Rh basis set
Hi CCL-people,
I performed a study (geometry optimization) of Rh complexes using B3LYP/LANL2DZ
in Gaussian 94.
Now I want to verify my results using a larger basis set at the Rh center.
Since simple uncontraction of (341/321/31) in LANL2DZ might not be an
appropriated way to get a larger basis set I would like to ask for suggestions,
experiences and references about larger basis sets for Rh!!
Please respond directly to: philfen { *at * } chem.wisc.edu
I 'll post a summary.
Peter
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Peter Hilfenhaus
University of Wisconsin
1101 W. University Avenue
Madison, WI 53706, U.S.A.
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