CCL: Using multiple basis sets in G09



 Sent to CCL by: "Ol  Ga" [eurisco1[A]pochta.ru]
 Dear Bradley Kenneth Welch,
 An example special for your case:
 # b3lyp/Gen pseudo=read  {additional keywords}
 comment
 0 1 <---- just an example
 {coordinates}
 {blank line}
 C, Cl, O, N 0
 6-311g*
 ****
 Pt 0
 Lanl2DZ
 ****
 {blank line}
 Pt 0
 Lanl2DZ
 Sincerely,
 Ol Ga
 --------------------------------------------------
 > From: "Bradley Kenneth Welch bwelch5(!)slu.edu"
 <owner-chemistry],[ccl.net>
 Sent: Thursday, June 24, 2010 9:28 PM
 To: "Ga, Ol " <eurisco1],[pochta.ru>
 Subject: CCL: Using multiple basis sets in G09
 >
 >
 > Sent to CCL by: "Bradley  Kenneth Welch" [bwelch5-,-slu.edu]
 > Good afternoon everyone,
 >
 >
 > I am starting a computational project  and I need some technical
 assistance. I
 > need to set up an input file for an optimisation of a platinum complex. I
 need
 > to use a basis set to account for the platinum (LanL2DZ specifically), and
 > another to account for N,Cl,O, and C (6-311G). In my G09 input file, how
 would
 > I set it up to use multiple basis sets?
 >
 >
 > Bradley Welch
 > Undergraduate
 > Department of Chemistry
 > Saint Louis University
 > Monsanto Hall, RM 218
 > 3501 Laclede Ave.
 > St. Louis, Mo 63103-2010
 > email: bwelch5#slu.edu
 >
 >
 >