loading system configuration loading override configuration from /home/nexmap/pkwi/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas-2.x_CPU_MPICC/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_H22_D1A.c INFO: Using existing binary: ./ILL_H22_D1A.out INFO: === Simulation 'ILL_H22_D1A' (/home/nexmap/pkwi/TESTS/2022-11-01/McStas-2.x_CPU_MPICC_5e7/ILL_H22_D1A/ILL_H22_D1A.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] Instrument: ILL_H22_D1A (H22@ILL thermal guide). * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container Instrument: ILL_H22_D1A (H22@ILL thermal guide). ILL_H22_D1A: Detailed DIF configuration * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container * Incoming beam: lambda=1.911 [Angs] EI=22.4 [meV] KI=3.288 [Angs-1] Vi=2070.14 [m/s] * Monochromator: DM=1.092 [Angs] RV=2.187 [m] curved, take-off A2=-122 [deg] * Sample: Na2Ca3Al2F14.laz in V.laz cylinder container [ILL_H22_D1A] Initialize Source_gen: component Thermal (square 0.14 x 0.22) focusing distance dist=3.18 area=0.038 x 0.2 spectra 1.881 to 1.941 AA (21.715 to 23.122 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]. [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize [ILL_H22_D1A] Initialize 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: D1A_Mono_Dx is using automatic limits option 'auto' together with MPI. WARNING this may create incorrect distributions (but integrated flux will be right). WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability Monitor_nD: Lmon is using automatic limits option 'auto' together with MPI. WARNING this may create incorrect distributions (but integrated flux will be right). PowderN: Environment_in: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability 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: Environment_in: Reading 26 rows from Al.laz PowderN: Environment_in: Read 26 reflections from file 'Al.laz' PowderN: Environment_in: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz PowderN: Container_in: Concentric mode - remember to include the 'opposite' copy of this component ! WARNING The equivalent, 'opposite' comp should have concentric=0 Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_in): p_inc=0, adjusting to 0.01, to avoid algorithm instability Table from file 'V.laz' (block 1) is 21 x 18 (x=1:6), constant step. interpolation: linear '# TITLE *-V-[IM3-M] James, W.J.;Straumanis, M.E.[1960];# CELL 3.024100 3.02 ...' PowderN: Container_in: Reading 21 rows from V.laz PowderN: Container_in: Read 21 reflections from file 'V.laz' PowderN: Container_in: Vc=27.66 [Angs] sigma_abs=10.16 [barn] sigma_inc=9.87 [barn] reflections=V.laz Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Na2Ca3Al2F14.laz' (Table_Read_Offset) WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability 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 Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/V.laz' (Table_Read_Offset) WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability Table from file 'V.laz' (block 1) is 21 x 18 (x=1:6), constant step. interpolation: linear '# TITLE *-V-[IM3-M] James, W.J.;Straumanis, M.E.[1960];# CELL 3.024100 3.02 ...' PowderN: Container_out: Reading 21 rows from V.laz PowderN: Container_out: Read 21 reflections from file 'V.laz' PowderN: Container_out: Vc=27.66 [Angs] sigma_abs=10.16 [barn] sigma_inc=9.87 [barn] reflections=V.laz WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability Opening input file '/home/nexmap/pkwi/McStas/mcstas/2.x-dev/tools/Python/mcrun/../mccodelib/../../../data/Al.laz' (Table_Read_Offset) WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability 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: Environment_out: Reading 26 rows from Al.laz PowderN: Environment_out: Read 26 reflections from file 'Al.laz' PowderN: Environment_out: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability WARNING(Environment_out): p_inc=0, adjusting to 0.01, to avoid algorithm instability Trace ETA 24 [s] % 44 Trace ETA 25 [s] % 43 Trace ETA 24 [s] % 44 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 Trace ETA 25 [s] % 43 45 45 45 45 45 45 45 45 45 45 45 45 45 45 45 45 50 50 50 50 50 50 50 50 50 50 50 50 50 50 50 50 55 55 55 55 55 55 55 55 55 55 55 55 55 55 55 55 60 60 60 60 60 60 60 60 60 60 60 60 60 60 60 60 65 65 65 65 65 65 65 65 65 65 65 65 65 65 65 65 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 75 75 75 75 75 75 75 75 75 75 75 75 75 75 75 75 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 85 85 85 85 85 85 85 85 85 85 85 85 85 85 85 85 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 95 95 95 95 95 95 95 95 95 95 95 95 95 95 95 95 Finally [ILL_H22_D1A: 1]. Time: 24 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Save [ILL_H22_D1A] Detector: GuideOut_xy_I=5.44409e+07 GuideOut_xy_ERR=46910.1 GuideOut_xy_N=4.75904e+06 "GuideOut_xy_1667260963.x_y" Detector: GuideOut_dxdy_I=5.44409e+07 GuideOut_dxdy_ERR=46910.1 GuideOut_dxdy_N=4.75887e+06 "GuideOut_dxdy_1667260963.hd_vd" Detector: GuideOut_Phic_I=5.78396e+07 GuideOut_Phic_ERR=49828.1 GuideOut_Phic_N=4.75888e+06 "GuideOut_Phic" Detector: GuideOut_L_I=5.44407e+07 GuideOut_L_ERR=46910 GuideOut_L_N=4.75888e+06 "GuideOut_L_1667260963.L" Detector: D1A_Mono_Dx_I=5.18999e+07 D1A_Mono_Dx_ERR=45903.5 D1A_Mono_Dx_N=4.2663e+06 "D1A_Mono_Dx_1667260963.hd" Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Detector: Lmon_I=1.0429e+08 Lmon_ERR=158876 Lmon_N=1.54579e+06 "Lmon_1667260963.L" Detector: PSDsample_I=1.76659e+08 PSDsample_ERR=206838 PSDsample_N=2.61264e+06 "PSDsample_1667260963.x_y" Detector: BananaTheta_I=146364 BananaTheta_ERR=2436.62 BananaTheta_N=153827 "BananaTheta_1667260963.th" Finally [ILL_H22_D1A: 1]. Time: 25 [s] Finally [ILL_H22_D1A: 1]. Time: 25 [s] Detector: BananaPSD_I=414558 BananaPSD_ERR=3982.41 BananaPSD_N=426261 "BananaPSD_1667260963.th_y" Finally [ILL_H22_D1A: 1]. Time: 25 [s] PowderN: Sample: Info: you may highly improve the computation efficiency by using SPLIT 133 COMPONENT Sample=PowderN(...) in the instrument description /home/nexmap/pkwi/TESTS/2022-11-01/McStas-2.x_CPU_MPICC_5e7/ILL_H22_D1A/ILL_H22_D1A.instr. INFO: Placing instr file copy /home/nexmap/pkwi/TESTS/2022-11-01/McStas-2.x_CPU_MPICC_5e7/ILL_H22_D1A/ILL_H22_D1A.instr in dataset 1