Friday, September 27 2024 13:02:50
UNRES
24.71s| Exit Value | 1 |
|---|
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CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= T ns= 0 Call Read_Bridge. ns= 0 Total wall clock time 24.666790962219238 sec Processor 0 BROADCAST time 0.15859603881835938 REDUCE time 1.0536828041076660 GATHER time 0.0000000000000000 SCATTER time 9.2431545257568359E-002 SENDRECV 0.0000000000000000 BARRIER ene 0.10575366020202637 BARRIER grad 0.11192321777343750 CG processor 0 is finishing work. Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM. Processor 1 wait times for respective orders order[ 0 ] 0.47376775741577148 order[ 1 ] 9.7667217254638672E-002 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 2.2771883010864258 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 0.43083524703979492 order[ 8 ] 2.3255482390179438E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9532800372690674E-310 STOP Bye Bye... STOP Bye Bye... average total energy 74.3154 average total energy 74.3154 standard deviation 0.0598498 standard deviation 0.0598498 difference 36.7884 from reference ave etot 37.527 greater than 5.0 difference 36.7884 from reference ave etot 37.527 greater than 5.0
