INFO: Using directory: "1" INFO: Using existing c-file: ./SOLEIL_DIFFABS.c INFO: Using existing binary: ./SOLEIL_DIFFABS.out INFO: === Simulation 'SOLEIL_DIFFABS' (SOLEIL_DIFFABS.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). SOLEIL_DIFFABS: E0=13 [keV] M1_angle=3 [mrad] 0.171887 [deg] SOLEIL_DIFFABS: Monochromator theta=8.65136 [deg] [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Rh.txt' (Table_Read_Offset) [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize [SOLEIL_DIFFABS] Initialize INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Si.txt' (Table_Read_Offset) Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/FormFactors.txt' (Table_Read_Offset) Reusing input file 'Si.txt' (Table_Read_Offset) Reusing input file 'FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Reusing input file 'Rh.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/LaB6_660b_AVID2.hkl' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. 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: powder: 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: powder: Read 1453 reflections from file 'LaB6_660b_AVID2.hkl' Fluorescence: INFO: fluo: found material La1B6 from file LaB6_660b_AVID2.hkl fluo: Material La1B6 mass fractions: | 32 %: Z= 5 B 10.8 [g/mol] 2.37 [g/cm3] | 68 %: Z= 57 La 139 [g/mol] 6.15 [g/cm3] fluo: Material La1B6 M=203.78 [g/mol] density=4.94961 [g/cm3] rho=0.0146272 [at/Angs-3] *** TRACE end *** Save [SOLEIL_DIFFABS] Detector: DCM_in_I=5.59892e+13 DCM_in_ERR=1.84941e+10 DCM_in_N=9.17267e+06 "DCM_in_1745724005.x_y" Detector: DCM_in_div_I=5.59892e+13 DCM_in_div_ERR=1.84941e+10 DCM_in_div_N=9.17266e+06 "DCM_in_div_1745724005.hd_vd" Detector: DCM_out_I=3.14172e+10 DCM_out_ERR=3.9806e+08 DCM_out_N=9.17267e+06 "DCM_out_1745724005.x_y" Detector: DCM_out_div_I=3.14172e+10 DCM_out_div_ERR=3.9806e+08 DCM_out_div_N=9.17267e+06 "DCM_out_div_1745724005.hd_vd" Detector: DCM_out_e_I=3.14172e+10 DCM_out_e_ERR=3.9806e+08 DCM_out_e_N=9.17267e+06 "DCM_out_e_1745724005.E" Detector: sample_stage_I=2.31559e+10 sample_stage_ERR=3.36558e+08 sample_stage_N=6.90334e+06 "sample_stage_1745724005.x_y" Detector: fluo_monitor_I=1.12194e+07 fluo_monitor_ERR=323224 fluo_monitor_N=1.12461e+07 "fluo_monitor_1745724005.E" Detector: det_angle_I=1.52148e+06 det_angle_ERR=121727 det_angle_N=914079 "det_angle_1745724005.th" Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Detector: xpad_I=1.64818e+06 xpad_ERR=103083 xpad_N=3.45714e+06 "xpad_1745724005.th_y" Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] Finally [SOLEIL_DIFFABS: 1]. Time: 8 [s] INFO: fluo: scattered intensity: fluo=1.00433e+07 Compton=57.1411 Rayleigh=912177 INFO: Placing instr file copy SOLEIL_DIFFABS.instr in dataset 1 INFO: Placing generated c-code copy SOLEIL_DIFFABS.c in dataset 1