loading system configuration loading override configuration from /users/willend/mxtest/mctest/../mccodelib/mcxtrace-test/McXtrace_DUAL_A100_DMSC/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./SOLEIL_MARS.c INFO: Using existing binary: ./SOLEIL_MARS.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 'SOLEIL_MARS' (/users/willend/xTESTS/2022-12-01/McXtrace_DUAL_A100_DMSC_5e7/SOLEIL_MARS/SOLEIL_MARS.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. Warning (Source): Bending_magnet is an experimental component - testing is ongoing [SOLEIL_MARS] Initialize Warning (Source): Bending_magnet is an experimental component - testing is ongoing [SOLEIL_MARS] Initialize Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Pt.dat' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Silicon.dat' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/FormFactors.txt' (Table_Read_Offset) Reusing input file 'Silicon.dat' (Table_Read_Offset) Reusing input file 'FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Reusing input file 'Pt.dat' (Table_Read_Offset) WARNING(Sample): p_interact=0, adjusting to 0.01, to avoid algorithm instability INFO (reflectivity-lib) reflectivity parameterization type: 'eth' WARNING(Sample): p_interact=0, adjusting to 0.01, to avoid algorithm instability Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/LaB6_660b_AVID2.hkl' (Table_Read_Offset) Table from file 'LaB6_660b_AVID2.hkl' (block 1) is 1453 x 6 (x=1:23), constant step. interpolation: linear '# TITLE La1 B6 [Cubic, Centric (-1 at origin)];# a b ...' PowderN: Sample: Reading 1453 rows from LaB6_660b_AVID2.hkl PowderN: Sample: Powder file probably of type Crystallographica/Fullprof (lau) WARNING: but F2 unit is set to barns=1 (barns). Intensity might be 100 times too high. PowderN: Sample: Read 1453 reflections from file 'LaB6_660b_AVID2.hkl' PowderN: Sample: WARNING: You have requested statistics for incoherent scattering but not set a material datafile ('Si.txt') nor defined sigma_inc! Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Si.txt' (Table_Read_Offset) [r6n22.esss.dk:3410544] 1 more process has sent help message help-mpi-btl-openib.txt / no device params found [r6n22.esss.dk:3410544] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages *** TRACE end *** Save [SOLEIL_MARS] Detector: displaySourceLenght_I=6.154e+12 displaySourceLenght_ERR=1.33081e+09 displaySourceLenght_N=5e+07 "Output1.L" Detector: displaySource_I=6.154e+12 displaySource_ERR=1.33081e+09 displaySource_N=5e+07 "emon_psd1.dat" Detector: emon_dcm0_I=0 emon_dcm0_ERR=0 emon_dcm0_N=0 "emon_dcm0.dat" Detector: displayMono_I=0.000233527 displayMono_ERR=6.2983e-08 displayMono_N=4.74545e+07 "emon_psd.dat" Detector: displayMonoLenght_I=0.000233527 displayMonoLenght_ERR=6.2983e-08 displayMonoLenght_N=4.74545e+07 "Output.L" Detector: emon_dcm1_I=1.09065e-05 emon_dcm1_ERR=1.43e-08 emon_dcm1_N=871145 "BeamMonitor2.dat" Detector: displaySlit2_I=8.9747e-05 displaySlit2_ERR=4.10278e-08 displaySlit2_N=7.15517e+06 "emon_psd3.dat" Finally [SOLEIL_MARS: 1]. Time: 13 [s] Detector: displayMonoLenght1_I=2.52394e-07 displayMonoLenght1_ERR=2.52452e-10 displayMonoLenght1_N=1.32332e+08 "displayMonoLenght1_1669862788.th" Finally [SOLEIL_MARS: 1]. Time: 13 [s] INFO: Placing instr file copy /users/willend/xTESTS/2022-12-01/McXtrace_DUAL_A100_DMSC_5e7/SOLEIL_MARS/SOLEIL_MARS.instr in dataset 1