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quantum_espresso [2015/11/10 20:36]
root
quantum_espresso [2015/11/11 19:41]
root
Line 49: Line 49:
 </​csv>​ </​csv>​
 (1) Fails with error [[http://​www.quantum-espresso.org/​faq/​frequent-errors-during-execution/#​5.6|charge is wrong]]. (1) Fails with error [[http://​www.quantum-espresso.org/​faq/​frequent-errors-during-execution/#​5.6|charge is wrong]].
 +
 +** Notes **
 +
 +Each run fails with error messages (depending on MPI type) and RC 1 after terminating normally according to the log. This appears harmless:
 +
 +<​code>​
 +   This run was terminated on:  13: 2:44  11Nov2015 ​           ​
 +=------------------------------------------------------------------------------=
 +   JOB DONE.
 +=------------------------------------------------------------------------------=
 +-------------------------------------------------------
 +Primary job  terminated normally, but 1 process returned
 +a non-zero exit code.. Per user-direction,​ the job has been aborted.
 +-------------------------------------------------------
 +------------------------------------------------------------
 +A process or daemon was unable to complete a TCP connection
 +to another process:
 +etc.
 +</​code>​
  
 ** Continuing Work ** ** Continuing Work **
quantum_espresso.txt · Last modified: 2016/02/12 20:39 by root