Spiking neural networks (SNNs), which are brain-inspired and spike-driven, achieve high energy efficiency. However, a performance gap between SNNs and artificial neural networks (ANNs) still remains. Knowledge distillation (KD) is commonly adopted to improve SNN performance, but existing methods typically enforce uniform alignment across all timesteps, either from a teacher network or through inter-temporal self-distillation, implicitly assuming that per-timestep predictions should be treated equally. In practice, SNN predictions vary and evolve over time, and intermediate timesteps need not all be individually correct even when the final aggregated output is correct. Under such conditions, effective distillation should not force every timestep toward the same supervision target, but instead provide corrective guidance to erroneous timesteps while preserving useful temporal dynamics. To address this issue, we propose Selective Alignment Knowledge Distillation (SeAl-KD), which selectively aligns class-level and temporal knowledge by equalizing competing logits at erroneous timesteps and reweighting temporal alignment based on confidence and inter-timestep similarity. Extensive experiments on static image and neuromorphic event-based datasets demonstrate consistent improvements over existing distillation methods. The code is available at https://github.com/KaiSUN1/SeAl.
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FlashAttention improves efficiency through tiling, but its online softmax still relies on floating-point arithmetic for numerical stability, making full quantization difficult. We identify three main obstacles to integer-only FlashAttention: (1) scale explosion during tile-wise accumulation, (2) inefficient shift-based exponential operations on GPUs, and (3) quantization granularity constraints requiring uniform scales for integer comparison. To address these challenges, we propose QFlash, an end-to-end integer FlashAttention design that performs softmax entirely in the integer domain and runs as a single Triton kernel. On seven attention workloads from ViT, DeiT, and Swin models, QFlash achieves up to 6.73x speedup over I-ViT and up to 8.69x speedup on Swin, while reducing energy consumption by 18.8% compared to FP16 FlashAttention, without sacrificing Top-1 accuracy on ViT/DeiT and remaining competitive on Swin under per-tensor quantization. Our code is publicly available at https://github.com/EfficientCompLab/qflash.
Federated Learning (FL) faces two major challenges when deploying large vision-language models such as contrastive language-image pretraining (CLIP) model, namely high computation/communication overhead and performance degradation due to data heterogeneity. To address these, we propose FedENC, a novel federated adaptive CLIP framework. FedENC keeps the CLIP encoder frozen and introduces a lightweight communicable global expert adaptation module for learning general knowledge across clients and two local experts for client-specific adaptation to reduce computation and communication overhead. To mitigate data heterogeneity, we introduce neural collapse (NC) alignment to encourage the model to learn unified and balanced image feature representations. To enrich the performance, we propose a cosine and Kullback–Leibler (KL) divergence based alignment function to improve the prediction consistency between the global and local experts. Finally, we ensemble their outputs for robust inference. Extensive experiments on six datasets (4 natural + 2 medical) in challenging settings (e.g., domain shift) show that FedENC improves the test accuracy (e.g., by +5.37% on DomainNet compared to LoRA) with reasonable communication load (e.g., 15.2x lower than LoRA, with 3.3GB GPU memory usage). The code is available at https://github.com/AIPMLab/FedENC.
Diffusion-based image compression has exhibited robust performance. However, most existing methods primarily emphasize spatial domain, causing frequency dependencies to be learned only implicitly. We revisit this problem from a frequency perspective, and observe pronounced heterogeneity between global and local frequency dependencies. Global frequency patterns describe the energy distribution over the entire image, whereas patch level frequency relations govern the coupling of local details. These two forms of dependency differ substantially in both scale and semantic level, yet most methods overlook this distinction. To address this issue, we propose a learning heterogeneous global local frequency dependencies in diffusion-based image compression which uses Fourier and Mamba jointly models both global and local frequency correlations(FMDiff). The core of FMDiff is the dual branch FMBlock. In the frequency branch, features are decomposed into magnitude and phase, then fed into Mamba separately. Its scanning mechanism captures cross frequency coupling within each patch while aggregating long range frequency context along the sequence. Magnitude phase interactive modulation is then used to explicitly restore spectral information corrupted by compression. The spatial branch provides high level semantic constraints and is fused with the frequency branch during diffusion reconstruction. Extensive experiments show that FMDiff consistently improves performance across multiple datasets.
Time series forecasting is vital in diverse sectors such as energy and transportation, where non-stationary dynamics are deeply intertwined with external events in other modalities such as texts. However, incorporating natural language-based external events to improve non-stationary forecasting remains largely unexplored, as most approaches still rely on a single modality, resulting in limited contextual knowledge and model underperformance. Enabling fine-grained multimodal interactions between temporal and textual data is challenged by two fundamental issues: (1) the gap in modeling interactions among discrete external events and continuous time series in a unified framework; (2) classical uniform diffusion timestep ignores event-induced non-stationary variability, leading to imbalanced denoising difficulty across diffusion stages. In this work, we propose event-aware non-stationary time series forecasting EventTSF, an autoregressive diffusion framework that integrates historical time series and textual events via step-wise diffusion. To mitigate the imbalanced denoising difficulty of uniform timestep sampling, EventTSF uses an event-aware flow-matching timestep conditioned on event semantics. Extensive experiments on 7 synthetic and real-world datasets show that EventTSF outperforms 12 non-stationary time series forecasting baselines, achieving average gains of 41.3% in probabilistic forecasting and 27.5% in deterministic forecasting across all evaluation metrics.
Spiking Neural Networks (SNNs) offer notable advantages in biological plausibility and energy efficiency, making them promising candidates for building low-power Transformers. However, existing Spiking Transformers largely adhere to a passive reactive paradigm, which struggles to focus on task-relevant information and incurs substantial computational overhead when processing redundant visual data. To overcome this fundamental yet underexplored limitation, we propose SAFformer, a novel Spiking Transformer architecture based on an active predictive filtering paradigm. Inspired by the brain’s predictive coding mechanism, SAFformer actively suppresses predictable signals and focuses on salient visual features. Extensive experiments show that SAFformer establishes new state-of-the-art performance on CIFAR-10/100 and CIFAR10-DVS. Remarkably, on ImageNet-1K, it achieves 80.44% Top-1 accuracy with only 26.58M parameters and an energy consumption of 5.88 mJ, demonstrating an exceptional balance between accuracy and efficiency.
Capturing expertise and enabling efficient information retrieval are critical in the energy sector, where high staff turnover can lead to significant knowledge loss. Retrieval Augmented Generation (RAG) offers a solution by grounding Large Language Model (LLM) outputs in documented sources, but its effectiveness is limited by reliance on general-purpose embeddings. We present Wikatoni, an agentic AI system for energy engineering workflows that integrates a novel domain-specific embedding model. Wikatoni combines fine-tuned embeddings with agentic RAG, metadata filtering, and hybrid retrieval to improve document search, automated reporting, and workflow efficiency. Evaluation on internal enterprise offshore energy data shows that the domain-adapted embedding improves recall by 10%, and Wikatoni agentic RAG further increases answer accuracy by 14% compared to vanilla RAG with the base embedding model, achieving the best overall performance in context recall, faithfulness, and answer accuracy.
Time-series forecasting plays an essential role in domains such as finance, healthcare, and energy. Yet most existing systems operate in a unimodal setting, overlooking complementary information available from visual and textual modalities. There are surprisingly few time-series forecasting demos, and multimodal, interpretable demos are rarer still. In practice, it is difficult for users to experiment with foundation models on their own time-series data due to strict input requirements, heavy setup burdens, and limited interpretability support. We present MulTiCast, an interactive Multimodal Time series foreCasting system that enables users to combine numerical signals with visual and textual context to improve predictions. The system builds on pretrained models with lightweight adaptation, but its central contribution lies in the interactive demonstration platform. Through a web interface via Hugging Face Spaces, users can load datasets, toggle modality inclusion, and visualize forecasts together with the attention maps of each modality, providing insights into the reasoning path behind the predictions.
Algorithms for Context Engineering in LLM Inference: Optimization of Placement, Compression, and Scheduling
PDF ↗Scaling long-context and agentic LLMs is increasingly limited by memory capacity and bandwidth rather than FLOPs. I propose an algorithmic framework for context engineering that models placement, compression, and scheduling as coupled optimization problems with explicit accuracy-efficiency trade-offs. Concretely, I aim to develop (1) salience-aware retention/eviction policies with provable approximation guarantees relative to an ideal oracle; (2) tier-dependent compression schemes that bound error propagation across memory levels; and (3) probabilistic prefetch/scheduling that controls tail latency. I will evaluate on long-context language modeling and reasoning benchmarks, isolating each component via ablations and comparing against heuristic baselines under controlled bandwidth/capacity regimes. Results target improved throughput and energy metrics at near-baseline quality, advancing principled, hardware-aware inference without requiring custom hardware.
Bridging Machine Learning and Physics for Scalable Long-Term Building Temperature Prediction (Student Abstract)
PDF ↗Building temperature prediction is crucial for energy optimization and control in smart cities. We present a physics-enhanced XGBoost framework in a multi-stage sequential scaling approach. Starting from single-zone, single-day predictions, we progressively scale to multi-zone, multi-year forecasts using real-world data from Google's Smart Building Simulator. Our method incorporates physics-enhanced features, temporal encodings, and inter-zone interactions, achieving mean absolute errors (MAE) as low as 0.169°F for weekly multi-zone predictions. For longer horizons, we employ ensemble strategies, demonstrating robust performance up to 2.5 years. Compared to baseline models, our framework consistently improves long-term prediction fidelity. This work advances urban AI by enabling accurate long-term building dynamics modeling for downstream control tasks and bridges machine learning with physics-based modeling approaches.
Multi-Stage Reinforcement Learning for Robust Charging of Quantum Batteries (Student Abstract)
PDF ↗Quantum batteries have emerged as a next-generation energy storage solution, leveraging quantum phenomena such as superabsorption to overcome the limitations of conventional energy technologies. However, noise arising from interactions with the external environment degrades the charging efficiency and stability of the battery by disrupting the system's quantum coherence. To address this challenge, this study proposes a robust charging framework for a single-qubit quantum battery based on the Jaynes-Cummings (JC) model. The proposed framework combines the Proximal Policy Optimization (PPO) algorithm with a multi-stage reinforcement learning structure. The agent first learns fundamental control principles in a noise-free, ideal environment and subsequently performs robust learning in progressively noisier and more complex settings. Simulation results demonstrate that the trained agent navigates a stable charging trajectory on the Bloch sphere, thereby achieving high ergotropy even in the presence of noise. These findings suggest that multi-stage reinforcement learning is an effective solution for control problems in noisy quantum systems and provides a theoretical foundation for designing charging protocols for multi-qubit systems.
Molecular conformations, the stable three-dimensional structures corresponding to local minima on the potential energy surface, govern key molecular properties and consequently underpin a wide range of downstream tasks. However, contemporary learning-based methods often lack scalability, interpretability, and robustness, thereby significantly constraining their practical effectiveness and reliability. In this context, I will introduce my ongoing explorations and the proposed research plan to address these challenges, with the ultimate objective of developing conformation‑centric universal foundation models to accelerate scientific discovery.
Deploying Atmospheric and Oceanic AI Models on Chinese Hardware and Framework: Migration Strategies, Performance Optimization and Analysis
PDF ↗With the growing role of artificial intelligence in climate and weather research, efficient model training and inference are in high demand. Current models like FourCastNet and AI-GOMS depend heavily on GPUs, limiting hardware independence, especially for Chinese domestic hardware and frameworks. To address this issue, we present a framework for migrating large-scale atmospheric and oceanic models from PyTorch to MindSpore and optimizing for Chinese chips, and evaluating their performance against GPUs. The framework focuses on software-hardware adaptation, memory optimization, and parallelism. Furthermore, the model's performance is evaluated across multiple metrics, including training speed, inference speed, model accuracy, and energy efficiency, with comparisons against GPU-based implementations. Experimental results demonstrate that the migration and optimization process preserves the models' original accuracy while significantly reducing system dependencies and improving operational efficiency by leveraging Chinese chips as a viable alternative for scientific computing. This work provides valuable insights and practical guidance for leveraging Chinese domestic chips and frameworks in atmospheric and oceanic AI model development, offering a pathway toward greater technological independence.
RUL-QMoE: Multiple Non-crossing Quantile Mixture-of-Experts for Probabilistic Remaining Useful Life Predictions of Varying Battery Materials
PDF ↗Lithium-ion (Li-ion) batteries are the major type of battery used in a variety of everyday applications, including electric vehicles (EVs), mobile devices, and energy storage systems. Predicting the Remaining Useful Life (RUL) of Li-ion batteries is crucial for ensuring their reliability, safety, and cost-effectiveness in battery-powered systems. The materials used for the battery cathodes and their designs play a significant role in determining the degradation rates and RUL, as they lead to distinct electrochemical reactions. Unfortunately, RUL prediction models often overlook the cathode materials and designs to simplify the model-building process, ignoring the effects of these electrochemical reactions. Other reasons are that specifications related to battery materials may not always be readily available, and a battery might consist of a mix of different materials. As a result, the predictive models that are developed often lack generalizability. To tackle these challenges, this paper proposes a novel material-based Mixture-of-Experts (MoE) approach for predicting the RUL of batteries, specifically addressing the complexities associated with heterogeneous battery chemistries. The MoE is integrated into a probabilistic framework, called Multiple Non-crossing Quantile Mixture-of-Experts for Probabilistic Prediction (RUL-QMoE), which accommodates battery operational conditions and enables uncertainty quantification. The RUL-QMoE model integrates specialized expert networks for five battery types: LFP, NCA, NMC, LCO, and NMC-LCO, within a gating mechanism that dynamically assigns relevance based on the battery's input features. Furthermore, by leveraging non-crossing quantile regression, the proposed RUL-QMoE produces coherent and interpretable predictive distributions of the battery's RUL, enabling robust uncertainty quantification in the battery's RUL prediction. Trained on seven real-world datasets, the proposed RUL-QMoE achieves strong predictive performance across all battery types, with MAE = 65 (cycles), MAPE = 9.59%, RMSE = 100 (cycles), and R2=96.84%. Compared to traditional models like XGBoost, Random Forest, CNN, and LSTM, the proposed RUL-QMoE model consistently delivers lower RMSE and superior probabilistic insights, including survival probabilities and prediction intervals. The model has been integrated into our Battery AI platform in collaboration with Toyota Motor Engineering & Manufacturing North America, Inc., as part of a broader Battery Foundation Model initiative. This RUL-QMoE model will serve future Toyota EVs' users and battery system designers.
LLM-based autonomous agents have recently shown strong capabilities in solving complex industrial design tasks. However, in domains aiming for carbon neutrality and high-performance renewable energy systems, current AI-assisted design automation methods face critical challenges in explainability, scalability, and practical usability. To address these limitations, we introduce PHIA (Physics-Informed Autonomous Agent), an LLM-driven system that automates modulation design for power converters in Power Electronics Systems with minimal human intervention. In contrast to traditional pipeline-based methods, PHIA incorporates an LLM-based planning module that interactively acquires and verifies design requirements via a user-friendly chat interface. This planner collaborates with physics-informed simulation and optimization components to autonomously generate and iteratively refine modulation designs. The interactive interface also supports interpretability by providing textual explanations and visual outputs throughout the design process. Experimental results show that PHIA reduces standard mean absolute error by 63.2% compared to the second-best benchmark and accelerates the overall design process by over 33 times. A user study involving 20 domain experts further confirms PHIA’s superior design efficiency and usability, highlighting its potential to transform industrial design workflows in power electronics.
LiBrain: LLM-Powered Li-ion Battery Diagnostics with Time-Series-Aware Retrieval-Augmented Framework for E-bikes
PDF ↗The rapid proliferation of smart-city ecosystems has significantly amplified the demand for Li-ion batteries, which now serve as the primary energy source for sustainable transportation systems such as e-bikes. Ensuring battery safety and optimal performance is crucial, yet challenging due to complex intrinsic dynamics and extrinsic operating conditions. This paper presents LiBrain, an innovative LLM-powered, time-series-aware retrieval-augmented framework designed to simultaneously address both safety and performance challenges through three synergistic components: (1) a distributed IoT-enabled edge network for continuous real-time battery monitoring and data acquisition, (2) a pretrained deep multi-task diagnostic engine capable of comprehensive battery performance forecasting, and (3) a knowledge-base augmentation module that transforms technical diagnostics into clear, actionable guidance tailored for e-bike users. Functioning as an intelligent battery management assistant, LiBrain effectively bridges the gap between expert-level real-time analytics and practical, user-friendly instructions. Extensive validation across a real-world operational e-bike battery-swap network demonstrates LiBrain's exceptional capabilities, achieving a 95% adoption rate in hazardous alarm detection and 92% in battery-status prediction. In real application, Li-Brain has processed over 500 million battery events, managed almost 10 million inquiries and 1 million alarms annually, and identified 10% of on-site batteries daily for proactive replacement, thereby maintaining operational safety and reliability.
Discovery of Feasible 3D Printing Configurations for Metal Alloys via AI-Driven Adaptive Experimental Design
PDF ↗Configuring the parameters of additive manufacturing processes for metal alloys is a challenging problem due to complex relationships between input parameters (e.g., laser power, scan speed) and quality of printed outputs. The standard trial-and-error approach to find feasible parameter configurations is highly inefficient because validating each configuration is expensive in terms of resources (physical and human labor) and the configuration space is very large. This paper combines the general principles of AI-driven adaptive experimental design with domain knowledge to address the challenging problem of discovering feasible configurations. The key idea is to build a surrogate model from past experiments to intelligently select a small batch of input configurations for validation in each iteration. To demonstrate the effectiveness of this methodology, we deploy it for Directed Energy Deposition process to print GRCop-42, a high-performance copper–chromium–niobium alloy developed by NASA for aerospace applications. Within three months, our approach yielded multiple defect-free outputs across a range of laser powers—dramatically reducing time-to-result and resource expenditure compared to several months of manual experimentation by domain scientists with no success. By enabling high-quality GRCop-42 fabrication on readily available infrared laser platforms for the first time, we democratize access to this critical alloy, paving the way for cost-effective, decentralized production for aerospace applications.
CODEI: Resource-Efficient Task-Driven Co-Design of Perception and Decision Making for Mobile Robots Applied to Autonomous Vehicles (Abstract Reprint)
PDF ↗This article discusses the integration challenges and strategies for designing mobile robots, by focusing on the task-driven, optimal selection of hardware and software to balance safety, efficiency, and minimal usage of resources such as costs, energy, computational requirements, and weight. We emphasize the interplay between perception and motion planning in decision-making by introducing the concept of occupancy queries to quantify the perception requirements for sampling-based motion planners. Sensor and algorithm performance are evaluated using false negative rate and false positive rate across various factors such as geometric relationships, object properties, sensor resolution, and environmental conditions. By integrating perception requirements with perception performance, an integer linear programming approach is proposed for efficient sensor and algorithm selection and placement. This forms the basis for a co-design optimization that includes the robot body, motion planner, perception pipeline, and computing unit. We refer to this framework for solving the co-design problem of mobile robots as CODEI, short for co-design of embodied intelligence. A case study on developing an autonomous vehicle for urban scenarios provides actionable information for designers, and shows that complex tasks escalate resource demands, with task performance affecting choices of the autonomy stack. The study demonstrates that resource prioritization influences sensor choice: cameras are preferred for cost-effective and lightweight designs, while lidar sensors are chosen for better energy and computational efficiency.
Super Level Sets and Exponential Decay: A Synergistic Approach to Stable Neural Network Training (Abstract Reprint)
PDF ↗This paper presents a theoretically grounded optimization framework for neural network training that integrates an Exponentially Decaying Learning Rate with Lyapunov-based stability analysis. We develop a dynamic learning rate algorithm and prove that it induces connected and stable descent paths through the loss landscape by maintaining the connectivity of super-level sets Sλ = {θ ∈ ℝn : ℒ(θ) ≥ λ}. Under the condition that the Lyapunov function V(θ) = ℒ(θ) satisfies Δ V(θ) ⋅ Δ ℒ(θ) ≥ 0, we establish that these super-level sets are not only connected but also equiconnected across epochs, providing uniform topological stability. We further derive convergence guarantees using a second-order Taylor expansion and demonstrate that our exponentially scheduled learning rate with gradient-based modulation leads to a monotonic decrease in loss. The proposed algorithm incorporates this schedule into a stability-aware update mechanism that adapts step sizes based on both curvature and energy-level geometry. This work formalizes the role of topological structure in convergence dynamics and introduces a provably stable optimization algorithm for high-dimensional, non-convex neural networks.
This talk surveys my research journey toward building reliable machine learning systems that behave safely and predictably in the open world. While modern machine learning models—including foundation models (FMs)—have demonstrated unprecedented capabilities, they often suffer from reliability failures under distribution shift, leading to overconfident mispredictions, hallucinated generations, or susceptibility to adversarial prompts. My research rethinks reliability not as an afterthought, but as a first-class algorithmic principle, to be optimized alongside accuracy with minimal human supervision. The talk is organized around three key threads. To respect the allotted 20-30 minutes, the first and second parts will be briefly discussed. 1. Unknown-Aware Learning via Outlier Synthesis. I introduce a class of learning algorithms that synthesize “virtual outliers” in representation or pixel space to explicitly teach models what they don’t know. This includes the VOS, NPOS, and Dream-OOD frameworks, which shape the energy landscape around in-distribution data to avoid overconfidence on OOD. 2. Learning in the Wild with Unlabeled Data. I present theoretical insights and practical algorithms for leveraging unlabeled in-the-wild data to improve reliability. This includes SAL framework, which uses a gradient-based spectral method to separate potential outliers, and SCONE, which handles semantic and covariate shifts via constrained optimization. These results turn unlabeled data contamination into a learning signal. 3. Reliable Foundation Models. I explore reliability failures in LLMs and multimodal systems. I introduce HaloScope for hallucination detection via subspace separation on LLM representations, and TSV that performs LLM latent steering for improved hallucination detection. I will also briefly cover the LLM security and alignment, which includes VLMGuard for detecting malicious prompts in vision-language models and a data-centric paradigm for AI alignment through source-aware feedback cleaning. Throughout the talk, I highlight how representation learning, data generation, and theoretical guarantees intersect to produce scalable, label-efficient reliability methods. I will also reflect on my broader vision: designing proactive and collaborative AI systems that anticipate uncertainty and support rich human-AI interaction—especially for underrepresented communities and emerging scientific domains. This talk will be accessible to a broad AAAI audience, combining foundational algorithmic insights with real-world applications and forward-looking perspectives on the future of responsible AI.