From: Axel Kohlmeyer (akohlmey_at_cmm.chem.upenn.edu)
Date: Mon Jun 01 2009 - 09:00:36 CDT
On Sun, 2009-05-31 at 23:52 -0400, KIRTANA S wrote:
> While running my simulation I am getting the following error .I would
> like to have suggestions on what does it imply .What should I use for
it implies that there are no parameters for atoms of type AU.
> atom type for gold .
you'd have to "find" them and add them to your parameter file.
axel.
>
>
> ------------- Processor 0 Exiting: Called CmiAbort ------------
> Reason: FATAL ERROR: DIDN'T FIND vdW PARAMETER FOR ATOM TYPE AU
> Charm++ fatal error:
> FATAL ERROR: DIDN'T FIND vdW PARAMETER FOR ATOM TYPE AU
>
> Abort (core dumped)
>
> Thanks
-- ======================================================================= Axel Kohlmeyer akohlmey_at_cmm.chem.upenn.edu http://www.cmm.upenn.edu Center for Molecular Modeling -- University of Pennsylvania Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323 tel: 1-215-898-1582, fax: 1-215-573-6233, office-tel: 1-215-898-5425 ======================================================================= If you make something idiot-proof, the universe creates a better idiot.
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