[Pw_forum] ph.x v3.2 on NEC SX-8

[Axel Kohlmeyer]

On Thu, 4 Jan 2007 wlyim at puccini.che.pitt.edu wrote:

WY> **************************************************************************
WY> 
WY> Is there any benchmark test on NEC machine for the latest version of 
WY> espresso?

william,
there are a bunch of examples for all kinds of calculations in
the example subdirectory. those are regularly tested on a few platforms.
please try a few of those (see the README files for descriptions)
and see if they work reasonably. this might help to identify the
source of the problem.

cheers,
   axel.

WY> 
WY> Best regards,
WY> William
WY> 
WY> 

-- 
=======================================================================
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
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If you make something idiot-proof, the universe creates a better idiot.