CCL:G: GAUSSIAN-basis sets



 Sent to CCL by: Debellis Anthony CE US [anthony.debellis ~~ cibasc.com]
 Julie,
 You should consult the Gaussian manual under the keywords GEN, GENECP,
 and PSEUDO.  The use of mixed basis sets is explained there.
 Anthony
 -----Original Message-----
 > From: owner-chemistry..ccl.net [mailto:owner-chemistry..ccl.net]
 Sent: Monday, September 17, 2007 9:07 PM
 To: Debellis Anthony CE US
 Subject: CCL:G: GAUSSIAN-basis sets
 Sent to CCL by: "Julie H Hwang" [jhwang5=-=mail.rochester.edu] Dear
 all,
 Hi I have a question on choosing basis set(s).
 I want to calculate Raman spectra peaks for ferrocene and I was
 wondering if I can choose different basis sets for non-metals (C and H)
 and metal (Fe).
 I tried to look up the Gaussian manual, but they didn't specify the
 availability of such option.
 Thank you for your time!
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