From owner-chemistry "-at-" ccl.net Tue Aug 31 08:19:00 2010
From: "Billy McCann bwm0005%%auburn.edu" <owner-chemistry_+_server.ccl.net>
To: CCL
Subject: CCL:G: Visualization of G09 output
Message-Id: <-42654-100830192310-20483-fVkajqfTBbsybBC4IKOkeQ_+_server.ccl.net>
X-Original-From: Billy McCann <bwm0005-.-auburn.edu>
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Date: Mon, 30 Aug 2010 18:22:30 -0500
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Sent to CCL by: Billy McCann [bwm0005~~auburn.edu]

  Greetings.

For visualization of Gaussian 09 calculations in Gaussian 03, Molekol 
has a bash script to do this very thing available at

ftp://ftp.cscs.ch/out/molekel/molekel_5.4/convG09to03.sh

The main action of the script is a sed call:

cat $1 | sed "s/Gaussian 09/Gaussian 03/" | sed "s/Eigenvalues -- 
/EIGENVALUES -- /" | sed "s/Density Matrix:/DENSITY MATRIX./"  | sed "s/ 
Atom  AN/Atom AN/" > $2

which is identical to Marcel Swart's command, with some additions for 
eigenvalues and density matrices.  $1 is the input file; $2 will be the 
output file.

Using this will enable you to even view normal modes.


Hope this helps,

Billy McCann