Hello teachers, I would like to use the Gulp module to simulate CeO2 chemical reactions using Reaxff. However, the Reaxff force field does not have applicable atoms such as Ce atoms. Can I use any method to introduce Ce atoms?
Hello teachers, I would like to use the Gulp module to simulate CeO2 chemical reactions using Reaxff. However, the Reaxff force field does not have applicable atoms such as Ce atoms. Can I use any method to introduce Ce atoms?
