[Wien] about parallel calculation,

Jorissen Kevin Kevin.Jorissen at ua.ac.be
Mon Feb 28 17:43:11 CET 2005


In your previous and this mail, you talk about a .machine file.
 
Wien doesn't care about .machine files.  It wants a .machines file.
 
 
 
Kevin Jorissen
 
EMAT - Electron Microscopy for Materials Science   (http://webhost.ua.ac.be/emat/)
Dept. of Physics
 
UA - Universiteit Antwerpen
Groenenborgerlaan 171
B-2020 Antwerpen
Belgium
 
tel  +32 3 2653249
fax + 32 3 2653257
e-mail kevin.jorissen at ua.ac.be
 

________________________________

Van: wien-admin at zeus.theochem.tuwien.ac.at namens Yushan Wang
Verzonden: ma 28-2-2005 16:44
Aan: wien at zeus.theochem.tuwien.ac.at
Onderwerp: [Wien] about parallel calculation,



Dear user,
the IT assot told me that he had set well for the parallel calcualtion.
the following is what I did:

I edit the .machine file as follows:
................................
1:localhost
1:localhost
granularity:1
extrafine
......................
and before run SCF, I flag the "parallel"
and start my SCF, but, I failed.

please help me pointing out what wrong that I have done. noting My machine
have two CPUs.

yushan

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