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 226.86703691340534
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 7.4230988025665283 sec
Processor 0 BROADCAST time 5.0129890441894531E-003 REDUCE time 3.6410570144653320E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 3.6938190460205078E-003 BARRIER grad 2.6450157165527344E-003
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 4.7042846679687500E-002 order[ 1 ] 0.36240673065185547 order[ 2 ] 2.3306994215788266E-310 order[ 3 ] 2.3306994121784372E-310 order[ 4 ] 0.0000000000000000 order[ 5 ] 6.9525796710907089E-310 order[ 6 ] 2.3307002538889281E-310 order[ 7 ] 1.6707472801208496 order[ 8 ] 2.3307002549193514E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9525796711033569E-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