[Pw_forum] A question about Gamma-point calculation

[Paolo Giannozzi]

On Tuesday 30 August 2005 12:10, Chaohao Hu wrote:

> [...]  for a larger supercell (LaNi5-xMx and its hydrides), this task 
> will stop when calculating the fifth or sixth irreducible representations.
> Why??? 

why, nobody can tell for sure on the basis of available information!
Likely explanations:
- not enough memory
- not enough disk space
- cpu time limit 

P.
-- 
Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
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