hybrid airebo

Wait! wait! Axel, can I answer this one?

pair_style hybrid airebo 3.0 1 0 lj/cut 2.5
pair_coeff * * airebo CH.airebo C H NULL
#pair_style hybrid tersoff lj/cut 2.5
#pair_coeff * * tersoff Si.tersoff Si Si NULL
pair_coeff 2 3 lj/cut 1.0 1.0 2.5
pair_coeff 1 3 lj/cut 1.0 1.0 2.5
pair_coeff 3 3 lj/cut 1.0 1.0 2.5

Please note the subtle difference, look for it, you’ll find it. And yes you can leave the additional arguments in.
:slight_smile:

dave

Well, that was really a subtle difference. I'm sorry, Dave, but Steve told me about it a bit earlier. And now it works!

Thanks everyone for help!

18.08.2011, 18:14, "Dave Schall" <[email protected]>: