loading system configuration
loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_8GPU/mccode_config.json
INFO: Using directory: "2"
INFO: Using existing c-file: ./templateTOF.c
INFO: Using existing binary: ./templateTOF.out
INFO: ===
Simulation 'templateTOF' (/home/nexmap/pkwi/TESTS/2023-02-01/McStas_8GPU_5e7/templateTOF/templateTOF.instr): running on 5 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1).
Have found 5 GPU devices on rank 2. Will use device 2.
Have found 5 GPU devices on rank 3. Will use device 3.
Have found 5 GPU devices on rank 4. Will use device 4.
Have found 5 GPU devices on rank 1. Will use device 1.
Have found 5 GPU devices on rank 0. Will use device 0.
templateTOF: lambda=1.57446 [Angs], k=3.9907 [Angs-1], v=2512.63 [m/s], E=33 [meV]. Time=[0.000373114 0.000497486 0.000746229]
templateTOF: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry.
templateTOF: container is Nb.laz (outer cylinder)
templateTOF: external environment is Al.laz
templateTOF: lambda=1.57446 [Angs], k=3.9907 [Angs-1], v=2512.63 [m/s], E=33 [meV]. Time=[0.000373114 0.000497486 0.000746229]
templateTOF: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry.
templateTOF: container is Nb.laz (outer cylinder)
templateTOF: external environment is Al.laz
templateTOF: lambda=1.57446 [Angs], k=3.9907 [Angs-1], v=2512.63 [m/s], E=33 [meV]. Time=[0.000373114 0.000497486 0.000746229]
templateTOF: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry.
templateTOF: container is Nb.laz (outer cylinder)
templateTOF: external environment is Al.laz
templateTOF: lambda=1.57446 [Angs], k=3.9907 [Angs-1], v=2512.63 [m/s], E=33 [meV]. Time=[0.000373114 0.000497486 0.000746229]
templateTOF: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry.
templateTOF: container is Nb.laz (outer cylinder)
templateTOF: external environment is Al.laz
templateTOF: lambda=1.57446 [Angs], k=3.9907 [Angs-1], v=2512.63 [m/s], E=33 [meV]. Time=[0.000373114 0.000497486 0.000746229]
templateTOF: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry.
templateTOF: container is Nb.laz (outer cylinder)
templateTOF: external environment is Al.laz
[templateTOF] Initialize
[templateTOF] Initialize
[templateTOF] Initialize
[templateTOF] Initialize
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Nb.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Nb.laz' (Table_Read_Offset)
Isotropic_Sqw: Sample_in: is a hollow cylinder: radius=0.005000 thickness=0.000100 height=0.016800 [J Comp Phys 228 (2009) 5251]
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset)
[templateTOF] Initialize
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset)
Isotropic_Sqw: Sample_in: Temperature set to T=350 [K]
Isotropic_Sqw: Sample_in: S(q,w) data from Rb_liq_inc.sqw (inc) assumed to be classical (symmetrised in energy).
Isotropic_Sqw: Sample_in: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_inc.sqw file (classical/symmetric) using 'Frommhold' quantum correction
Isotropic_Sqw: Sample_in: Generated Rb_liq_inc.sqw incoherent Sqw
                   q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.985192 size=[101x10185] sigma=0.5 [barns]
                   normalization factor S(q,w)*0.492586 (auto) \int q^2 S(q) dq=676.701
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset)
Isotropic_Sqw: Sample_in: Temperature set to T=350 [K]
Isotropic_Sqw: Sample_in: S(q,w) data from Rb_liq_coh.sqw (coh) assumed to be classical (symmetrised in energy).
Isotropic_Sqw: Sample_in: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_coh.sqw file (classical/symmetric) using 'Frommhold' quantum correction
Isotropic_Sqw: Sample_in: Generated Rb_liq_coh.sqw coherent Sqw
                   q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.887933 size=[101x10185] sigma=6.32 [barns]
                   normalization factor S(q,w)*0.477012 (auto) \int q^2 S(q) dq=698.369
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Nb.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Nb.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset)
Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset)
*** TRACE end *** 

Save [templateTOF]
Detector: M_total_I=5.23005e-09 M_total_ERR=3.80767e-11 M_total_N=3.26222e+06 "M_total_1675224702.E_th"
Detector: M_single_coh_I=6.03782e-10 M_single_coh_ERR=8.07122e-13 M_single_coh_N=2.43183e+06 "M_single_coh_1675224702.E_th"
Detector: M_single_inc_I=4.99273e-11 M_single_inc_ERR=2.29669e-13 M_single_inc_N=201589 "M_single_inc_1675224702.E_th"
Detector: M_multi_I=1.47575e-12 M_multi_ERR=8.15912e-15 M_multi_N=585397 "M_multi_1675224702.E_th"

Finally [templateTOF: 2]. Time: 12 [s] 

Finally [templateTOF: 2]. Time: 12 [s] 

Finally [templateTOF: 2]. Time: 12 [s] 
Detector: M_env_container_I=4.58252e-09 M_env_container_ERR=3.80677e-11 M_env_container_N=94519 "M_env_container_1675224702.E_th"

Finally [templateTOF: 2]. Time: 11 [s] 

Finally [templateTOF: 2]. Time: 12 [s] 
Isotropic_Sqw: Sample_in: 102244 neutron events (out of 3724813) that should have
               scattered were transmitted because scattering conditions
WARNING        could not be satisfied after 100 tries.
Isotropic_Sqw: Sample_in: 13 neutron events (out of 3622569) reached
WARNING        unrealistic weight. The S(q,w) norm might be too high.
Isotropic_Sqw: Sample_in: Scattering fraction=0.00202175 of incoming intensity
               Absorption fraction           =0.0474841
               Single   scattering intensity =6.69476e-10 (coh=3.63769e-10 inc=3.05708e-10)
               Multiple scattering intensity =4.14885e-12
Isotropic_Sqw: Environment_out: 1 neutron events (out of 505721) that should have
               scattered were transmitted because scattering conditions
WARNING        could not be satisfied after 100 tries.
INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2023-02-01/McStas_8GPU_5e7/templateTOF/templateTOF.instr in dataset 2