[gpaw-users] get_projections_error
d.davelou at materials.uoc.gr
d.davelou at materials.uoc.gr
Tue Mar 1 13:08:41 CET 2016
Dear all,
I try to calculate the probabilties of the wavefunctions of my
structure and I keep getting this error:
--------------------------------------
File
"/gpfs/buildsets/eb150518/software/GPAW/0.10.0.11364-goolf-1.4.10-Python-2.7.3/lib/python2.7/site-packages/gpaw/aseinterface.py", line 621, in
get_projections
GPAW CLEANUP (node 11): <type 'exceptions.AssertionError'> occurred.
Calling MPI_Abort!
assert wfs.gd.comm.size == 1
---------------------------------------
Best regards,
Davelou Daphne
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