Execution Time21.32s

Test: UNRES_M_MD_microcanonical (Passed)
Build: Linux-pgi-MPI E0LL2Y (dell15) on 2023-05-30 04:14:21
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6


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Test output
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[dell15:83989] [[59559,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
[dell15:83989] [[59559,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           51  opened
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           51  opened
 MPI: node=             0  iseed=                  -3059742
 indpdb=            0  pdbref=  T
 Call Read_Bridge.
 ns=            0
 ns=            0
 Total wall clock time    20.68112433422357       sec
 Processor            0  BROADCAST time   0.5600524703040719       REDUCE time 
 Processor            1  CG group            0  absolute rank            1 
    1.864266199991107       GATHER time    0.000000000000000       SCATTER time
    0.2798486584797502       SENDRECV    0.000000000000000       BARRIER ene 
   0.4913425836712122       BARRIER grad   0.1713439403101802     
CG processor   0 is finishing work.
  leves ERGASTULUM.
 Processor            1  wait times for respective orders order[            0 ]
    0.5727232992649078       order[            1 ]   0.2187799289822578      
  order[            2 ]    0.000000000000000       order[            3 ] 
    0.000000000000000       order[            4 ]    1.393555527552962      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]   0.5118017811328173      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
Warning: ieee_invalid is signaling
Warning: ieee_invalid 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_inexact is signaling
Bye Bye...
average total energy  74.2698
standard deviation  0.000916244
average total energy  74.2698
standard deviation  0.000916244