X-Git-Url: https://hackdaworld.org/cgi-bin/gitweb.cgi?a=blobdiff_plain;ds=sidebyside;f=pair_correlation_calc.c;h=56369f64d092492058e08946de595870e45a6392;hb=155e1cfea83209d09c2a06ae4fb7f5e1652fc00a;hp=e5903aaeaa3e5a2379f589048476d587560cbe99;hpb=4d1515cac0af6b11df3d34a0bb19ea885676ee73;p=physik%2Fposic.git

diff --git a/pair_correlation_calc.c b/pair_correlation_calc.c
index e5903aa..56369f6 100644
--- a/pair_correlation_calc.c
+++ b/pair_correlation_calc.c
@@ -48,11 +48,11 @@ int main(int argc,char **argv) {
 		return ret;
 	}
 
-	//moldyn.cutoff*=2;
-	//moldyn.cutoff_square*=4;
+	moldyn.cutoff*=2;
+	moldyn.cutoff_square*=4;
 
 	dr=atof(argv[2]);
-	slots=2.0*moldyn.cutoff/dr;
+	slots=moldyn.cutoff/dr;
 	printf("[pair corr calc]\n");
 	printf("  slots: %d\n",slots);
 	printf("  cutoff: %f\n",moldyn.cutoff);
@@ -76,5 +76,7 @@ int main(int argc,char **argv) {
 
 	free(stat);
 
+	moldyn_free_save_file(&moldyn);
+
 	return 0;
 }