[Pw_forum] repeated band structure calculation in, splittet phonon calculation
thomas.gruber at physik.tu-freiberg.de
Fri Aug 5 14:02:47 CEST 2011
>> Or did I something wrong and it should work?
> what should work in which case and with which version of the code
I wanted to know, if I can use "wf_collect = .true." in an scf run,
which is used for input of an splittet phonon calculation with QE 4.3.1.
Part of the &inputph for ph.x would look like this.
to create the pattern:
run mode 11 on q-point 8:
and the final run with all the *.xml file:
When I calculate everything on one core, it works. But when I run the
scf on multiple cores and use "wf_collect = .true." then the following
error occurs, when I run the splittet jobs on multiple core (but not on
one core) or at the final run (even with one core):
from openfilq : error # 1
file $prefix.wfc not found
Thanks already for your help.
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