arXiv subjects

Weixiang Hong

Publications and source records attributed to Weixiang Hong.

6 recordsLinked to original sources

arXiv2026

Prototype-guided transfer of sparse literature knowledge for electrolyte additive discovery

Electrolyte additive discovery remains challenging because experimentally validated molecules are sparse, whereas accessible chemical spaces are vast and largely unlabeled. This challenge is amplified in lithium-ion batteries, where additive performance arises from coupled interfacial reactions rather than a single molecular property. Here, we develop a prototype-guided molecular intelligence, ProtoMI, a literature-driven framework that learns transferable structural priors from reported electrolyte additives and uses them to prioritize candidates in unlabeled chemical space. For boron-containing additives, ProtoMI combines 126 literature-reported molecules with 179,977 unlabeled candidates. Graph contrastive learning identifies seven chemically interpretable prototypes from the reported additives, and prototype guided semi-supervised contrastive learning adapts these prototypes to the candidate space under source-target distribution mismatch. In retrospective temporal validation, ProtoMI achieves enrichment factors of 9.2-45.6 while screening less than 2% of the candidate space. A subsequent translation step identifies four commercially accessible candidates. One representative candidate, 4,4,5,5-Tetramethyl-2-[10-(1naphthyl)anthracen-9-yl]-1,3,2-dioxaborolane (TNDB), improves high-temperature LiFePO4||graphite cycling at 55 {\deg}C by 34.93% relative to the baseline electrolyte. An arsenal of characterizations and operando optical fiber Fourier transform infrared spectroscopy suggest that TNDB forms B-containing, F/P/O-modified inorganic interphases, suppresses solvent decomposition and reduces Fe deposition on graphite. This case study shows how sparse literature knowledge can guide experimentally efficient molecular discovery in data-scarce battery-additive spaces.

physics.chem-ph↗

arXiv2026

BatteryMFormer: Multi-level Learning for Battery Degradation Trajectory Forecasting

Early battery degradation trajectory forecasting (BDTF), which predicts the full-life state-of-health trajectory from early operational data, is critical for battery optimization, manufacturing, and deployment. Battery degradation data exhibit two key characteristics. First, degradation data present a multi-level structure, including regularities shared within aging conditions and trajectory patterns shared across batteries. Second, degradation-related variations in voltage-current profiles are often localized to specific state of charge (SOC) intervals. Existing approaches often fail to explicitly model these characteristics. To bridge this gap, we propose BatteryMFormer, a multi-level Transformer for early BDTF. BatteryMFormer integrates (1) an aging-condition-aware decoder that injects aging-condition priors via aging-condition-informed queries and aging-condition-aware attention, (2) a meta degradation pattern memory that learns and retrieves trajectory prototypes to guide long-horizon forecasting, and (3) a dual-view encoder that jointly captures temporal dynamics and SOC-localized variations from voltage and current time series. Extensive experiments on four battery domains show that BatteryMFormer consistently outperforms state-of-the-art baselines, marking a significant step toward reliable BDTF. Our code is available at https://github.com/Ruifeng-Tan/BatteryMFormer.

cs.AI↗

arXiv2026

Insertion Network for Image Sequence Correspondence

We propose a novel method for establishing correspondence between two sequences of 2D images. One particular application of this technique is slice-level content navigation, where the goal is to localize specific 2D slices within a 3D volume or determine the anatomical coverage of a 3D scan based on its 2D slices. This serves as an important preprocessing step for various diagnostic tasks, as well as for automatic registration and segmentation pipelines. Our approach builds sequence correspondence by training a network to learn how to insert a slice from one sequence into the appropriate position in another. This is achieved by encoding contextual representations of each slice and modeling the insertion process using a slice-to-slice attention mechanism. We apply this method to localize manually labeled key slices in body CT scans and compare its performance to the current state-of-the-art alternative known as body part regression, which predicts anatomical position scores for individual slices. Unlike body part regression, which treats each slice independently, our method leverages contextual information from the entire sequence. Experimental results show that the insertion network reduces slice localization errors in supervised settings from 8.4 mm to 5.4 mm, demonstrating a substantial improvement in accuracy.

cs.CV↗

arXiv2025

Pretrained battery transformer (PBT): A foundation model for battery life prediction

Early prediction of battery cycle life is essential for improving battery design, manufacturing and deployment. However, despite encouraging progress with machine learning, battery life prediction remains constrained by scarce data and pronounced heterogeneity across battery chemistries, specifications, formation protocols and operating conditions. Although transfer learning has been widely explored to alleviate these challenges, its effectiveness is limited by the absence of a foundation model that can integrate heterogeneous battery life data and provide broadly useful knowledge for target-scenario specialization. Here we introduce the pretrained battery transformer (PBT), a foundation model for battery life prediction that incorporates battery-knowledge-encoded mixture-of-experts layers to learn from scarce and heterogeneous lifetime data. PBT is first pretrained on 13 lithium-ion battery datasets to yield a general PBT that encodes comprehensive battery lifetime knowledge, and is then adapted through transfer learning into specialized PBT models for target scenarios. Across 15 datasets covering 977 batteries and 528 sets of aging conditions from lithium-ion, sodium-ion and zinc-ion batteries, PBT achieves state-of-the-art performance, surpassing the strongest competing method by 21.9% on average, with gains of up to 86.9%. This study establishes, to our knowledge, the first foundation model for battery life prediction and provides a step towards shifting battery lifetime prediction from isolated, scenario-specific modelling tasks to a reusable knowledge foundation that can be specialized to target scenarios with limited data, with implications for other prediction problems characterized by scarce and heterogeneous data in sustainable energy.

cs.LG↗

arXiv2025

BatteryLife: A Comprehensive Dataset and Benchmark for Battery Life Prediction

Battery Life Prediction (BLP), which relies on time series data produced by battery degradation tests, is crucial for battery utilization, optimization, and production. Despite impressive advancements, this research area faces three key challenges. Firstly, the limited size of existing datasets impedes insights into modern battery life data. Secondly, most datasets are restricted to small-capacity lithium-ion batteries tested under a narrow range of diversity in labs, raising concerns about the generalizability of findings. Thirdly, inconsistent and limited benchmarks across studies obscure the effectiveness of baselines and leave it unclear if models popular in other time series fields are effective for BLP. To address these challenges, we propose BatteryLife, a comprehensive dataset and benchmark for BLP. BatteryLife integrates 16 datasets, offering a 2.5 times sample size compared to the previous largest dataset, and provides the most diverse battery life resource with batteries from 8 formats, 59 chemical systems, 9 operating temperatures, and 421 charge/discharge protocols, including both laboratory and industrial tests. Notably, BatteryLife is the first to release battery life datasets of zinc-ion batteries, sodium-ion batteries, and industry-tested large-capacity lithium-ion batteries. With the comprehensive dataset, we revisit the effectiveness of baselines popular in this and other time series fields. Furthermore, we propose CyclePatch, a plug-in technique that can be employed in various neural networks. Extensive benchmarking of 18 methods reveals that models popular in other time series fields can be unsuitable for BLP, and CyclePatch consistently improves model performance establishing state-of-the-art benchmarks. Moreover, BatteryLife evaluates model performance across aging conditions and domains. BatteryLife is available at https://github.com/Ruifeng-Tan/BatteryLife.

cs.LG↗

arXiv2020

Deep Reinforcement Learning with Label Embedding Reward for Supervised Image Hashing

Deep hashing has shown promising results in image retrieval and recognition. Despite its success, most existing deep hashing approaches are rather similar: either multi-layer perceptron or CNN is applied to extract image feature, followed by different binarization activation functions such as sigmoid, tanh or autoencoder to generate binary code. In this work, we introduce a novel decision-making approach for deep supervised hashing. We formulate the hashing problem as travelling across the vertices in the binary code space, and learn a deep Q-network with a novel label embedding reward defined by Bose-Chaudhuri-Hocquenghem (BCH) codes to explore the best path. Extensive experiments and analysis on the CIFAR-10 and NUS-WIDE dataset show that our approach outperforms state-of-the-art supervised hashing methods under various code lengths.

cs.CV↗