X-Git-Url: https://hackdaworld.org/gitweb/?a=blobdiff_plain;ds=sidebyside;f=potentials%2Ftersoff.h;fp=potentials%2Ftersoff.h;h=a23503a0ed9693859a10631ba4ba3b6077a829be;hb=52485a28c5f9812c0f7a2d4e0094cd8000167b24;hp=4e129570f90f0f2f9aaa506c03551acfb013d185;hpb=98f5c05d17d1077aaca379e755bf36f5d8f61776;p=physik%2Fposic.git diff --git a/potentials/tersoff.h b/potentials/tersoff.h index 4e12957..a23503a 100644 --- a/potentials/tersoff.h +++ b/potentials/tersoff.h @@ -83,6 +83,7 @@ int tersoff_mult_3bp_k1(t_moldyn *moldyn, int tersoff_mult_3bp_j2(t_moldyn *moldyn,t_atom *ai,t_atom *aj,u8 bc); int tersoff_mult_3bp_k2(t_moldyn *moldyn, t_atom *ai,t_atom *aj,t_atom *ak,u8 bc); +int tersoff_mult_check_2b_bond(t_moldyn *moldyn,t_atom *ai,t_atom *aj,u8 bc); /* tersoff potential paramter defines */