INFO: Using directory: "1" INFO: Using existing c-file: ./Test_Sqw_monitor.c INFO: Using existing binary: ./Test_Sqw_monitor.out INFO: === Simulation 'Test_Sqw_monitor' (/home/nexmap/pkwi/TESTS/2022-02-01/McStas_8GPU_5e7/Test_Sqw_monitor/Test_Sqw_monitor.instr): running on 8 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1). Have found 1 GPU devices on rank 1. Will use device 0. Have found 1 GPU devices on rank 5. Will use device 0. Have found 1 GPU devices on rank 6. Will use device 0. Have found 1 GPU devices on rank 2. Will use device 0. Have found 1 GPU devices on rank 0. Will use device 0. Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Have found 1 GPU devices on rank 4. Will use device 0. Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Have found 1 GPU devices on rank 7. Will use device 0. Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Have found 1 GPU devices on rank 3. Will use device 0. Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: lambda=4.1 [Angs], k=1.53248 [Angs-1], v=964.886 [m/s], E=4.8664 [meV]. Time=[0.00310917 0.00414557 0.00621835] Test_Sqw_monitor: sample is Rb_liq_coh.sqw, with hollow cylindrical geometry. Test_Sqw_monitor: detector is cylindrical with radius=4 [m] height=3 [m] and 468 tubes [1 inch] Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize 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/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) Isotropic_Sqw: Sample_in: is a hollow cylinder: radius=0.005000 thickness=0.001000 height=0.030000 [J Comp Phys 228 (2009) 5251] Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_inc.sqw' (Table_Read_Offset) Isotropic_Sqw: Sample_in: Temperature set to T=350 [K] Isotropic_Sqw: Sample_in: S(q,w) data from Rb_liq_inc.sqw (inc) assumed to be classical (symmetrised in energy). Isotropic_Sqw: Sample_in: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_inc.sqw file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: Sample_in: Generated Rb_liq_inc.sqw incoherent Sqw q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.985192 size=[101x10185] sigma=0.5 [barns] normalization factor S(q,w)*0.492586 (auto) \int q^2 S(q) dq=676.701 Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Rb_liq_coh.sqw' (Table_Read_Offset) Isotropic_Sqw: Sample_in: Temperature set to T=350 [K] Isotropic_Sqw: Sample_in: S(q,w) data from Rb_liq_coh.sqw (coh) assumed to be classical (symmetrised in energy). Isotropic_Sqw: Sample_in: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_coh.sqw file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: Sample_in: Generated Rb_liq_coh.sqw coherent Sqw q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.887933 size=[101x10185] sigma=6.32 [barns] normalization factor S(q,w)*0.477012 (auto) \int q^2 S(q) dq=698.369 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/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 [Test_Sqw_monitor] Detector: SampleIn_I=4.62738e-08 SampleIn_ERR=6.55193e-12 SampleIn_N=4.98899e+07 "SampleIn_1643679456.x_y" Detector: Detector_nM_I=7.70029e-10 Detector_nM_ERR=7.66227e-13 Detector_nM_N=1.74773e+07 "Sqw_map.dat" Detector: Detector_nM_coh_I=2.59864e-10 Detector_nM_coh_ERR=1.07372e-13 Detector_nM_coh_N=9.29482e+06 "Sqw_single.dat" Detector: Detector_nM_inc_I=2.53826e-11 Detector_nM_inc_ERR=3.35787e-14 Detector_nM_inc_N=888644 "Sqw_inc.dat" Detector: Detector_nM_multi_I=4.48202e-12 Detector_nM_multi_ERR=4.79649e-15 Detector_nM_multi_N=2.55214e+06 "Sqw_multi.dat" Detector: Detector_nM_env_I=4.83753e-10 Detector_nM_env_ERR=7.5792e-13 Detector_nM_env_N=7.3721e+06 "Sqw_env.dat" Detector: M_total_I=1.87241e-10 M_total_ERR=3.12704e-13 M_total_N=6.17126e+06 "M_total_1643679464.A_t" Detector: M_single_coh_I=9.66802e-11 M_single_coh_ERR=6.54287e-14 M_single_coh_N=3.62325e+06 "M_single_coh_1643679464.A_t" Detector: M_single_inc_I=1.21706e-11 M_single_inc_ERR=2.32675e-14 M_single_inc_N=419336 "M_single_inc_1643679464.A_t" Detector: M_multi_I=2.08874e-12 M_multi_ERR=3.27037e-15 M_multi_N=1.18395e+06 "M_multi_1643679464.A_t" Detector: M_env_container_I=7.78896e-11 M_env_container_ERR=3.04891e-13 M_env_container_N=2.1531e+06 "M_env_container_1643679464.A_t" Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.6 [min] Finally [Test_Sqw_monitor: 1]. Time: 1.61667 [min] Isotropic_Sqw: Environment_in: 213 neutron events (out of 1484866) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Container_in: 1 neutron events (out of 1475198) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: 54912225 neutron events (out of 58602974) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample_in: 1938 neutron events (out of 3690749) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: Scattering fraction=0.0181509 of incoming intensity Absorption fraction =0.12182 Single scattering intensity =7.15722e-11 (coh=3.93933e-11 inc=3.21788e-11) Multiple scattering intensity =2.81983e-12 Isotropic_Sqw: Container_out: 77772 neutron events (out of 1627002) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Container_out: 85 neutron events (out of 1549230) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Environment_out: 78095 neutron events (out of 1661156) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Environment_out: 52441 neutron events (out of 1583061) reached WARNING unrealistic weight. The S(q,w) norm might be too high. INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-02-01/McStas_8GPU_5e7/Test_Sqw_monitor/Test_Sqw_monitor.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