loading system configuration loading user configuration from /users/willend/.mcstas/3.x-dev/mccode_config.json loading override configuration from /users/willend/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_DUAL_A100_DMSC/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_H22_D1B.c INFO: Using existing binary: ./ILL_H22_D1B.out INFO: === -------------------------------------------------------------------------- WARNING: No preset parameters were found for the device that Open MPI detected: Local host: r6n22 Device name: mlx5_0 Device vendor ID: 0x02c9 Device vendor part ID: 4123 Default device parameters will be used, which may result in lower performance. You can edit any of the files specified by the btl_openib_device_param_files MCA parameter to set values for your device. NOTE: You can turn off this warning by setting the MCA parameter btl_openib_warn_no_device_params_found to 0. -------------------------------------------------------------------------- Simulation 'ILL_H22_D1B' (/users/willend/TESTS/2022-11-01/McStas_DUAL_A100_DMSC_5e7/ILL_H22_D1B/ILL_H22_D1B.instr): running on 2 nodes (master is 'r6n22.esss.dk', MPI version 3.1). Have found 2 GPU devices on rank 0. Will use device 0. Have found 2 GPU devices on rank 1. Will use device 1. Instrument: ILL_H22 (H22@ILL thermal guide). ILL_H22_D1B: Detailed D1B configuration * Incoming beam: lambda=2.52 [Angs] EI=12.88 [meV] KI=2.493 [Angs-1] Vi=1569.85 [m/s] * Monochromator: DM=3.348 [Angs] RV=2.2 [m] curved, take-off THETA_M=22.11 [deg] * Sample: 'Na2Ca3Al2F14.laz' in Al cryostat. Instrument: ILL_H22 (H22@ILL thermal guide). ILL_H22_D1B: Detailed D1B configuration * Incoming beam: lambda=2.52 [Angs] EI=12.88 [meV] KI=2.493 [Angs-1] Vi=1569.85 [m/s] * Monochromator: DM=3.348 [Angs] RV=2.2 [m] curved, take-off THETA_M=22.11 [deg] * Sample: 'Na2Ca3Al2F14.laz' in Al cryostat. [ILL_H22_D1B] Initialize [ILL_H22_D1B] Initialize Source_gen: component Thermal (square 0.14 x 0.22) focusing distance dist=3.18 area=0.038 x 0.2 spectra 2.490 to 2.550 AA (12.581 to 13.195 meV) T1=683.7 K (1.178 AA), T2=257.7 K (1.919 AA), T3=16.7 K (7.539 AA) Flux is dPhi/dlambda in [n/s/cm2]. Monitor_nD: GuideOut_dxdy is using automatic limits option 'auto' together with MPI. WARNING this may create incorrect distributions (but integrated flux will be right). Monitor_nD: D2B_Mono_Dx is using automatic limits option 'auto' together with MPI. WARNING this may create incorrect distributions (but integrated flux will be right). Monitor_nD: monitor_D1B is using automatic limits option 'auto' together with MPI. WARNING this may create incorrect distributions (but integrated flux will be right). PowderN: Cryo_1: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_1: Reading 26 rows from Al.laz PowderN: Cryo_1: Read 26 reflections from file 'Al.laz' PowderN: Cryo_1: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz PowderN: Cryo_2: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_2: Reading 26 rows from Al.laz PowderN: Cryo_2: Read 26 reflections from file 'Al.laz' PowderN: Cryo_2: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz PowderN: Cryo_3: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_3: Reading 26 rows from Al.laz PowderN: Cryo_3: Read 26 reflections from file 'Al.laz' PowderN: Cryo_3: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz PowderN: Cryo_4: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_4: Reading 26 rows from Al.laz PowderN: Cryo_4: Read 26 reflections from file 'Al.laz' PowderN: Cryo_4: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Na2Ca3Al2F14.laz' (Table_Read_Offset) Table from file 'Na2Ca3Al2F14.laz' (block 1) is 841 x 18 (x=1:20), constant step. interpolation: linear '# TITLE *-Na2Ca3Al2F14-[I213] Courbion, G.;Ferey, G.[1988] Standard NAC cal ...' PowderN: Sample: Reading 841 rows from Na2Ca3Al2F14.laz PowderN: Sample: Read 841 reflections from file 'Na2Ca3Al2F14.laz' PowderN: Sample: Vc=1079.1 [Angs] sigma_abs=11.7856 [barn] sigma_inc=13.6704 [barn] reflections=Na2Ca3Al2F14.laz Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_4_127: Reading 26 rows from Al.laz PowderN: Cryo_4_127: Read 26 reflections from file 'Al.laz' PowderN: Cryo_4_127: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_3_128: Reading 26 rows from Al.laz PowderN: Cryo_3_128: Read 26 reflections from file 'Al.laz' PowderN: Cryo_3_128: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_2_129: Reading 26 rows from Al.laz PowderN: Cryo_2_129: Read 26 reflections from file 'Al.laz' PowderN: Cryo_2_129: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/users/willend/McStas/mcstas/3.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) Exact_radial_coll: collimador_radial: foil thickness is 0.1 [millimeter] opening each input slit [2.27:90] [millimeter] opening each output slit [2.97:90] [millimeter] divergence per channel is 94.8501 [min] Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: Cryo_1_130: Reading 26 rows from Al.laz PowderN: Cryo_1_130: Read 26 reflections from file 'Al.laz' PowderN: Cryo_1_130: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Exact_radial_coll: collimador_radial: foil thickness is 0.1 [millimeter] opening each input slit [2.27:90] [millimeter] opening each output slit [2.97:90] [millimeter] divergence per channel is 94.8501 [min] [r6n22.esss.dk:4138581] 1 more process has sent help message help-mpi-btl-openib.txt / no device params found [r6n22.esss.dk:4138581] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages *** TRACE end *** Save [ILL_H22_D1B] Detector: GuideOut_xy_I=3.24726e+07 GuideOut_xy_ERR=22188.5 GuideOut_xy_N=7.91666e+06 "GuideOut_xy_1667264481.x_y" Detector: GuideOut_dxdy_I=3.24726e+07 GuideOut_dxdy_ERR=22188.5 GuideOut_dxdy_N=7.91666e+06 "GuideOut_dxdy_1667264481.hd_vd" Detector: GuideOut_Phic_I=4.54948e+07 GuideOut_Phic_ERR=31081.5 GuideOut_Phic_N=7.91666e+06 "GuideOut_Phic" Detector: GuideOut_L_I=3.24726e+07 GuideOut_L_ERR=22188.5 GuideOut_L_N=7.91666e+06 "GuideOut_L_1667264481.L" Detector: D2B_Mono_Dx_I=3.14989e+07 D2B_Mono_Dx_ERR=21884.7 D2B_Mono_Dx_N=7.36814e+06 "D2B_Mono_Dx_1667264481.hd" Detector: D1B_monitor_shutter_I=3.48014e+08 D1B_monitor_shutter_ERR=182618 D1B_monitor_shutter_N=6.9533e+06 "D1B_monitor_shutter_1667264481.x_y" Detector: monitor_D1B_I=1.11736e+08 monitor_D1B_ERR=59206.4 monitor_D1B_N=6.5237e+06 "monitor_D1B_1667264481.L" Detector: PSD_D1B_I=1.11736e+08 PSD_D1B_ERR=59206.4 PSD_D1B_N=6.5237e+06 "PSD_D1B_1667264481.x_y" Detector: D1B_BananaTheta_I=5672.95 D1B_BananaTheta_ERR=157.029 D1B_BananaTheta_N=107042 "D1B_BananaTheta_1667264481.th" Detector: D1B_BananaTheta_Sample_I=5511.33 D1B_BananaTheta_Sample_ERR=156.828 D1B_BananaTheta_Sample_N=11905 "D1B_BananaTheta_Sample_1667264481.th" Finally [ILL_H22_D1B: 1]. Time: 11 [s] Finally [ILL_H22_D1B: 1]. Time: 11 [s] INFO: Placing instr file copy /users/willend/TESTS/2022-11-01/McStas_DUAL_A100_DMSC_5e7/ILL_H22_D1B/ILL_H22_D1B.instr in dataset 1