func2b is now again real func2b ... still -> nan! :/

[physik/posic.git] / sic.c

diff --git a/sic.c b/sic.c
index 26bb8c8..d6e85fb 100644 (file)
--- a/sic.c
+++ b/sic.c
@@ -106,7 +106,6 @@ int main(int argc,char **argv) {
        printf("[sic] creating atoms\n");
        create_lattice(&md,DIAMOND,LC_SI,SI,M_SI,
                       ATOM_ATTR_1BP|ATOM_ATTR_2BP|ATOM_ATTR_3BP|ATOM_ATTR_HB,
-                      //ATOM_ATTR_1BP|ATOM_ATTR_2BP|ATOM_ATTR_3BP,
                       //ATOM_ATTR_2BP|ATOM_ATTR_HB,
                       0,5,5,5);