Al-O potential implementation in LAMMPS?


  I am looking to use an Aluminum-Oxygen potential and would prefer if one is implemented in LAMMPS. If anyone have the knowledge of such potential, please give me a head up on it's whereabouts or the name whoever implemented it.


I think there are parameterizations of Al-oxide for ReaxFF. You'd
have to look in the literature.


Thanks Steve,
  I will look around. The question is this, will it be easy to use the parameters to generate some sort of LAMMPS potential file with ReaxFF?

The LAMMPS potential file for ReaxFF is the ReaxFF parameters
for a particular element(s). You can create that file any
way you wish. Finding appropriate ReaxFF params (e.g. from
the literature) for the system you want is the harder issue.