Yang, Weijie
Visualizing the Local Atomic Environment Features of Machine Learning Interatomic Potential
Shao, Xuqiang, Zhang, Yuqi, Zhang, Di, Gao, Tianxiang, Liu, Xinyuan, Gan, Zhiran, Meng, Fanshun, Li, Hao, Yang, Weijie
This paper addresses the challenges of creating efficient and high-quality datasets for machine learning potential functions. We present a novel approach, termed DV-LAE (Difference Vectors based on Local Atomic Environments), which utilizes the properties of atomic local environments and employs histogram statistics to generate difference vectors. This technique facilitates dataset screening and optimization, effectively minimizing redundancy while maintaining data diversity. We have validated the optimized datasets in high-temperature and high-pressure hydrogen systems as well as the {\alpha}-Fe/H binary system, demonstrating a significant reduction in computational resource usage without compromising prediction accuracy. Additionally, our method has revealed new structures that emerge during simulations but were underrepresented in the initial training datasets. The redundancy in the datasets and the distribution of these new structures can be visually analyzed through the visualization of difference vectors. This approach enhances our understanding of the characteristics of these newly formed structures and their impact on physical processes.
A Scoring Method for Driving Safety Credit Using Trajectory Data
Wang, Wenfu, Yang, Weijie, Chen, An, Pan, Zhijie
Abstract--Urban traffic systems worldwide are suffering from severe traffic safety problems. Traffic safety is affected by many complex factors, and heavily related to all drivers' behaviors involved in traffic system. Drivers with aggressive driving behaviors increase the risk of traffic accidents. In order to manage the safety level of traffic system, we propose Driving Safety Credit inspired by credit score in financial security field, and design a scoring method using driver's trajectory data and violation records. First, we extract driving habits, aggressive driving behaviors and traffic violation behaviors from driver's trajectories and traffic violation records. Next, we train a classification modelto filtered out irrelevant features. And at last, we score each driver with selected features. We verify our proposed scoring method using 40 days of traffic simulation, and proves the effectiveness of our scoring method. I. INTRODUCTION Urban traffic worldwide is facing severe traffic safety problems. According to the Global status report on road safety 2015 [1] released by the World Health Organization, approximately 1.3 million people die each year on the world's roads, and between 20 and 50 million sustain nonfatal injuries.