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 149.04366470023797
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 11.334019184112549 sec
Processor 0 BROADCAST time 1.0895490646362305E-002 REDUCE time 9.3182325363159180E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.0425090789794922E-002 BARRIER grad 1.0145902633666992E-002
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 0.10626983642578125 order[ 1 ] 0.51032304763793945 order[ 2 ] 2.3430202833173255E-310 order[ 3 ] 2.3430202739169360E-310 order[ 4 ] 0.0000000000000000 order[ 5 ] 6.9527189155800338E-310 order[ 6 ] 2.3430211156274270E-310 order[ 7 ] 2.5562179088592529 order[ 8 ] 2.3430211166578503E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9527189155926819E-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