From chemistry-request "-at-" server.ccl.net Tue May 21 18:39:06 2002
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Date: Tue, 21 May 2002 17:39:03 -0500 (CDT)
From: Caroline Taylor <cmtaylor;at;trivial.uchicago.edu>
To: CHEMISTRY # - at - # ccl.net
Subject: ccsd in g98
Message-ID: <Pine.LNX.4.21.0205211736500.668-100000 -x- at -x- trivial.uchicago.edu>
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Hi there. 

I was wondering if anyone had a feel for  how reliable the CCSD
implementation in Gaussian98 is for open shell systems? 

We're seeing some odd results, and I'd like to rule this out as a problem.

Thanks!

-Caroline

-- 
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Caroline M. Taylor
Department of Chemistry
University of Chicago, James Franck Institute
5640 S. Ellis Avenue
Chicago, Illinois 60637
(773) 702-7223
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