CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
MPI: node= 0 iseed= -3059742
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 0
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 161.60647737499718
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 10.416198015213013 sec
Processor 0 BROADCAST time 1.1518478393554688E-002 REDUCE time 8.0585956573486328E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.0392665863037109E-002 BARRIER grad 1.5774965286254883E-002
Processor 1 wait times for respective orders order[ 0 ] 0.18039846420288086 order[ 1 ] 0.48995327949523926 order[ 2 ] 2.3568387880822572E-310 order[ 3 ] 2.3568387786818678E-310 order[ 4 ] 0.0000000000000000 order[ 5 ] 6.9528327962323653E-310 order[ 6 ] 2.3568396203923588E-310 order[ 7 ] 2.3762788772583008 order[ 8 ] 2.3568396214227821E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9528327962450134E-310
CG processor 0 is finishing work.
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