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: "1" INFO: Using existing c-file: ./ILL_H13_IN20.c INFO: Using existing binary: ./ILL_H13_IN20.out INFO: === Simulation 'ILL_H13_IN20' (/home/nexmap/pkwi/TESTS/2023-04-01/McStas_8GPU_5e7/ILL_H13_IN20/ILL_H13_IN20.instr): running on 7 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1). Have found 8 GPU devices on rank 0. Will use device 0. templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau [ILL_H13_IN20] Initialize Isotropic_Sqw: Sample: is a hollow cylinder: radius=0.010000 thickness=0.005000 height=0.050000 [J Comp Phys 228 (2009) 5251] Have found 8 GPU devices on rank 2. Will use device 2. templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau [ILL_H13_IN20] Initialize Have found 8 GPU devices on rank 6. Will use device 6. Have found 8 GPU devices on rank 4. Will use device 4. templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau Sample: Powder V.lau [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize Isotropic_sqw: Sample: Powder file probably of type Crystallographica/Fullprof (lau) WARNING: but F2 unit is set to powder_barns=1 (barns). Intensity might be 100 times too high. Isotropic_sqw: Converting 3558 powder lines from V.lau into S(q,w) data Isotropic_sqw: q range [0:25.0197], creating 423 elements vector Isotropic_Sqw: Sample: Generated V.lau coherent Sqw q=[0:24.9605 Angs-1] w=[0:0 meV] |S|=0.869429 size=[423x1] sigma=0.01834 [barns] Mainly elastic scattering. Isotropic_Sqw: Sample: Using Isotropic elastic incoherent scattering (sigma=5.07999 [barns]) Isotropic_Sqw: Sample: Sample temperature not defined (T=0). Warning Disabling detailed balance. Have found 8 GPU devices on rank 5. Will use device 5. Have found 8 GPU devices on rank 1. Will use device 1. templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize Have found 8 GPU devices on rank 3. Will use device 3. templateTAS: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=19.39 A2=38.77 A3=0 A4=-19.19 A5=19.39 A6=38.77 [deg] Monochromator: DM=3.155 [Angs] RMH=6.655 [m] RMV=0.7332 [m] curved Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.lau [ILL_H13_IN20] Initialize *** TRACE end *** Save [ILL_H13_IN20] Detector: D4_SC2_1D_I=5.25482e+09 D4_SC2_1D_ERR=1.35515e+06 D4_SC2_1D_N=2.26185e+07 "D4_SC2_1D_1680312919.L" Detector: Sample_Cradle_I=5.44368e+07 Sample_Cradle_ERR=35225.5 Sample_Cradle_N=4.98203e+06 "Sample_Cradle" Detector: D7_SC3_1D_I=4.65882e+08 D7_SC3_1D_ERR=173121 D7_SC3_1D_N=7.91915e+07 "D7_SC3_1D_1680312919.th_E" Finally [ILL_H13_IN20: 1]. Time: 8 [s] Finally [ILL_H13_IN20: 1]. Time: 8 [s] Finally [ILL_H13_IN20: 1]. Time: 8 [s] Finally [ILL_H13_IN20: 1]. Time: 8 [s] Finally [ILL_H13_IN20: 1]. Time: 8 [s] Finally [ILL_H13_IN20: 1]. Time: 8 [s] Detector: He3H_I=248.797 He3H_ERR=1.15826 He3H_N=183203 "He3H.psd" Finally [ILL_H13_IN20: 1]. Time: 8 [s] Isotropic_Sqw: Sample: 268 neutron events (out of 27681985) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample: Scattering fraction=0.290418 of incoming intensity Absorption fraction =0.519716 Single scattering intensity =2.09602e+06 (coh=5759.69 inc=2.09026e+06) Multiple scattering intensity =0 INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2023-04-01/McStas_8GPU_5e7/ILL_H13_IN20/ILL_H13_IN20.instr in dataset 1