[Pw_forum] Failure during collective

Filippo Spiga spiga.filippo at gmail.com
Sun Sep 28 09:28:28 CEST 2014


Dear Paresh,

can you send me the exact pseudopotentials you used? My email is filippo.spiga at quantum-espresso.org 

Thanks
F

On Sep 27, 2014, at 6:02 PM, paresh rout <paresh.rout88 at gmail.com> wrote:
> I am getting a strange error while performing scf calculation using two different Hubbard U values for my system. When I use U=3.5 eV  job runs fine but for U=7.4 the job  stops after some iterations(very close to convergence). I tried a lot to overcome this problem but unable to sort out by myself. Any help would be highly appreciated. I attach the Input , output and the error file below .

--
Mr. Filippo SPIGA, M.Sc.
http://filippospiga.info ~ skype: filippo.spiga

«Nobody will drive us out of Cantor's paradise.» ~ David Hilbert

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