QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: Aun on January 24, 2017, 19:09

Title: Combining RearFF potential with other?
Post by: Aun on January 24, 2017, 19:09

Hi all,

I am trying to use more than one potential.
In  tutorial, at Molecular Dynamic section, it describes how to combine potentials using tags. I tried the same method, but RearFF and Eam potential are not implemented with tag expression. How can i combine RearFF potential with other?

Title: Re: Combining RearFF potential with other?
Post by: Julian Schneider on January 25, 2017, 10:20

It is currently not possible to combine ReaxFF-potentials with other potentials in ATK-Classical. We are planning to make that work in the future, though.