Merge branch 'leadoff'

[physik/posic.git] / pair_correlation_calc.c

diff --git a/pair_correlation_calc.c b/pair_correlation_calc.c
index cfe14e2..26db76b 100644 (file)
--- a/pair_correlation_calc.c
+++ b/pair_correlation_calc.c
@@ -43,6 +43,8 @@ int main(int argc,char **argv) {
        dr=atof(argv[1]);
 
        first=1;
+       stat=NULL;
+       total=NULL;
 
        for(j=2;j<argc;j++) {
 
@@ -55,8 +57,10 @@ int main(int argc,char **argv) {
                        return ret;
                }
 
-               moldyn.cutoff*=2;
-               moldyn.cutoff_square*=4;
+               //moldyn.cutoff*=2;
+               //moldyn.cutoff_square*=4;
+               moldyn.cutoff=6.0;
+               moldyn.cutoff_square=36.0;
 
                slots=moldyn.cutoff/dr;
                printf("[pair corr calc]\n");