loading system configuration loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_CPU_MPICC_KISS/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_BRISP.c INFO: Using existing binary: ./ILL_BRISP.out INFO: === Simulation 'ILL_BRISP' (/home/nexmap/pkwi/TESTS/2022-11-01/McStas_CPU_MPICC_KISS_1e7/ILL_BRISP/ILL_BRISP.instr): running on 8 nodes (master is 'panda2.fysik.dtu.dk', MPI version 3.0). Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 Instrument ILL_BRISP: Time of Flight Neutron Spectrometer for Small Angle Inelastic Scattering Monochr. Bragg angle [deg] 17.5 Wavelength [AA] 2.01774 Neutron velocity [m/s] 1960.63 Incident Energy [meV] 20.0931 Travel time: Disk./Fermi [us] 2060.56 CHOP Disk Speed [rpm] 3740 CHOP Fermi Speed [rpm] 14960 (249.333 [Hz], 1566.61 [rad/s]) CHOP Disk Phase [deg] 184.956 CHOP Fermi Phase [deg] 0 Dist. Monochromator-Fermi [m] 5.54 Dist. Disk-Fermi [m] 4.04 Dist. Sample-Detector [m] 4.5 [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize [ILL_BRISP] Initialize Isotropic_Sqw: Environment_in: is a hollow cylinder: radius=0.050000 thickness=0.002000 height=0.100000 [J Comp Phys 228 (2009) 5251] Isotropic_sqw: Environment_in: 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 2204 powder lines from Al.lau into S(q,w) data Isotropic_sqw: q range [0:12.5088], creating 389 elements vector Isotropic_Sqw: Environment_in: Generated Al.lau coherent Sqw q=[0:12.4767 Angs-1] w=[0:0 meV] |S|=11.5875 size=[389x1] sigma=5.98 [barns] Mainly elastic scattering. Isotropic_Sqw: Environment_in: Using Isotropic elastic incoherent scattering (sigma=0.0328 [barns]) Isotropic_Sqw: Environment_in: Sample temperature not defined (T=0). Warning Disabling detailed balance. Isotropic_Sqw: Container_in: is a hollow box: width=0.050200 height=0.050200 depth=0.004200 Isotropic_Sqw: Container_in: ERROR importing data files (Sqw_init coh=NULL inc=). Isotropic_Sqw: Container_in: Scattering cross section is zero ERROR (sigma_coh, sigma_inc). Isotropic_Sqw: Sample: is a box: width=0.050000 height=0.050000 depth=0.004000 Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.lau' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.lau' (Table_Read_Offset) 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. Isotropic_Sqw: Container_out: is a hollow box: width=0.050200 height=0.050200 depth=0.004200 Isotropic_Sqw: Container_out: ERROR importing data files (Sqw_init coh=NULL inc=). Isotropic_Sqw: Container_out: Scattering cross section is zero ERROR (sigma_coh, sigma_inc). Isotropic_Sqw: Environment_out: is a hollow cylinder: radius=0.050000 thickness=0.002000 height=0.100000 [J Comp Phys 228 (2009) 5251] Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.lau' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.lau' (Table_Read_Offset) Isotropic_sqw: Environment_out: 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 2204 powder lines from Al.lau into S(q,w) data Isotropic_sqw: q range [0:12.5088], creating 389 elements vector Isotropic_Sqw: Environment_out: Generated Al.lau coherent Sqw q=[0:12.4767 Angs-1] w=[0:0 meV] |S|=11.5875 size=[389x1] sigma=5.98 [barns] Mainly elastic scattering. Isotropic_Sqw: Environment_out: Using Isotropic elastic incoherent scattering (sigma=0.0328 [barns]) Isotropic_Sqw: Environment_out: Sample temperature not defined (T=0). Warning Disabling detailed balance. Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 85 Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 86 Trace ETA 12 [s] % 85 90 90 90 90 90 90 90 90 *** TRACE end *** Save [ILL_BRISP] Detector: LmonokOUT_I=6.03041e+08 LmonokOUT_ERR=214453 LmonokOUT_N=1.01027e+07 "LmonokOUT_1667258727.L" Detector: Monitor1_I=6.02347e+08 Monitor1_ERR=214346 Monitor1_N=1.00875e+07 "Monitor1_1667258727.x_y" Detector: DC_OUT_T_I=1.02104e+07 DC_OUT_T_ERR=16108.7 DC_OUT_T_N=510367 "DC_OUT_T_1667258727.t" Detector: HC_OUT_PSD_I=1.98886e+07 HC_OUT_PSD_ERR=24101.8 HC_OUT_PSD_N=725601 "HC_OUT_PSD_1667258727.x_y" Detector: FC_OUT_T_I=34944.3 FC_OUT_T_ERR=73.5406 FC_OUT_T_N=240694 "FC_OUT_T_1667258727.t" Detector: SampleXY_I=2842.11 SampleXY_ERR=6.96848 SampleXY_N=177840 "SampleXY_1667258727.x_y" Detector: Detector_I=26.7678 Detector_ERR=0.595037 Detector_N=71215 "Detector_1667258727.x_y" Detector: Detector_Q_I=26.73 Detector_Q_ERR=0.595032 Detector_Q_N=70969 "Detector_Q_1667258727.U1" Detector: Detector_E_I=26.692 Detector_E_ERR=0.595026 Detector_E_N=70733 "Detector_E_1667258727.U1" Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Detector: Detector_QE_I=26.5227 Detector_QE_ERR=0.592263 Detector_QE_N=70487 "Detector_QE_1667258727.U1_U2" Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Finally [ILL_BRISP: 1]. Time: 12 [s] Isotropic_Sqw: Environment_in: 38381 neutron events (out of 123047) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Environment_in: Scattering fraction=0.48381 of incoming intensity Absorption fraction =0.0048714 Single scattering intensity =1708.18 (coh=1707.76 inc=0.424655) Multiple scattering intensity =0 Isotropic_Sqw: Sample: 8 neutron events (out of 2202391) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample: Scattering fraction=0.140973 of incoming intensity Absorption fraction =0.52822 Single scattering intensity =590.314 (coh=0.898907 inc=589.415) Multiple scattering intensity =0 Isotropic_Sqw: Environment_out: 39748 neutron events (out of 120194) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Environment_out: Scattering fraction=0.502959 of incoming intensity Absorption fraction =0.00487037 Single scattering intensity =793.285 (coh=793.273 inc=0.0117927) Multiple scattering intensity =0 INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-11-01/McStas_CPU_MPICC_KISS_1e7/ILL_BRISP/ILL_BRISP.instr in dataset 1