INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_IN4.c INFO: Using existing binary: ./ILL_IN4.out INFO: === Simulation 'ILL_IN4' (/home/nexmap/pkwi/TESTS/2022-07-01/McStas_8GPU_5e7/ILL_IN4/ILL_IN4.instr): running on 7 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1). Have found 8 GPU devices on rank 3. Will use device 3. Have found 8 GPU devices on rank 0. Will use device 0. ILL_IN4: Thermal ToF spectrometer Divergence at the lead shutter: dX =2.2026 [deg] Take-off at monochromator: A1 =-20.964 [deg] ; DM=1.677 [Angs] Incident energy: Ei =56.8085 [meV] ; Ki=5.23599 [Angs-1] Incident velocity: Vi =3296.7 [m/s] Source-Mono distance: LRM =10.2086 [m] Virtual Source-Mono distance: d0 =3.52555 [m] Mono-Sample distance: LMS =1.94553 [m] (d1) Curvature at monochromator: RMH =-7.00816 [m] ; RMV=-1.9 [m] Fermi Chopper Frequency: nu =335.376 [Hz] ; rpm=20122.6 [rpm] BC2 phase wrt BC1: PhiBC2=-22.5 [deg] L12=2.45746 [m] delay t12=0.000745432 [s] (BCTR) FC phase wrt BC1: PhiFC =-196.999 [deg] L1F=5.37909 [m] delay t1F=0.00163166 [s] Distances: in [m] [H12] 6.1 [BC1] 0.583 [VS] 1.87446 [BC2] 1.65109 [PG] 1.27053 [FC] 0.675 [Spl] 2 [Det] Have found 8 GPU devices on rank 6. Will use device 6. Have found 8 GPU devices on rank 1. Will use device 1. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. Have found 8 GPU devices on rank 4. Will use device 4. Have found 8 GPU devices on rank 5. Will use device 5. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. Have found 8 GPU devices on rank 2. Will use device 2. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. [ILL_IN4] Initialize [ILL_IN4] Initialize [ILL_IN4] Initialize [ILL_IN4] Initialize [ILL_IN4] Initialize [ILL_IN4] Initialize Warning: Read_Table :Dirac2D.sqw Data has 626294 values that should be 627 x 294 Warning: Read_Table :Dirac2D.sqw Data has 640623 values that should be 642 x 623 Warning: Read_Table :Dirac2D.sqw Data has 755254 values that should be 756 x 254 Warning: Read_Table :Dirac2D.sqw Data has 765489 values that should be 766 x 489 Warning: Read_Table :Dirac2D.sqw Data has 143289 values that should be 145 x 583 Warning: Read_Table :Dirac2D.sqw Data has 788005 values that should be 791 x 5 Warning: Read_Table :Dirac2D.sqw Data has 180134 values that should be 183 x 757 Warning: Read_Table :Dirac2D.sqw Data has 841227 values that should be 842 x 227 Warning: Read_Table :Dirac2D.sqw Data has 85973 values that should be 88 x 556 Warning: Read_Table :Dirac2D.sqw Data has 112583 values that should be 114 x 139 Warning: Read_Table :Dirac2D.sqw Data has 163758 values that should be 166 x 515 Generate 100 Dirac peaks on (q,w) grid. ILL_IN4: WARNING: The choppers are NOT in closed position phase12=-22.5 [deg]. Warning: Read_Table :Dirac2D.sqw Data has 31861 values that should be 32 x 1000 Warning: Read_Table :Dirac2D.sqw Data has 244746 values that should be 245 x 1000 Warning: Read_Table :Dirac2D.sqw Data has 15485 values that should be 16 x 1000 Warning: Read_Table :Dirac2D.sqw Data has 234511 values that should be 235 x 1000 Warning: Read_Table :Dirac2D.sqw Data has 158773 values that should be 159 x 1000 Warning: Read_Table :Dirac2D.sqw Data has 211995 values that should be 212 x 1000 [ILL_IN4] Initialize Source_gen: component Thermal (square 0.1 x 0.1) focusing distance dist=5.2 area=0.1 x 0.1 spectra 1.100 to 1.300 AA (48.408 to 67.612 meV) T1=683.7 K (1.178 AA), T2=257.7 K (1.919 AA), T3=16.7 K (7.539 AA) Flux is dPhi/dlambda in [n/s/cm2]. Source_gen: component Thermal2 (square 0.1 x 0.1) focusing distance dist=5.2 area=0.1 x 0.1 spectra 0.500 to 0.700 AA (166.959 to 327.240 meV) T1=683.7 K (1.178 AA), T2=257.7 K (1.919 AA), T3=16.7 K (7.539 AA) Flux is dPhi/dlambda in [n/s/cm2]. Source_gen: component Thermal3 (square 0.1 x 0.1) focusing distance dist=5.2 area=0.1 x 0.1 spectra 0.300 to 0.500 AA (327.240 to 909.000 meV) T1=683.7 K (1.178 AA), T2=257.7 K (1.919 AA), T3=16.7 K (7.539 AA) Flux is dPhi/dlambda in [n/s/cm2]. Source_gen: component Thermal4 (square 0.1 x 0.1) focusing distance dist=5.2 area=0.1 x 0.1 spectra 0.200 to 0.400 AA (511.312 to 2045.250 meV) T1=683.7 K (1.178 AA), T2=257.7 K (1.919 AA), T3=16.7 K (7.539 AA) Flux is dPhi/dlambda in [n/s/cm2]. Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al2O3_sapphire.trm' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/HOPG.rfl' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/HOPG.trm' (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) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) Isotropic_Sqw: SampleS: is a box: width=0.050000 height=0.050000 depth=0.001000 Opening input file 'Dirac2D.sqw' (Table_Read_Offset) Opening input file 'Dirac2D.sqw' (Table_Read_Offset) Opening input file 'Dirac2D.sqw' (Table_Read_Offset) Opening input file 'Dirac2D.sqw' (Table_Read_Offset) Isotropic_Sqw: SampleS: Computing scattering unit density V_rho=0.602214 [AA^-3] from density=1 [g/cm^3] weight=1 [g/mol]. Isotropic_Sqw: SampleS: S(q,w) data from Dirac2D.sqw (coh) assumed to be classical (symmetrised in energy). Isotropic_Sqw: SampleS: Generated Dirac2D.sqw coherent Sqw q=[0:15.6923 Angs-1] w=[0:283.758 meV] |S|=0.284838 size=[1000x1999] sigma=1 [barns] normalization factor S(q,w)*21.4141 (auto) \int q^2 S(q) dq=59.5952 Isotropic_Sqw: SampleS: Sample temperature not defined (T=0). Warning Disabling detailed balance. Incoherent: SampleV: The target is not defined. Using direct beam (Z-axis). Incoherent: SampleV: Vc=13.827 [Angs] sigma_abs=5.08 [barn] sigma_inc=5.08 [barn] 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 [ILL_IN4] Detector: Obt1_I=1.11572e+11 Obt1_ERR=1.78059e+07 Obt1_N=3.92741e+07 "Obt1_1656633676.x_y" Detector: Obt1_lambda_I=1.11547e+11 Obt1_lambda_ERR=1.78039e+07 Obt1_lambda_N=3.92654e+07 "Obt1_lambda_1656633676.L" Detector: Win1_I=8.74132e+10 Win1_ERR=1.39498e+07 Win1_N=3.92741e+07 "Win1_1656633676.x_y" Detector: Win1_lambda_I=5.62473e+10 Win1_lambda_ERR=1.11902e+07 Win1_lambda_N=2.52707e+07 "Win1_lambda_1656633676.L" Detector: BC2_t_I=1.69104e+10 BC2_t_ERR=4.33878e+06 BC2_t_N=1.51937e+07 "BC2_t_1656633676.t" Detector: BC2_t_post_I=1.53684e+10 BC2_t_post_ERR=4.13636e+06 BC2_t_post_N=1.38074e+07 "BC2_t_post_1656633676.t" Detector: Cradle_I=1.54695e+10 Cradle_ERR=4.14994e+06 Cradle_N=1.38983e+07 "Cradle_1656633676.x_y" Detector: Cradle_lambda_I=1.54695e+10 Cradle_lambda_ERR=4.14994e+06 Cradle_lambda_N=1.38983e+07 "Cradle_lambda_1656633676.L" Detector: Cradle_t_I=1.54669e+10 Cradle_t_ERR=4.14958e+06 Cradle_t_N=1.38959e+07 "Cradle_t_1656633676.t" Detector: Mono_xy_I=1.54695e+10 Mono_xy_ERR=4.14994e+06 Mono_xy_N=1.38983e+07 "Mono_xy_1656633676.x_y" Detector: Mono_t_I=1.39448e+09 Mono_t_ERR=394931 Mono_t_N=1.2469e+07 "Mono_t_1656633676.t" Detector: FC_Pos_I=5.15855e+08 FC_Pos_ERR=240520 FC_Pos_N=4.60006e+06 "FC_Pos_1656633676.t" Detector: sample_flux_I=4.40456e+06 sample_flux_ERR=2166.47 sample_flux_N=4.1334e+06 "sample_flux_1656633676.x_y" Detector: sample_tof_I=9.12949e+06 sample_tof_ERR=4410.84 sample_tof_N=4.2841e+06 "sample_tof_1656633676.x_t" Detector: sample_lambda_I=9.12949e+06 sample_lambda_ERR=4410.84 sample_lambda_N=4.2841e+06 "sample_lambda_1656633676.L" Detector: sample_w_I=9.12949e+06 sample_w_ERR=4410.84 sample_w_N=4.2841e+06 "sample_w_1656633676.E" Detector: sample_qxy_I=9.07437e+06 sample_qxy_ERR=4397.52 sample_qxy_N=4.2582e+06 "sample_qxy_1656633676.kx_ky" Detector: Detector_I=5.42033e+06 Detector_ERR=7731.53 Detector_N=3.38232e+06 "Detector_1656633705.th_y" Detector: Detector_sample_I=124998 Detector_sample_ERR=137.126 Detector_sample_N=2.1104e+06 "Detector_sample_1656633705.th_y" Detector: Detector_env_I=7858.52 Detector_env_ERR=137.74 Detector_env_N=14545 "Detector_env_1656633705.th_y" Detector: Detector_Sqw_I=74010.1 Detector_Sqw_ERR=106.003 Detector_Sqw_N=596597 "Sqw_full.dat" Detector: Detector_qe_I=173239 Detector_qe_ERR=170.139 Detector_qe_N=1.29942e+06 "Detector_qe_1656633705.A_E" Detector: Detector_SqwV_I=29412 Detector_SqwV_ERR=26.2065 Detector_SqwV_N=1.57508e+06 "Sqw_filtered.dat" Finally [ILL_IN4: 1]. Time: 47 [s] Finally [ILL_IN4: 1]. Time: 47 [s] Finally [ILL_IN4: 1]. Time: 47 [s] Detector: Detector_qeV_I=29312.6 Detector_qeV_ERR=26.1632 Detector_qeV_N=1.56938e+06 "Detector_qeV_1656633705.A_E" Finally [ILL_IN4: 1]. Time: 47 [s] Finally [ILL_IN4: 1]. Time: 47 [s] Finally [ILL_IN4: 1]. Time: 47 [s] Finally [ILL_IN4: 1]. Time: 47 [s] Isotropic_Sqw: SampleS: 810523 neutron events (out of 2072966) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: SampleS: Scattering fraction=0.117505 of incoming intensity Absorption fraction =0 Single scattering intensity =168621 (coh=168621 inc=0) Multiple scattering intensity =0 INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-07-01/McStas_8GPU_5e7/ILL_IN4/ILL_IN4.instr in dataset 1 loading system configuration loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_8GPU/mccode_config.json