From owner-chemistry@ccl.net Fri Feb 3 08:57:01 2006 From: "Anastasios Papadopoulos anastp.:.chem.auth.gr" To: CCL Subject: CCL: Polarization functions Ag atom Message-Id: <-30768-060203052702-7069-wVyHGiFQEfUrpTWJ8TpocA[A]server.ccl.net> X-Original-From: Anastasios Papadopoulos Content-Disposition: inline Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset=ISO-8859-7; format="flowed" Date: Fri, 03 Feb 2006 12:26:53 +0200 MIME-Version: 1.0 Sent to CCL by: Anastasios Papadopoulos [anastp : chem.auth.gr] Hi CCL subsscribers. I run Ag,Cu clusters using BP86 method and LANL2DZ basis set, in Gausssian 03W B-02 package.In addition, I added extrabasis in Cu atom (6-31G(3d)).Moreover, I want to add an extra f polarization function in Ag atom.Could someone inform me,which coefficients and exponennts exist for f function or where I can find polarization functions for Ag atom? Yours, Tasos G. Papadopoulos Laboratory of Applied Quantum Chemistry, Faculty of Chemistry, Aristotle University of Thessaloniki,Greece.