Subject: basis set for Nickel

From: angelo vargas <[email-masked]>
Date: Tue, 12 Oct 1999 19:07:23 +0200

Can anybody suggest a good basis set for Nickel ( Gaussians )?

I am having problems with the convergence of Ni complexes with Gaussian
98 using a 6-31G** basis set.

Any suggestions are welcome.

Angelo
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Angelo Vargas
Laboratory of Technical Chemistry
Department of Chemical Engineering and Industrial Chemistry
Swiss Federal Institute of Technology (ETHZ)
ETH Zentrum, Universitätsstr. 6    Telefon:  0041/1/632 31 54
CH-8092 Zürich - Switzerland       Fax:      0041/1/632 11 63
E-mail:   [email-masked]
http://mercury.ethz.ch/members/vargas/vargas.html
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