[QE-users] users Digest, Vol 139, Issue 1

Timrov Iurii iurii.timrov at epfl.ch
Sun Apr 28 17:44:09 CEST 2019


Dear Shaofeng,


Please provide input and output files of your calculation, how many cores did you use, details of the parallelization etc.


Regards,

Iurii


--
Dr. Iurii Timrov
Postdoctoral Researcher
STI - IMX - THEOS and NCCR - MARVEL
Swiss Federal Institute of Technology Lausanne (EPFL)
CH-1015 Lausanne, Switzerland
+41 21 69 34 881
http://people.epfl.ch/265334
________________________________
From: users <users-bounces at lists.quantum-espresso.org> on behalf of wangshaofeng at iae.ac.cn <wangshaofeng at iae.ac.cn>
Sent: Sunday, April 28, 2019 1:08:46 AM
To: users
Subject: Re: [QE-users] users Digest, Vol 139, Issue 1

Dear all,
I met an error when I calculate phonon using lda+U mode.
     Atomic wfc used for the DFT+U projector are NOT orthogonalized

     Calculating the dnsbare matrix...
-------------------------------------------------------
Primary job  terminated normally, but 1 process returned
a non-zero exit code.. Per user-direction, the job has been aborted.
-------------------------------------------------------
--------------------------------------------------------------------------
mpirun detected that one or more processes exited with non-zero status, thus causing
the job to be terminated. The first process to do so was:

  Process name: [[22288,1],2]
  Exit code:    174
--------------------------------------------------------------------------

Can any expert tell me how to get it correct? I am using version 6.4.1.

Best,

shaofeng



________________________________
Shaofeng Wang
Ph.D
Email: wangshaofeng at iae.ac.cn
Key Laboratory of Pollution Ecology and Environmental Engineering
Institute of Applied Ecology
Chinese Academy of Sciences
China

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