supporting information.docx (5.28 MB)
Supplement Number 1
dataset
posted on 2024-03-25, 04:00 authored by Fei-Yang Xu, Zhi-Guo Li, Xiang-Rong Chen, Hua Y. Geng, Lei Liu, Jianbo HuThis file contains fitting parameters of Eq. 3, Comparison of the pressure calculated from AIMD and DPMD simulations, convergence test, pressure comparison between different system sizes, and the number of O2 molecules as a function of density
