Subject: Molybdenum basis set?

From: [email-masked] (Christopher Cramer)
Date: Tue, 27 Oct 1998 11:42:18 -0600 (CST)

Can anyone recommend a good basis set for molybdenum? I'd prefer
all-electron, approximately double-zeta in quality, contracted-gaussian. A
search of the PNL website was not particularly helpful. Having never played
with this atom before, I'd be happy to receive expert advice prior to
charging off.

CJC
-- 

Christopher J. Cramer
University of Minnesota
Department of Chemistry
207 Pleasant St. SE
Minneapolis, MN 55455-0431
--------------------------
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[email-masked]
http://pollux.chem.umn.edu/~cramer