no segfaulst anymore BUT take care, definetly calculating bullshit

[physik/posic.git] / sic.c

diff --git a/sic.c b/sic.c
index 3408895..5f50bd8 100644 (file)
--- a/sic.c
+++ b/sic.c
@@ -41,6 +41,7 @@ int main(int argc,char **argv) {
        printf("[sic] selecting potential\n");
        set_potential1b(&md,tersoff_mult_1bp,&tp);
        set_potential2b(&md,tersoff_mult_2bp,&tp);
+       set_potential2b_post(&md,tersoff_mult_post_2bp,&tp);
        set_potential3b(&md,tersoff_mult_3bp,&tp);
        //set_potential2b(&md,lennard_jones,&lj);
 
@@ -125,7 +126,7 @@ int main(int argc,char **argv) {
 
        /* create the simulation schedule */
        printf("[sic] adding schedule\n");
-       moldyn_add_schedule(&md,10,1.0e-15);
+       moldyn_add_schedule(&md,100,1.0e-15);
 
        /* activate logging */
        printf("[sic] activate logging\n");