Evaluating AIQM1 on Reaction Barrier Heights
In our work published in the Journal of Chemical Physics, we investigate the performance of AIQM1 on …
Author: Yaohuang Huang
Prof. Pavlo O. Dral joins the Editorial Board of the new journal “Artificial Intelligence Chemistry”
Artificial Intelligence Chemistry, a new chemical journal launched by Elsevier, with international peer review and online …
Open Master’s Positions in 2023
The group of Prof. Pavlo Dral in College of Chemistry and Chemical Engineering at Xiamen University …
Welcome New Members of Our Group (2022)!
Yuxinxin Chen (master student), Yeyun Chen (co-supervised PhD student) and Yaohuang Huang (research assistant) join our …
A comparative study of different machine learning methods for dissipative quantum dynamics
Recently, Machine Learning (ML) is increasingly used for fast and accurate propagation of quantum dissipative dynamics …