This package provides the interface module between aenet [1] and LAMMPS [2], patch of aenet for the LAMMPS library, and Artificial Neural network (ANN) potential parameter file of BCC iron.
Dear developer,
I tried all permutations I could think of, to make lammps take a pair_coeff, but without success ( C-code is unreadable for me :) ). Can you,please, describe how a 2-element input would look like? For example TiO2 from aenet examples...
Thank you very much.
Sergiu