Hi All:
I am a newer here. My experience on MD simulations is focused on DL_Poly. I heard in LAMMPS, charge equilibration method is implemented, which is also I needed for my Ph. D thesis. After look at the documents throughly, I found that:
Charge equilibration method appears at two places: COMB and REAX.
Elements in COMB are limited to " for Si, Cu, Hf, Ti, O, their oxides and Zr, Zn and U metals. "
Elements in Reax are limited to " The default ffield.reax contains parameterizations for the following elements: C, H, O, N, S. "
I am not so sure if I omitted some useful information. Welcome to correct me!
In my system, there are six elements: Al, O, N, C, H form a molecule; Cobalt as a metal.
So, my question is, how can I simulate this kind of system using LA