Re: AMBER: Help reg. input file

From: FyD <>
Date: Wed, 02 Jan 2008 20:34:40 +0100

Quoting snoze pa <>:

> Hi, I am trying to study the Zn-porphyrin system using gaussian. I did the
> whole opt using gaussian. However I want to split the molecule into two
> parts, Zn and P.
> Does anyone have the gaussian input script for such system available. only
> input file is needed in gaussian .gjf or .com format.

My feeling is this is a bad idea to split Zn & porphyrin...

regards, Francois

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Received on Sat Jan 05 2008 - 00:03:22 PST
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