[Pw_forum] NEB: enexpected number of dimensons in ngg
BarnardEP at ufs.ac.za
Fri Jun 24 11:16:49 CEST 2011
I seem to have solved the problem I had experienced with Quantum espresso 4.2.1 in the NEB code. I got the following error: Unexpected number if dimensions in ngg.If you make the number of pools 1 then no error occurs. So I assume there is a bug in that part of the code, where you parallelize with respect to your k-points.
University of the Free State
University of the Free State: This message and its contents are subject to a disclaimer.
Please refer to http://www.ufs.ac.za/disclaimer for full details.
Universiteit van die Vrystaat:
Hierdie boodskap en sy inhoud is aan 'n vrywaringsklousule onderhewig.
Volledige besonderhede is by http://www.ufs.ac.za/vrywaring beskikbaar.
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the users