loading system configuration loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas-2.x_CPU_MPICC/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/2022-11-01/McStas-2.x_CPU_MPICC_5e7/ILL_H13_IN20/ILL_H13_IN20.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). ILL_H13_IN20: 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.laz [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] Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) ILL_H13_IN20: 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.laz ILL_H13_IN20: 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.laz Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) ILL_H13_IN20: 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] ILL_H13_IN20: 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.laz 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.laz ILL_H13_IN20: 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] ILL_H13_IN20: 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.laz ILL_H13_IN20: 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] ILL_H13_IN20: 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.laz * 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.laz ILL_H13_IN20: 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.laz ILL_H13_IN20: 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.laz ILL_H13_IN20: 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.laz * 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.laz ILL_H13_IN20: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=1888.87 [m/s] Isotropic_sqw: Converting 21 powder lines from V.laz into S(q,w) data Isotropic_sqw: q range [0:12.4666], creating 106 elements vector ILL_H13_IN20: 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] * 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.laz ILL_H13_IN20: Detailed TAS configuration * Incoming beam: EI=18.65 [meV] KI=3 [Angs-1] Vi=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 Isotropic_Sqw: Sample: Generated V.laz coherent Sqw q=[0:12.349 Angs-1] w=[0:0 meV] |S|=0.827538 size=[106x1] sigma=0.0368 [barns] * Outgoing beam: EF=18.65 [meV] KF=3 [Angs-1] Vf=1888.87 [m/s] * Transfer: EN=0 [meV] QM=1 [Angs-1] Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.laz Mainly elastic scattering. [ILL_H13_IN20] Initialize ILL_H13_IN20: 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 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.laz Analyzer: DA=3.155 [Angs] RAH=2.876 [m] RAV=0.3168 [m] curved Sample: Powder V.laz Isotropic_Sqw: Sample: Using Isotropic elastic incoherent scattering (sigma=9.87 [barns]) Isotropic_Sqw: Sample: Sample temperature not defined (T=0). Warning Disabling detailed balance. [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize [ILL_H13_IN20] Initialize Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 90 Trace ETA 12 [s] % 91 Trace ETA 11 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 90 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 90 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 91 Trace ETA 12 [s] % 90 Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.19844e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.2061e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.20514e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.20611e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.19901e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 11 [s] Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.20398e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.2159e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 11 [s] Warning: 1.20328e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 12 [s] Finally [ILL_H13_IN20: 1]. Time: 12 [s] Warning: 1.20464e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.20005e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.19368e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.20187e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 12 [s] Finally [ILL_H13_IN20: 1]. Time: 12 [s] Finally [ILL_H13_IN20: 1]. Time: 12 [s] Finally [ILL_H13_IN20: 1]. Time: 12 [s] Finally [ILL_H13_IN20: 1]. Time: 12 [s] Warning: 1.20876e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Warning: 1.19917e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Save [ILL_H13_IN20] Detector: D4_SC2_1D_I=5.25681e+09 D4_SC2_1D_ERR=1.35546e+06 D4_SC2_1D_N=2.26193e+07 "D4_SC2_1D_1667260761.L" Detector: Sample_Cradle_I=5.41321e+07 Sample_Cradle_ERR=35145.7 Sample_Cradle_N=4.97565e+06 "Sample_Cradle" Warning: 1.20851e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). Finally [ILL_H13_IN20: 1]. Time: 12 [s] Detector: D7_SC3_1D_I=4.77767e+08 D7_SC3_1D_ERR=178739 D7_SC3_1D_N=8.06327e+07 "D7_SC3_1D_1667260761.th_E" Detector: He3H_I=237.743 He3H_ERR=1.13047 He3H_N=179705 "He3H.psd" Finally [ILL_H13_IN20: 1]. Time: 12 [s] Isotropic_Sqw: Sample: Scattering fraction=0.356141 of incoming intensity Absorption fraction =0.544373 Single scattering intensity =3.01111e+06 (coh=8483.88 inc=3.00262e+06) Multiple scattering intensity =0 Warning: 1.19781e+06 events were removed in Component[14] SC3=Collimator_linear() (negative time, miss next components, rounding errors, Nan, Inf). INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-11-01/McStas-2.x_CPU_MPICC_5e7/ILL_H13_IN20/ILL_H13_IN20.instr in dataset 1