[Pw_forum] bands calculation crash

[Paolo Giannozzi]

On Mar 16, 2012, at 11:35 , Davide Tiana wrote:

> I am running some calculations on coordination polymers. I made
> calculations on other 8 molecules and everything was ok. Making
> calculation on this new molecule bands crash pushing out this error:

the error is for the bands.x executable. You should first of all  
understand
under which circumstances it crashes (serial, parallel, always,  
random...)

P.
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Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222