Re: [AMBER] Antechamber Error

From: David Cantu <cantudav.gmail.com>
Date: Wed, 22 Jun 2011 17:11:31 -0500

I know how to change the verbosity, but how (ie which file do I edit, or
command) do I set tight_p_conv to zero and change the scfconv criterion?

Thanks,

David

On Wed, Jun 22, 2011 at 12:17 PM, David A Case <case.biomaps.rutgers.edu>wrote:

> On Wed, Jun 22, 2011, David Cantu wrote:
> >
> > I tried optimizing the geometry of the molecule on Gamess, and then
> opening
> > in Antechamber but still keep getting the same error...
>
> Are you able to post the input files you are using? The convergence gurus
> here can take a look. Or, you can set verbosity to 1, set tight_p_conv to
> 0,
> and make the scfconv convergence criterion looser.
>
> ...dac
>
>
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Received on Wed Jun 22 2011 - 15:30:03 PDT
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