loading system configuration loading override configuration from /home/nexmap/pkwi/mxtest/mctest/../mccodelib/mcxtrace-test/McXtrace-1.x_CPU_MPICC/mccode_config.json INFO: Using directory: "1" INFO: Using existing c-file: ./SOLEIL_MARS.c INFO: Using existing binary: ./SOLEIL_MARS.out INFO: === Simulation 'SOLEIL_MARS' (/home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace-1.x_CPU_MPICC_5e7/SOLEIL_MARS/SOLEIL_MARS.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/1.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Pt.dat' (Table_Read_Offset) Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize Energie 16.99 / Angle 10.9544z translation 0.0497296[SOLEIL_MARS] Initialize INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/1.x-dev/tools/Python/mxrun/../mccodelib/../../../data/Si.txt' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/1.x-dev/tools/Python/mxrun/../mccodelib/../../../data/FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/1.x-dev/tools/Python/mxrun/../mccodelib/../../../data/LaB6_660b_AVID2.hkl' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' 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! INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Trace ETA 50 [s] % 21 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 50 [s] % 21 Trace ETA 49 [s] % 22 Trace ETA 50 [s] % 21 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 50 [s] % 21 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 Trace ETA 49 [s] % 22 32 32 32 32 32 32 32 32 32 31 32 31 31 32 32 31 42 42 42 42 42 42 42 42 42 42 42 41 42 41 41 41 52 52 52 52 52 52 52 52 52 52 52 51 51 52 51 51 62 62 62 62 62 62 62 62 62 62 62 61 61 62 61 61 72 72 72 72 72 72 72 72 72 72 72 71 71 72 71 71 82 82 82 82 82 82 82 82 82 82 82 81 81 82 81 81 92 92 92 92 92 92 92 92 92 92 92 91 92 91 91 91 Finally [SOLEIL_MARS: 1]. Time: 48 [s] Finally [SOLEIL_MARS: 1]. Time: 48 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Save [SOLEIL_MARS] Detector: displaySourceLength_I=6.1564e+12 displaySourceLength_ERR=1.33105e+09 displaySourceLength_N=5e+07 "Output1.L" Detector: displaySource_I=6.1564e+12 displaySource_ERR=1.33105e+09 displaySource_N=5e+07 "emon_psd1.dat" Detector: emon_dcm0_I=6.87528e+09 emon_dcm0_ERR=3.23977e+07 emon_dcm0_N=5.78308e+06 "emon_dcm0.dat" Detector: displayMono_I=6.75222e+11 displayMono_ERR=3.72444e+08 displayMono_N=4.91301e+07 "emon_psd.dat" Detector: displayMonoLength_I=6.75222e+11 displayMonoLength_ERR=3.72444e+08 displayMonoLength_N=4.91301e+07 "Output.L" Detector: emon_dcm1_I=2.75144e+09 emon_dcm1_ERR=2.15129e+07 emon_dcm1_N=903361 "BeamMonitor2.dat" Detector: emon_dcm1_full_range_I=2.6833e+11 emon_dcm1_full_range_ERR=2.46653e+08 emon_dcm1_full_range_N=7.6688e+06 "BeamMonitor2_full_e_range.dat" Detector: displaySlit2_I=2.6833e+11 displaySlit2_ERR=2.46653e+08 displaySlit2_N=7.6688e+06 "emon_psd3.dat" Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Finally [SOLEIL_MARS: 1]. Time: 49 [s] Detector: displayMonoLength1_I=7.08778e+08 displayMonoLength1_ERR=336738 displayMonoLength1_N=2.20925e+08 "displayMonoLength1_1703044479.th" Finally [SOLEIL_MARS: 1]. Time: 49 [s] PowderN: Sample: Info: you may highly improve the computation efficiency by using SPLIT 198 COMPONENT Sample=PowderN(...) in the instrument description /home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace-1.x_CPU_MPICC_5e7/SOLEIL_MARS/SOLEIL_MARS.instr. INFO: Placing instr file copy /home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace-1.x_CPU_MPICC_5e7/SOLEIL_MARS/SOLEIL_MARS.instr in dataset 1