CCL: Opt with Full point group Symmetry in G09



 Sent to CCL by: makowskm__chemia.uj.edu.pl
 Enforcing symmetrization of the density matrix should help. It is done by
 SCF=DSymm.
 >
 > Sent to CCL by: "Mr Mi Yang" [agri_chemist\a/yahoo.com]
 > First of all thanks for replies of Jimenez Vazquez, Cory Pye and others.
 > Actually, I have used Z-matrix made by molden and it works perfect to
 > maintain symmetry in G09 only
 > for small molecules like benzene. But for a Fulleren like molecule to
 > build Z-matrix manually is almost
 > impossible.
 >