INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_H8_IN1.c INFO: Using existing binary: ./ILL_H8_IN1.out INFO: === Simulation 'ILL_H8_IN1' (/home/nexmap/pkwi/TESTS/2022-04-01/McStas_8GPU_5e7/ILL_H8_IN1/ILL_H8_IN1.instr): running on 8 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1). Have found 1 GPU devices on rank 5. Will use device 0. Have found 1 GPU devices on rank 1. Will use device 0. Have found 1 GPU devices on rank 0. Will use device 0. templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Have found 1 GPU devices on rank 2. Will use device 0. * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Sample: Powder V.lau Sample: Powder V.lau [ILL_H8_IN1] Initialize [ILL_H8_IN1] Initialize templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved templateTAS: Detailed TAS configuration Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] Sample: Powder V.lau Have found 1 GPU devices on rank 6. Will use device 0. * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Sample: Powder V.lau [ILL_H8_IN1] Initialize [ILL_H8_IN1] Initialize Have found 1 GPU devices on rank 4. Will use device 0. templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Sample: Powder V.lau templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] [ILL_H8_IN1] Initialize * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Have found 1 GPU devices on rank 3. Will use device 0. Sample: Powder V.lau Have found 1 GPU devices on rank 7. Will use device 0. Isotropic_Sqw: Sample: is a hollow cylinder: radius=0.010000 thickness=0.005000 height=0.050000 [J Comp Phys 228 (2009) 5251] [ILL_H8_IN1] Initialize templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] templateTAS: Detailed TAS configuration * Incoming beam: EI=207.2 [meV] KI=10 [Angs-1] Vi=6296.22 [m/s] * Outgoing beam: EF=207.2 [meV] KF=10 [Angs-1] Vf=6296.22 [m/s] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved * Transfer: EN=0 [meV] QM=1 [Angs-1] Angles: A1=14.23 A2=28.46 A3=0 A4=-5.732 A5=14.23 A6=28.46 [deg] Monochromator: DM=1.278 [Angs] RMH=13.14 [m] RMV=0.7942 [m] curved Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Sample: Powder V.lau Analyzer: DA=1.278 [Angs] RAH=3.883 [m] RAV=0.2346 [m] curved Sample: Powder V.lau [ILL_H8_IN1] Initialize [ILL_H8_IN1] 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. *** TRACE end *** Save [ILL_H8_IN1] Detector: D4_SC2_1D_I=4.45651e+09 D4_SC2_1D_ERR=463503 D4_SC2_1D_N=9.74299e+07 "D4_SC2_1D_1648771071.L" Detector: Sample_Cradle_I=1.26056e+08 Sample_Cradle_ERR=20371.6 Sample_Cradle_N=4.74977e+07 "Sample_Cradle" Detector: D7_SC3_1D_I=1.04148e+09 D7_SC3_1D_ERR=131993 D7_SC3_1D_N=6.22612e+08 "D7_SC3_1D_1648771071.th_E" Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Finally [ILL_H8_IN1: 1]. Time: 28 [s] Detector: He3H_I=1340.49 He3H_ERR=1.47561 He3H_N=1.62908e+06 "He3H.psd" Finally [ILL_H8_IN1: 1]. Time: 28 [s] Isotropic_Sqw: Sample: Scattering fraction=0.255138 of incoming intensity Absorption fraction =0.254337 Single scattering intensity =1.45719e+06 (coh=25470.2 inc=1.43172e+06) Multiple scattering intensity =0 INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-04-01/McStas_8GPU_5e7/ILL_H8_IN1/ILL_H8_IN1.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