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: ./Test_Sqw_monitor.c INFO: Using existing binary: ./Test_Sqw_monitor.out INFO: === Simulation 'Test_Sqw_monitor' (/home/nexmap/pkwi/TESTS/2022-11-01/McStas_CPU_MPICC_KISS_1e7/Test_Sqw_monitor/Test_Sqw_monitor.instr): running on 8 nodes (master is 'panda2.fysik.dtu.dk', MPI version 3.0). 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 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 [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 ETA 14 [s] % 75 Trace ETA 15 [s] % 72 75 80 Trace ETA 14 [s] % 77 Trace ETA 14 [s] % 73 Trace ETA 14 [s] % 77 80 75 85 80 80 85 80 85 90 85 Trace ETA 15 [s] % 69 Trace ETA 15 [s] % 73 70 75 90 85 90 90 95 75 80 90 95 95 95 80 85 95 Trace ETA 15 [s] % 71 85 90 75 90 95 80 95 85 *** TRACE end *** 90 95 Save [Test_Sqw_monitor] Detector: SampleIn_I=4.6274e-08 SampleIn_ERR=1.46506e-11 SampleIn_N=9.97799e+06 "SampleIn_1667261590.x_y" Detector: Detector_nM_I=7.68997e-10 Detector_nM_ERR=1.70485e-12 Detector_nM_N=3.50076e+06 "Sqw_map.dat" Detector: Detector_nM_coh_I=2.60269e-10 Detector_nM_coh_ERR=2.40357e-13 Detector_nM_coh_N=1.86308e+06 "Sqw_single.dat" Detector: Detector_nM_inc_I=2.5412e-11 Detector_nM_inc_ERR=7.49448e-14 Detector_nM_inc_N=178551 "Sqw_inc.dat" Detector: Detector_nM_multi_I=4.4673e-12 Detector_nM_multi_ERR=1.06795e-14 Detector_nM_multi_N=509656 "Sqw_multi.dat" Detector: Detector_nM_env_I=4.82304e-10 Detector_nM_env_ERR=1.68615e-12 Detector_nM_env_N=1.47593e+06 "Sqw_env.dat" Detector: M_total_I=1.86244e-10 M_total_ERR=6.86439e-13 M_total_N=1.23342e+06 "M_total_1667261610.A_t" Detector: M_single_coh_I=9.6621e-11 M_single_coh_ERR=1.46236e-13 M_single_coh_N=724397 "M_single_coh_1667261610.A_t" Detector: M_single_inc_I=1.22127e-11 M_single_inc_ERR=5.20014e-14 M_single_inc_N=84386 "M_single_inc_1667261610.A_t" Detector: M_multi_I=2.08047e-12 M_multi_ERR=7.2813e-15 M_multi_N=235757 "M_multi_1667261610.A_t" Finally [Test_Sqw_monitor: 1]. Time: 21 [s] Finally [Test_Sqw_monitor: 1]. Time: 17 [s] Finally [Test_Sqw_monitor: 1]. Time: 20 [s] Finally [Test_Sqw_monitor: 1]. Time: 21 [s] Finally [Test_Sqw_monitor: 1]. Time: 20 [s] Finally [Test_Sqw_monitor: 1]. Time: 20 [s] Detector: M_env_container_I=7.69199e-11 M_env_container_ERR=6.68652e-13 M_env_container_N=430361 "M_env_container_1667261610.A_t" Finally [Test_Sqw_monitor: 1]. Time: 19 [s] Finally [Test_Sqw_monitor: 1]. Time: 19 [s] Isotropic_Sqw: Environment_in: 44 neutron events (out of 999954) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: 28956035 neutron events (out of 38363581) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample_in: 388 neutron events (out of 9407546) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: Scattering fraction=0.0199981 of incoming intensity Absorption fraction =0.122105 Single scattering intensity =8.97689e-10 (coh=8.25969e-10 inc=7.17198e-11) Multiple scattering intensity =1.26318e-11 Isotropic_Sqw: Container_out: 16136 neutron events (out of 914225) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Container_out: 19 neutron events (out of 898089) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Environment_out: 16023 neutron events (out of 1017765) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Environment_out: 10480 neutron events (out of 1001742) reached WARNING unrealistic weight. The S(q,w) norm might be too high. INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-11-01/McStas_CPU_MPICC_KISS_1e7/Test_Sqw_monitor/Test_Sqw_monitor.instr in dataset 1