X-Git-Url: https://hackdaworld.org/gitweb/?a=blobdiff_plain;f=moldyn.c;h=a1bfcaea95c82580dc636f5655649a61d0e8cf8f;hb=155e1cfea83209d09c2a06ae4fb7f5e1652fc00a;hp=def5079dbbd949fa55e4f65b9aa4a77e165077db;hpb=4c2140b0f76fb191bdd9b9c2a329877eb0aae531;p=physik%2Fposic.git diff --git a/moldyn.c b/moldyn.c index def5079..a1bfcae 100644 --- a/moldyn.c +++ b/moldyn.c @@ -257,6 +257,14 @@ int set_potential(t_moldyn *moldyn,u8 type) { moldyn->func3b_k2=albe_mult_3bp_k2; moldyn->check_2b_bond=albe_mult_check_2b_bond; break; + case MOLDYN_POTENTIAL_HO: + moldyn->func2b=harmonic_oscillator; + moldyn->check_2b_bond=harmonic_oscillator_check_2b_bond; + break; + case MOLDYN_POTENTIAL_LJ: + moldyn->func2b=lennard_jones; + moldyn->check_2b_bond=lennard_jones_check_2b_bond; + break; default: printf("[moldyn] set potential: unknown type %02x\n", type);