[AMBER] Looking for parameters for a metal-organic compound

From: Kat Russell <katjrussell.gmail.com>
Date: Thu, 2 Aug 2012 14:10:08 -0400

I am looking for the parameters for a cerium oxygen compound. I found
information on Organocerium chemistry, so I am assuming that someone else
has done work in this area. If you could help me locate the information, I
would greatly appreciate it. We have decided that there is no immediate
need to use QM parameters or do QM calculations, this is more of a
superficial simulation, but our current simulation programs are not meant
for organic molecules. (I will be grouping the ceria informations with an
animo acid)

Thanks!
-- 
Kat Russell
Alfred University
B.S. Glass Science and Engineering Candidate Dec 2012
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Received on Thu Aug 02 2012 - 11:30:03 PDT
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