Execution Time32.07s

Test: UNRES_M_MD_microcanonical (Passed)
Build: devel Linux-pgi-MPI-DFA E0LL2Y (dell15) on 2020-03-19 15:58:01
Repository revision: 65a74fce67c215adace99cc576a5bbdbefb64321

Energy 1l2y_micro

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Test output
CTEST_FULL_OUTPUT
--------------------------------------------------------------------------
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
--------------------------------------------------------------------------
[dell15:170402] [[14611,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
Warning: ieee_denorm is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
 2  
    
 2  
    
 indpdb=            0  pdbref=  T
 Call Read_Bridge.
 ns=            0
 ns=            0
 Total wall clock time    31.34437144920230       sec
 Processor            0  BROADCAST time   0.5591970942914486       REDUCE time 
    1.819189697504044       GATHER time    0.000000000000000       SCATTER time
 Processor            1  CG group            0  absolute rank            1 
  leves ERGASTULUM.
 Processor            1  wait times for respective orders order[            0 ]
    0.1430058404803276       order[            1 ]   0.2542302832007408      
  order[            2 ]    0.000000000000000       order[            3 ] 
    0.2744009494781494       SENDRECV    0.000000000000000       BARRIER ene 
   0.2004275321960449       BARRIER grad   0.1589081846177578     
CG processor   0 is finishing work.
    0.000000000000000       order[            4 ]    1.775370303541422      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]   0.5016968473792076      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
average total energy  79.6052
standard deviation  0.000629652