[Wien] LAPW2C stop

[Lyudmila Dobysheva]

03.03.2012 13:07, Zahia Aboub пишет:
> I use 40 atoms the LAPW2C not finished (he running 3 day )

Laurence is right that you use the system without symmetries that are 
present there, though, maybe, you want just that case.
Nevertheless, I tested both cases (yours and that of Laurence). Your 
structure file takes 16 minutes for 1 k-point with normal usual 
settings, and the second takes 2 minutes. Three days is rather long even 
for your file. So, either you took unusual parameters in other 
initializing files, or there is something wrong in your 
machine/compilation/options/...
Check how much time it takes for one k-point in both cases.

> the file structure is

Please, in the next letters, when you give initialized files, do it in 
attachments: mailing programs often distort their content and manual 
correction is then necessary to check them.

Best wishes
   Lyudmila Dobysheva
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