CCL:G: Fragment calculation
- From: "Rosana Marques Amorim" <amorimrm a
superig.com.br>
- Subject: CCL:G: Fragment calculation
- Date: Fri, 18 Nov 2011 00:25:57 -0200
Sent to CCL by: "Rosana Marques Amorim" [amorimrm++superig.com.br]
Partha,
I think you can use onion calculation to do this.
Rosana Amorim
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From: "Partha P Kundu partha1kundu[A]yahoo.com"
<owner-chemistry]^[ccl.net>
Sent: Thursday, November 17, 2011 4:12 PM
To: "Amorim, Rosana " <amorimrm]^[superig.com.br>
Subject: CCL:G: Fragment calculation
Sent to CCL by: "Partha P Kundu" [partha1kundu=-=yahoo.com]
Dear All,
I want to optimize a structure with different charge on different
parts of
system. Is it possible to do in Gaussian 03?
Thanks in advance.
Partha.>