Execution Time31.38s

Test: UNRES_M_MD_microcanonical (Failed)
Build: devel Linux-pgi-MPI E0LL2Y (dell15) on 2020-03-16 04:59:33
Repository revision: b59690b0ebfce87b007ce94182bcda480835ce71

Exit Value1

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Test output
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WARNING: Linux kernel CMA support was requested via the
btl_vader_single_copy_mechanism MCA variable, but CMA support is
not available due to restrictive ptrace settings.

The vader shared memory BTL will fall back on another single-copy
mechanism if one is available. This may result in lower performance.

  Local host: dell15
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 2  
    
 2  
    
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 indpdb=            0  pdbref=  T
 Call Read_Bridge.
 ns=            0
 ns=            0
[dell15:22216] 1 more process has sent help message help-btl-vader.txt / cma-permission-denied
[dell15:22216] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
 Total wall clock time    30.18747583776712       sec
 Processor            0  BROADCAST time   0.4988176710903645       REDUCE time 
 Processor            1  CG group            0  absolute rank            1 
  leves ERGASTULUM.
 Processor            1  wait times for respective orders order[            0 ]
    0.1605509519577026       order[            1 ]   0.2047948352992535      
    1.706330820918083       GATHER time    0.000000000000000       SCATTER time
    0.2587594240903854       SENDRECV    0.000000000000000       BARRIER ene 
   0.4128516018390656       BARRIER grad   0.2396758943796158     
  order[            2 ]    0.000000000000000       order[            3 ] 
    0.000000000000000       order[            4 ]    1.381892893463373      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]   0.4189893007278442      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
CG processor   0 is finishing work.
Warning: ieee_denorm is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_inexact is signaling
Bye Bye...
average total energy  79.6052
standard deviation  0.000629652
average total energy  79.6052
standard deviation  0.000629652
difference  5.3429 from reference ave etot 74.2623 greater than 5.0
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Primary job  terminated normally, but 1 process returned
a non-zero exit code. Per user-direction, the job has been aborted.
--------------------------------------------------------------------------
difference  5.3429 from reference ave etot 74.2623 greater than 5.0
--------------------------------------------------------------------------
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: [[63099,1],1]
  Exit code:    1
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