Re: [AMBER] Antechamber Error

From: David A Case <case.biomaps.rutgers.edu>
Date: Wed, 22 Jun 2011 13:17:51 -0400

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 - 10:30:03 PDT
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