X-Git-Url: https://hackdaworld.org/gitweb/?a=blobdiff_plain;f=sic.c;h=e33d93429eb2804afd579da1fcecc69806ac58d7;hb=61d24d027511c3e96b2f94558dc1b31c72725767;hp=a3c4f742afc5d90a443623b38989d830a18312c6;hpb=155e1cfea83209d09c2a06ae4fb7f5e1652fc00a;p=physik%2Fposic.git

diff --git a/sic.c b/sic.c
index a3c4f74..e33d934 100644
--- a/sic.c
+++ b/sic.c
@@ -272,11 +272,9 @@ int main(int argc,char **argv) {
 	/* cutoff radius & bondlen */
 #ifdef ALBE
 	set_cutoff(&md,ALBE_S_SI);
-	set_bondlen(&md,ALBE_S_SI,ALBE_S_C,ALBE_S_SIC);
 	//set_cutoff(&md,ALBE_S_C);
 #else
 	set_cutoff(&md,TM_S_SI);
-	set_bondlen(&md,TM_S_SI,TM_S_C,-1.0);
 	//set_cutoff(&md,TM_S_C);
 #endif