Re: CCL:Semiempirical vibration frequencies

From: "Jens Spanget-Larsen" <spanget-.at.-virgil.ruc.dk>
Organization: Roskilde Universitetscenter
Subject: Re: CCL:Semiempirical vibration frequencies
Date: Wed, 10 Nov 2004 17:11:02 +0100

John,
 A.P. Scott & L. Radom, J. Phys. Chem. 1996, 100, 16502-16513,
 compare the vibrational frequencies predicted by AM1 and PM3
 with those obtained with a variety of HF, MP2, QCISD, and DFT
 procedures.
 Jens >--<
 > CCLers,
 >
 > Could anyone point me to references comparing vibration frequencies from
 > semiempirical methods with those fron ab initio or DFT?
 >
 > Many thanks!
 >
 > John McKelvey
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