fixed tersoff virial calc

[physik/posic.git] / bond_analyze.c

diff --git a/bond_analyze.c b/bond_analyze.c
index cc1c3189e155c2e181bc13579684bdba5ae554db..6c46251f14dd4ecd2b18a1bbb94c76f1a9028757 100644 (file)
--- a/bond_analyze.c
+++ b/bond_analyze.c
@@ -49,6 +49,9 @@ int main(int argc,char **argv) {
        set_potential(&moldyn,MOLDYN_POTENTIAL_AM);
        albe_mult_set_params(&moldyn,SI,C);
 
+       /* link cell init */
+       link_cell_init(&moldyn,VERBOSE);
+
        /* analyzing ... */
        bond_analyze(&moldyn,quality);