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