3 citations · 16 across the 31 of their papers we have counts for
34 papers
Active rejection enables reliable generalization of universal machine-learning interatomic potentials
Mingxiang Luo, Xinnan Mao, Lu Wang +3
Universal machine learning interatomic potentials (uMLIPs) bridge quantum-mechanical accuracy and large-scale molecular dynamics, but the cost of high-accuracy calculations such as…
StraTA: Incentivizing Agentic Reinforcement Learning with Strategic Trajectory Abstraction
Xiangyuan Xue, Yifan Zhou, Zidong Wang +5
Large language models (LLMs) are increasingly used as interactive agents, but optimizing them for long-horizon decision making remains difficult because current methods are largely…
Earth-o1: A Grid-free Observation-native Atmospheric World Model
Junchao Gong, Kaiyi Xu, Wangxu Wei +22
Despite the unprecedented volume of multimodal data provided by modern Earth observation systems, our ability to model atmospheric dynamics remains constrained. Traditional modelin…
An SO(3)-equivariant reciprocal-space neural potential for long-range interactions
Lingfeng Zhang, Taoyong Cui, Dongzhan Zhou +6
Long-range electrostatic and polarization interactions play a central role in molecular and condensed-phase systems, yet remain fundamentally incompatible with locality-based machi…
VASP Agent: An Agentic Framework for Autonomous First-principles Calculations
Zeyu Xia, Jinzhe Ma, Congjie Zheng +11
Large Language Models (LLMs) are increasingly embedded in agentic frameworks for scientific discovery. First-principles materials computation imposes a demanding standard for auton…
A Renaissance of Explicit Motion Information Mining from Transformers for Action Recognition
Peiqin Zhuang, Lei Bai, Yichao Wu +4
Recently, action recognition has been dominated by transformer-based methods, thanks to their spatiotemporal contextual aggregation capacities. However, despite the significant pro…
Chem-R: Learning to Reason as a Chemist
Weida Wang, Benteng Chen, Di Zhang +14
Although large language models (LLMs) have significant potential to advance chemical discovery, current LLMs lack core chemical knowledge, produce unreliable reasoning trajectories…
Transition Models: Rethinking the Generative Learning Objective
Zidong Wang, Yiyuan Zhang, Xiaoyu Yue +4
A fundamental dilemma in generative modeling persists: iterative diffusion models achieve outstanding fidelity, but at a significant computational cost, while efficient few-step al…
CMPhysBench: A Benchmark for Evaluating Large Language Models in Condensed Matter Physics
Weida Wang, Dongchen Huang, Jiatong Li +32
We introduce CMPhysBench, designed to assess the proficiency of Large Language Models (LLMs) in Condensed Matter Physics, as a novel Benchmark. CMPhysBench is composed of more than…
Mimicking the Physicist's Eye:A VLM-centric Approach for Physics Formula Discovery
Jiaqi Liu, Songning Lai, Pengze Li +12
Automated discovery of physical laws from observational data in the real world is a grand challenge in AI. Current methods, relying on symbolic regression or LLMs, are limited to u…
AdaBrain-Bench: Benchmarking Brain Foundation Models for Brain-Computer Interface Applications
Jiamin Wu, Zichen Ren, Junyu Wang +7
Non-invasive Brain-Computer Interfaces (BCI) offer a safe and accessible means of connecting the human brain to external devices, with broad applications in home and clinical setti…
A Survey of Scientific Large Language Models: From Data Foundations to Agent Frontiers
Ming Hu, Chenglong Ma, Wei Li +117
Scientific Large Language Models (Sci-LLMs) are transforming how knowledge is represented, integrated, and applied in scientific research, yet their progress is shaped by the compl…
Iterative Pretraining Framework for Interatomic Potentials
Taoyong Cui, Zhongyao Wang, Dongzhan Zhou +5
Machine learning interatomic potentials (MLIPs) enable efficient molecular dynamics (MD) simulations with ab initio accuracy and have been applied across various domains in physica…
Position: Intelligent Science Laboratory Requires the Integration of Cognitive and Embodied AI
Sha Zhang, Suorong Yang, Tong Xie +18
Scientific discovery has long been constrained by human limitations in expertise, physical capability, and sleep cycles. The recent rise of AI scientists and automated laboratories…
The Avengers: A Simple Recipe for Uniting Smaller Language Models to Challenge Proprietary Giants
Yiqun Zhang, Hao Li, Chenxu Wang +11
Proprietary giants are increasingly dominating the race for ever-larger language models. Can open-source, smaller models remain competitive across a broad range of tasks? In this p…
Native-Resolution Image Synthesis
Zidong Wang, Lei Bai, Xiangyu Yue +2
We introduce native-resolution image synthesis, a novel generative modeling paradigm that enables the synthesis of images at arbitrary resolutions and aspect ratios. This approach…
PhysUniBench: A Multi-Modal Physics Reasoning Benchmark at Undergraduate Level
Lintao Wang, Encheng Su, Jiaqi Liu +11
Physics problem-solving is a challenging domain for AI models, requiring integration of conceptual understanding, mathematical reasoning, and interpretation of physical diagrams. E…
The Entropy Mechanism of Reinforcement Learning for Reasoning Language Models
Ganqu Cui, Yuchen Zhang, Jiacheng Chen +14
This paper aims to overcome a major obstacle in scaling RL for reasoning with LLMs, namely the collapse of policy entropy. Such phenomenon is consistently observed across vast RL r…
LabUtopia: High-Fidelity Simulation and Hierarchical Benchmark for Scientific Embodied Agents
Rui Li, Zixuan Hu, Wenxi Qu +13
Scientific embodied agents play a crucial role in modern laboratories by automating complex experimental workflows. Compared to typical household environments, laboratory settings…
UniSTD: Towards Unified Spatio-Temporal Learning across Diverse Disciplines
Chen Tang, Xinzhu Ma, Encheng Su +6
Traditional spatiotemporal models generally rely on task-specific architectures, which limit their generalizability and scalability across diverse tasks due to domain-specific desi…
Attention Reallocation: Towards Zero-cost and Controllable Hallucination Mitigation of MLLMs
Chongjun Tu, Peng Ye, Dongzhan Zhou +4
Multi-Modal Large Language Models (MLLMs) stand out in various tasks but still struggle with hallucinations. While recent training-free mitigation methods mostly introduce addition…
Seeing Delta Parameters as JPEG Images: Data-Free Delta Compression with Discrete Cosine Transform
Chenyu Huang, Peng Ye, Xiaohui Wang +5
With transformer-based models and the pretrain-finetune paradigm becoming mainstream, the high storage and deployment costs of individual finetuned models on multiple tasks pose cr…
Transforming Weather Data from Pixel to Latent Space
Sijie Zhao, Feng Liu, Xueliang Zhang +7
The increasing impact of climate change and extreme weather events has spurred growing interest in deep learning for weather research. However, existing studies often rely on weath…
Nature-Inspired Population-Based Evolution of Large Language Models
Yiqun Zhang, Peng Ye, Xiaocui Yang +5
Evolution, the engine behind the survival and growth of life on Earth, operates through the population-based process of reproduction. Inspired by this principle, this paper formall…