INFO: Using directory: "2" 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 5. Will use device 0. Have found 1 GPU devices on rank 7. Will use device 0. Have found 1 GPU devices on rank 3. 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. Have found 1 GPU devices on rank 6. Will use device 0. Have found 1 GPU devices on rank 1. Will use device 0. Test_Sqw_monitor: lambda=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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: lambda=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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: lambda=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: container is Al.laz (outer cylinder) Test_Sqw_monitor: external environment is Al.laz Test_Sqw_monitor: lambda=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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=1.6 [Angs], k=3.92699 [Angs-1], v=2472.52 [m/s], E=31.9548 [meV]. Time=[0.00121334 0.00161778 0.00242667] 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 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) [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) [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize 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) [Test_Sqw_monitor] Initialize [Test_Sqw_monitor] Initialize 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=1.14062e-06 SampleIn_ERR=1.61498e-10 SampleIn_N=4.98899e+07 "SampleIn_1643679556.x_y" Detector: Detector_nM_I=1.32733e-08 Detector_nM_ERR=1.12063e-11 Detector_nM_N=1.63911e+07 "Sqw_map.dat" Detector: Detector_nM_coh_I=7.38566e-09 Detector_nM_coh_ERR=2.93118e-12 Detector_nM_coh_N=1.04969e+07 "Sqw_single.dat" Detector: Detector_nM_inc_I=6.08842e-10 Detector_nM_inc_ERR=8.41462e-13 Detector_nM_inc_N=860607 "Sqw_inc.dat" Detector: Detector_nM_multi_I=1.21538e-10 Detector_nM_multi_ERR=1.32218e-13 Detector_nM_multi_N=2.69529e+06 "Sqw_multi.dat" Detector: Detector_nM_env_I=5.23835e-09 Detector_nM_env_ERR=1.07829e-11 Detector_nM_env_N=5.68993e+06 "Sqw_env.dat" Detector: M_total_I=5.96589e-09 M_total_ERR=7.36143e-12 M_total_N=7.53633e+06 "M_total_1643679563.A_t" Detector: M_single_coh_I=3.41807e-09 M_single_coh_ERR=1.99519e-12 M_single_coh_N=4.88397e+06 "M_single_coh_1643679563.A_t" Detector: M_single_inc_I=2.922e-10 M_single_inc_ERR=5.83474e-13 M_single_inc_N=411782 "M_single_inc_1643679563.A_t" Detector: M_multi_I=5.72728e-11 M_multi_ERR=9.07642e-14 M_multi_N=1.27102e+06 "M_multi_1643679563.A_t" Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Detector: M_env_container_I=2.23695e-09 M_env_container_ERR=7.06151e-12 M_env_container_N=2.55842e+06 "M_env_container_1643679563.A_t" Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Finally [Test_Sqw_monitor: 2]. Time: 56 [s] Isotropic_Sqw: Environment_in: 19967 neutron events (out of 1448386) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Container_in: 19 neutron events (out of 1431341) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: 128328 neutron events (out of 3548772) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample_in: 2256 neutron events (out of 3420444) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample_in: Scattering fraction=0.0180981 of incoming intensity Absorption fraction =0.0488701 Single scattering intensity =1.59263e-09 (coh=8.65851e-10 inc=7.26774e-10) Multiple scattering intensity =6.89961e-11 Isotropic_Sqw: Container_out: 5 neutron events (out of 1475678) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Container_out: 66 neutron events (out of 1475673) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Environment_out: 7 neutron events (out of 1504032) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Environment_out: 30825 neutron events (out of 1504025) 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 2 loading system configuration loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_8GPU/mccode_config.json