In my experience, gaussian is fed an input file of some sort, and outputs a
.log file. There is no xxx.out file that's produced (the xxx.log file is
the output file). At least this is true for gaussian03. I don't know if
things were different for, say, gaussian98 or gaussian09.
Good luck!
Jason
On Wed, May 26, 2010 at 5:00 AM, JoRDi <cyphras.hotmail.com> wrote:
> Hello,
>
> If you're trying to convert the Gaussian output file to the pdb format,
> you really need this file: the Gaussians outuput files has xxx.out
> format, not xxx.log. This file (xxx.log) is just a record of any
> operation / simulation that you had made.
>
> Best regards,
> Jordi.
>
>
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--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Wed May 26 2010 - 07:30:07 PDT
