significant external disturbances, highlighting its potential for practical deployments in human-centric and safety-critical scenarios.

Link prediction (LP) is an important problem in network science and machine learning research. The state-of-the-art LP methods are usually evaluated in a uniform setup, ignoring several factors associated with the data and application specific needs. We identify a number of such factors, such as, network-type, problem-type, geodesic distance between the end nodes and its distribution over the classes, nature and applicability of LP methods, class imbalance and its impact on early retrieval, evaluation metric, etc., and present an experimental setup which allows us to evaluate LP methods in a rigorous and controlled manner. We perform extensive experiments with a variety of LP methods over real network datasets in this controlled setup, and gather valuable insights on the interactions of these factors with the performance of LP through an array of carefully designed hypotheses. Following the insights, we provide recommendations to be followed as best practice for evaluating LP methods.

Time series forecasting (TSF) is an essential branch of machine learning with various applications. Most methods for TSF focus on constructing different networks to extract better information and improve performance. However, practical application data contain different internal mechanisms, resulting in a mixture of multiple patterns. That is, the model's ability to fit different patterns is different and generates different errors. In order to solve this problem, we propose an end-to-end framework, namely probability pattern-guided time series forecasting (PPGF). PPGF reformulates the TSF problem as a forecasting task guided by probabilistic pattern classification. Firstly, we propose the grouping strategy to approach forecasting problems as classification and alleviate the impact of data imbalance on classification. Secondly, we predict in the corresponding class interval to guarantee the consistency of classification and forecasting. In addition, True Class Probability (TCP) is introduced to pay more attention to the difficult samples to improve the classification accuracy. Detailedly, PPGF classifies the different patterns to determine which one the target value may belong to and estimates it accurately in the corresponding interval. To demonstrate the effectiveness of the proposed framework, we conduct extensive experiments on real-world datasets, and PPGF achieves significant performance improvements over several baseline methods. Furthermore, the effectiveness of TCP and the necessity of consistency between classification and forecasting are proved in the experiments. All data and codes are available online: https://github.com/syrGitHub/PPGF.

Authors: Yifan Xu Abstract: Conventional wind power prediction methods often struggle to provide accurate and reliable predictions in the presence of sudden changes in wind speed and power output. To address this challenge, this study proposes an integrated algorithm that combines a wind speed mutation identification algorithm, an optimized similar period matching algorithm and a wind power prediction algorithm. By exploiting the convergence properties of meteorological events, the method significantly improves the accuracy of wind power prediction under sudden meteorological changes. Firstly, a novel adaptive model based on variational mode decomposition, the VMD-IC model, is developed for identifying and labelling key turning points in the historical wind power data, representing abrupt meteorological environments. At the same time, this paper proposes Ramp Factor (RF) indicators and wind speed similarity coefficient to optimize the definition algorithm of the current wind power ramp event (WPRE). After innovating the definition of climbing and denoising algorithm, this paper uses the Informer deep learning algorithm to output the first two models as well as multimodal data such as NWP numerical weather forecasts to achieve accurate wind forecasts. The experimental results of the ablation study confirm the effectiveness and reliability of the proposed wind slope identification method. Compared with existing methods, the proposed model exhibits excellent performance and provides valuable guidance for the safe and cost-effective operation of power systems.

Inverse tasks can uncover potential reasoning gaps as Large Language Models (LLMs) scale up. In this work, we explore the redefinition task, in which we assign alternative values to well-known physical constants and units of measure, prompting LLMs to respond accordingly. Our findings show that not only does model performance degrade with scale, but its false confidence also rises. Moreover, while factors such as prompting strategies or response formatting are influential, they do not preclude LLMs from anchoring to memorized values.

Finding a minimum spanning tree (MST) for $n$ points in an arbitrary metric space is a fundamental primitive for hierarchical clustering and many other ML tasks, but this takes $\Omega(n^2)$ time to even approximate. We introduce a framework for metric MSTs that first (1) finds a forest of disconnected components using practical heuristics, and then (2) finds a small weight set of edges to connect disjoint components of the forest into a spanning tree. We prove that optimally solving the second step still takes $\Omega(n^2)$ time, but we provide a subquadratic 2.62-approximation algorithm. In the spirit of learning-augmented algorithms, we then show that if the forest found in step (1) overlaps with an optimal MST, we can approximate the original MST problem in subquadratic time, where the approximation factor depends on a measure of overlap. In practice, we find nearly optimal spanning trees for a wide range of metrics, while being orders of magnitude faster than exact algorithms.

Time series clustering poses a significant challenge with diverse applications across domains. A prominent drawback of existing solutions lies in their limited interpretability, often confined to presenting users with centroids. In addressing this gap, our work presents $k$-Graph, an unsupervised method explicitly crafted to augment interpretability in time series clustering. Leveraging a graph representation of time series subsequences, $k$-Graph constructs multiple graph representations based on different subsequence lengths. This feature accommodates variable-length time series without requiring users to predetermine subsequence lengths. Our experimental results reveal that $k$-Graph outperforms current state-of-the-art time series clustering algorithms in accuracy, while providing users with meaningful explanations and interpretations of the clustering outcomes.

In-silico material discovery and design have traditionally relied on high-fidelity first-principles methods such as density functional theory (DFT) [1] and ab-initio molecular dynamics (AIMD) [2] to accurately model atomic interactions and predict material properties. Despite their effectiveness, these methods face significant challenges due to their prohibitive computational cost, limiting their scalability for highthroughput screening across vast chemical spaces and for simulations over large length and time scales. Moreover, many advanced materials remain beyond the reach of widespread predictive theories due to a fundamental lack of mechanistic understanding. These challenges stem from the inherent complexity of their chemical composition, phase stability, and the intricate interplay of multiple order parameters, compounded by the lack of self-consistent integration between theoretical models and multi-modal experimental findings. As a result, breakthroughs in functional materials, such as new classes of correlated oxides, nitrides, and low-dimensional quantum materials, have largely been serendipitous or guided by phenomenological intuition rather than systematic, theory-driven design. Attempts to predict new materials and functionalities have often led to mixed results, with theoretically proposed systems failing to exhibit the desired properties when synthesized and tested.

Existing end-to-end autonomous driving (AD) algorithms typically follow the Imitation Learning (IL) paradigm, which faces challenges such as causal confusion and the open-loop gap. In this work, we establish a 3DGS-based closed-loop Reinforcement Learning (RL) training paradigm. By leveraging 3DGS techniques, we construct a photorealistic digital replica of the real physical world, enabling the AD policy to extensively explore the state space and learn to handle out-of-distribution scenarios through large-scale trial and error. To enhance safety, we design specialized rewards that guide the policy to effectively respond to safety-critical events and understand real-world causal relationships. For better alignment with human driving behavior, IL is incorporated into RL training as a regularization term. We introduce a closed-loop evaluation benchmark consisting of diverse, previously unseen 3DGS environments. Compared to IL-based methods, RAD achieves stronger performance in most closed-loop metrics, especially 3x lower collision rate. Abundant closed-loop results are presented at https://hgao-cv.github.io/RAD.