INFO: Using directory: "1"
INFO: Using existing c-file: ./templateNMX.c
INFO: Using existing binary: ./templateNMX.out
WARNING: Ignoring invalid parameter: "templateNMX"
INFO: ===
Simulation 'templateNMX' (/home/nexmap/pkwi/TESTS/2023-11-01/McStas_CPU_MPICC_KISS_1e7/templateNMX/templateNMX.instr): running on 8 nodes (master is 'panda2.fysik.dtu.dk', MPI version 3.1).
[templateNMX] Initialize
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rubredoxin.lau' (Table_Read_Offset)
[templateNMX] Initialize
[templateNMX] Initialize
[templateNMX] Initialize
[templateNMX] Initialize
[templateNMX] Initialize
[templateNMX] Initialize
[templateNMX] Initialize
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Mode: lengths and angles
Single_crystal: Rubredoxin.lau structure a=33.92 b=34.928 c=43.532 aa=90 bb=90 cc=90 V0=51574.9
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]
Single_crystal: sample: Read 124956 reflections from file 'Rubredoxin.lau'
Single_crystal: sample: Vc=51574.9 [Angs] sigma_abs=245.31 [barn] sigma_inc=817.57 [barn] reflections=Rubredoxin.lau
Direct space lattice orientation:
  a = [0 34.928 2.13872e-15]
  b = [0 0 33.92]
  c = [43.532 2.66557e-15 2.66557e-15]
Reciprocal space lattice orientation:
  a* = [-1.10151e-17 0.17989 0]
  b* = [-1.13424e-17 -1.13424e-17 0.185235]
  c* = [0.144335 0 0]

Trace ETA 7.15 [min] % 2 
Trace ETA 10 [s] % 102 
Trace ETA 1 [s] % 702 
Trace ETA 2 [s] % 402 
Trace ETA 2 [s] % 502 
Trace ETA 3 [s] % 302 
Trace ETA 5 [s] % 202 
Trace ETA 1 [s] % 602 710 210 510 410 110 310 610 10 720 520 120 220 420 620 320 20 730 530 130 230 430 630 330 30 740 540 140 240 440 640 340 40 750 550 150 250 450 650 350 50 760 560 160 260 460 360 660 60 770 570 170 270 470 370 670 70 780 580 180 280 480 380 680 80 790 590 190 290 490 390 690 90 *** TRACE end *** 

Save [templateNMX]

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 
Detector: det_I=5578.85 det_ERR=2.18708 det_N=6.76246e+06 "psd.dat"

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 

Finally [templateNMX: 1]. Time: 6.91667 [min] 
INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2023-11-01/McStas_CPU_MPICC_KISS_1e7/templateNMX/templateNMX.instr in dataset 1