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_LUCIA.c INFO: Using existing binary: ./SOLEIL_LUCIA.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_LUCIA' (/users/willend/xTESTS/2023-07-01/McXtrace_DUAL_A100_DMSC_5e7/SOLEIL_LUCIA/SOLEIL_LUCIA.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. SOLEIL_LUCIA: E0=3 [keV] Monochromator dcm_theta=40.6795 [deg] [SOLEIL_LUCIA] Initialize SOLEIL_LUCIA: E0=3 [keV] Monochromator dcm_theta=40.6795 [deg] [SOLEIL_LUCIA] Initialize Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Si.txt' (Table_Read_Offset) Opening input file '/users/willend/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/../mccodelib/../../../data/FormFactors.txt' (Table_Read_Offset) Reusing input file 'Si.txt' (Table_Read_Offset) Reusing input file 'FormFactors.txt' (Table_Read_Offset) Loading geometry file (OFF/PLY): wire.ply Number of vertices: 2584 Number of polygons: 5438 Warning: Aspect ratio of the geometry wire.ply was modified. If you want to keep the original proportions, specifiy only one of the dimensions. Bounding box dimensions for geometry wire.ply: Length=0.001000 (0.577%) Width= 0.001000 (1.282%) Depth= 0.000500 (0.343%) Error: Could not open input file 'CaCO3Ti' (Open_File) Error: Could not open input file 'CaCO3Ti' (Open_File) sample: Material CaCO3Ti mass fractions: | 8.1 %: Z= 6 C 12 [g/mol] 2 [g/cm3] | 32 %: Z= 8 O 16 [g/mol] 0.00133 [g/cm3] | 27 %: Z= 20 Ca 40.1 [g/mol] 1.55 [g/cm3] | 32 %: Z= 22 Ti 47.9 [g/mol] 4.54 [g/cm3] sample: Material CaCO3Ti M=147.99 [g/mol] density=2.05199 [g/cm3] rho=0.00835014 [at/Angs-3] NOTE: CPU COMPONENT grammar activated: 1) "FUNNEL" raytrace algorithm enabled. 2) Any SPLIT's are dynamically allocated based on available buffer size. [r6n22.esss.dk:1298715] 1 more process has sent help message help-mpi-btl-openib.txt / no device params found [r6n22.esss.dk:1298715] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages Save [SOLEIL_LUCIA] Detector: mon_src_xy_I=2.53322e+23 mon_src_xy_ERR=1.18092e+20 mon_src_xy_N=4.86056e+07 "mon_src_xy_1688185849.x_y" Detector: mon_src_e_I=2.53322e+23 mon_src_e_ERR=1.18092e+20 mon_src_e_N=4.86056e+07 "mon_src_e_1688185849.E" Detector: slit_mon_xy_I=1.08287e+23 slit_mon_xy_ERR=7.72148e+19 slit_mon_xy_N=2.07674e+07 "slit_mon_xy_1688185849.x_y" Detector: mon_dcm_e_I=3.483e+18 mon_dcm_e_ERR=2.4972e+16 mon_dcm_e_N=2.07674e+07 "mon_dcm_e_1688185849.E" Detector: mon_dcm_xy_I=3.483e+18 mon_dcm_xy_ERR=2.4972e+16 mon_dcm_xy_N=2.07674e+07 "mon_dcm_xy_1688185849.x_y" Detector: sample_stage_I=3.47741e+18 sample_stage_ERR=2.49518e+16 sample_stage_N=2.07351e+07 "sample_stage_1688185849.x_y" Finally [SOLEIL_LUCIA: 1]. Time: 8.21667 [min] Detector: mon_spl_fluo_I=3.27595e+14 mon_spl_fluo_ERR=5.94298e+12 mon_spl_fluo_N=6.57059e+06 "mon_spl_fluo_1688185849.E" sample: scattered intensity: fluo=0 Compton=0 Rayleigh=0 Finally [SOLEIL_LUCIA: 1]. Time: 8.21667 [min] sample: scattered intensity: fluo=0 Compton=0 Rayleigh=0 INFO: Placing instr file copy /users/willend/xTESTS/2023-07-01/McXtrace_DUAL_A100_DMSC_5e7/SOLEIL_LUCIA/SOLEIL_LUCIA.instr in dataset 1