CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
MPI: node= 0 iseed= -3059742
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
dc 65.917000000000002
dc 65.917000000000002 122.68350000000001 48.083500000000001
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 1663
# eval/s 136.58206322006680
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 12.295026063919067 sec
Processor 0 BROADCAST time 7.6205730438232422E-003 REDUCE time 5.3933858871459961E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 6.0820579528808594E-003 BARRIER grad 2.9857158660888672E-003
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 7.7586412429809570E-002 order[ 1 ] 0.50536894798278809 order[ 2 ] 2.3253431444384039E-310 order[ 3 ] 2.3253431350380144E-310 order[ 4 ] 0.0000000000000000 order[ 5 ] 6.9532107543731961E-310 order[ 6 ] 2.3253439767485054E-310 order[ 7 ] 2.7607643604278564 order[ 8 ] 2.3253439777789287E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9532107543858442E-310
SUMSL return code 23
ERROR = SUMSL return code 23 is not 4
but not failing this test, it is known problem with esccor
CRITICAL: energy is loo large 40.293100, ene= -283.400000