INFO: Using directory: "2" INFO: Using existing c-file: ./HZB_NEAT.c INFO: Using existing binary: ./HZB_NEAT.out INFO: === Simulation 'HZB_NEAT' (/home/nexmap/pkwi/TESTS/2022-04-01/McStas_8GPU_5e7/HZB_NEAT/HZB_NEAT.instr): running on 8 nodes (master is 'hypatia.fysik.dtu.dk', MPI version 3.1). 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 4. Will use device 0. HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] Have found 1 GPU devices on rank 1. Will use device 0. HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] Have found 1 GPU devices on rank 6. Will use device 0. [HZB_NEAT] Initialize HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] [HZB_NEAT] Initialize HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL [HZB_NEAT] Initialize Elastic line time: 21655.2 [us] [HZB_NEAT] Initialize [HZB_NEAT] Initialize Isotropic_Sqw: Sample: is a box: width=0.050000 height=0.060000 depth=0.002000 Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Y2O3.laz' (Table_Read_Offset) Have found 1 GPU devices on rank 7. Will use device 0. Have found 1 GPU devices on rank 5. Will use device 0. HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] [HZB_NEAT] Initialize Have found 1 GPU devices on rank 3. Will use device 0. HZB_NEAT: Detailed NEAT/TOF configuration HZB_NEAT: Detailed NEAT/TOF configuration * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] * Incoming beam: lambda=6 [Angs] EI=2.272 [meV] KI=1.047 [Angs-1] Vi=659.339 [m/s] Sample: coh=Y2O3.laz inc=NULL Elastic line time: 21655.2 [us] [HZB_NEAT] Initialize [HZB_NEAT] Initialize Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Y2O3.laz' (Table_Read_Offset) Isotropic_sqw: Converting 871 powder lines from Y2O3.laz into S(q,w) data Isotropic_sqw: q range [0:12.6779], creating 1496 elements vector Isotropic_Sqw: Sample: Generated Y2O3.laz coherent Sqw q=[0:12.6695 Angs-1] w=[0:0 meV] |S|=0.0429979 size=[1496x1] sigma=444.64 [barns] Mainly elastic scattering. Isotropic_Sqw: Sample: Using Isotropic elastic incoherent scattering (sigma=4.832 [barns]) Isotropic_Sqw: Sample: Sample temperature not defined (T=0). Warning Disabling detailed balance. Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../contrib/Gas_tables/He3inCF4.table' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../contrib/Gas_tables/He3inHe.table' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../contrib/Gas_tables/He3inCF4.table' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../contrib/Gas_tables/He3inHe.table' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../contrib/Gas_tables/He3inCF4.table' (Table_Read_Offset) *** TRACE end *** Save [HZB_NEAT] Detector: Guide_PSD_I=7.94036e+07 Guide_PSD_ERR=70716.7 Guide_PSD_N=7.09317e+06 "Guide_PSD_1648770752.y_x" Detector: Guide_Lambda_I=3.97061e+07 Guide_Lambda_ERR=49990.7 Guide_Lambda_N=3.54553e+06 "Guide_Lambda_1648770752.L" Detector: Guide2_PSD_I=5.02929e+06 Guide2_PSD_ERR=4609.42 Guide2_PSD_N=5.90354e+06 "Guide2_PSD_1648770752.x_y" Detector: Guide2_Lambda_I=2.51493e+06 Guide2_Lambda_ERR=3258.44 Guide2_Lambda_N=2.95216e+06 "Guide2_Lambda_1648770752.L" Detector: Guide2_dXY_I=5.0292e+06 Guide2_dXY_ERR=4609.38 Guide2_dXY_N=5.90327e+06 "Guide2_dXY_1648770752.hd_vd" Detector: Guide_time_I=2.19598e+06 Guide_time_ERR=3045.51 Guide_time_N=2.57326e+06 "Guide_time_1648770752.t" Detector: Ideal_Det_I=2065.6 Ideal_Det_ERR=5.57795 Ideal_Det_N=769797 "Ideal_Det_1648770752.A_t" Finally [HZB_NEAT: 2]. Time: 7 [s] Detector: Detector_I=952.314 Detector_ERR=3.85149 Detector_N=342508 "NEAT.psd" Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Finally [HZB_NEAT: 2]. Time: 7 [s] Isotropic_Sqw: Sample: 1171502 neutron events (out of 8294498) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: Sample: 18936 neutron events (out of 7122996) reached WARNING unrealistic weight. The S(q,w) norm might be too high. Isotropic_Sqw: Sample: Scattering fraction=0.0335542 of incoming intensity Absorption fraction =0.482423 Single scattering intensity =32796.3 (coh=31253.7 inc=1542.54) Multiple scattering intensity =891.655 INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-04-01/McStas_8GPU_5e7/HZB_NEAT/HZB_NEAT.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