[Pw_forum] Germanuim [0qq] problem ....

Paolo Giannozzi giannozz at nest.sns.it
Mon Sep 1 16:00:07 CEST 2003


On Monday 01 September 2003 15:35, sprokuda at dnk.ru wrote:
> [...]  But tell me - how it could be that the same input script works
> for Si, but it doesn't for Ge, while this structures are very similar?

the two scripts are not "the same", they are "very similar", which 
doesn't imply that both are correct

> My nscf output file is in attachment.

I don't see anything wrong in it

Paolo

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Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050509412
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