[gpaw-users] Regarding 'RuntimeError: Atoms objects on different processors are not identical!'
Hanne Falsig
hafa at topsoe.dk
Mon Mar 2 11:30:18 CET 2015
Dear all,
I get the following error message:
RuntimeError: Atoms objects on different processors are not identical!
I can see there have been a number of questions about this. Did someone
find a solution to this problem?
My input is:
calc =
GPAW(xc='BEEF-vdW',kpts=[1,1,1],h=0.20,mixer=MixerSum(),spinpol=True,
maxiter=300,occupations=FermiDirac(width=0.1),txt='gpaw.txt')
We use gpaw version 0.10.0.11364
Best regards,
Hanne
Hanne Falsig
Research Scientist | Physical Analytical, R&D
Haldor Topsoe A/S
Nymøllevej 55, DK-2800 Kgs. Lyngby
Phone (direct): +45 2275 4776
Switchboard: +45 4527 2000
Read more at www.topsoe.com
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