Simulation 'Fluo_Diff' (Fluo_Diff.instr): running on 32 nodes (master is 're-grades-02', MPI version 3.1). [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Fluo_Diff: Energy 16.99 [keV] [Fluo_Diff] Initialize PowderN: Sample: density/unit cell volume is NULL (Vc). Unactivating component. SampleF: Material Fe3C mass fractions: | 6.7 %: Z= 6 C 12 [g/mol] 2 [g/cm3] | 93 %: Z= 26 Fe 55.9 [g/mol] 7.87 [g/cm3] SampleF: Material Fe3C M=179.56 [g/mol] density=7.48111 [g/cm3] rho=0.0250904 [at/Angs-3] [Fluo_Diff] Initialize [Fluo_Diff] Initialize Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) Error: Could not open input file 'Fe3C' (Open_File) *** TRACE end *** Save [Fluo_Diff] Detector: detector_diffraction_I=2.91137e+07 detector_diffraction_ERR=5.58601e+06 detector_diffraction_N=594 "diffraction.dat" Detector: xpad_I=4.94674e+07 xpad_ERR=8.76078e+06 xpad_N=839 "diffraction_2d.dat" Detector: detector_fluo_I=1.79708e+13 detector_fluo_ERR=6.61285e+09 detector_fluo_N=8.9985e+06 "Fluorescence_all.dat" Detector: emon_fluo_I=1.74068e+13 emon_fluo_ERR=6.25189e+09 emon_fluo_N=8.71713e+06 "Fluorescence.dat" Detector: emon_Compton_I=9.80929e+08 emon_Compton_ERR=5.27314e+06 emon_Compton_N=42012 "Compton.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43728e+11 Compton=2.65373e+09 Rayleigh=1.50759e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43462e+11 Compton=2.68611e+09 Rayleigh=1.52459e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44914e+11 Compton=2.50776e+09 Rayleigh=1.47623e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44065e+11 Compton=2.65584e+09 Rayleigh=1.48787e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43452e+11 Compton=2.61354e+09 Rayleigh=1.54739e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43913e+11 Compton=2.67967e+09 Rayleigh=1.48101e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44417e+11 Compton=2.71063e+09 Rayleigh=1.47967e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43567e+11 Compton=2.63978e+09 Rayleigh=1.48002e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44047e+11 Compton=2.58559e+09 Rayleigh=1.4817e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43534e+11 Compton=2.60764e+09 Rayleigh=1.51421e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43902e+11 Compton=2.67483e+09 Rayleigh=1.48981e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44079e+11 Compton=2.4282e+09 Rayleigh=1.52413e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43887e+11 Compton=2.60995e+09 Rayleigh=1.45254e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44158e+11 Compton=2.55358e+09 Rayleigh=1.46456e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43222e+11 Compton=2.70263e+09 Rayleigh=1.46697e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43619e+11 Compton=2.54486e+09 Rayleigh=1.50333e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44298e+11 Compton=2.55989e+09 Rayleigh=1.47348e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44601e+11 Compton=2.58104e+09 Rayleigh=1.44838e+10 Detector: emon_Rayleigh_I=5.62992e+11 emon_Rayleigh_ERR=2.15493e+09 emon_Rayleigh_N=239362 "Rayleigh.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43971e+11 Compton=2.69135e+09 Rayleigh=1.5032e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43364e+11 Compton=2.59508e+09 Rayleigh=1.49397e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44179e+11 Compton=2.73595e+09 Rayleigh=1.48464e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.45096e+11 Compton=2.4965e+09 Rayleigh=1.49932e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44261e+11 Compton=2.69842e+09 Rayleigh=1.47003e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44113e+11 Compton=2.62497e+09 Rayleigh=1.46548e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.45138e+11 Compton=2.58599e+09 Rayleigh=1.49379e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.4475e+11 Compton=2.77844e+09 Rayleigh=1.46987e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.44032e+11 Compton=2.63734e+09 Rayleigh=1.52998e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43384e+11 Compton=2.66333e+09 Rayleigh=1.49734e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43119e+11 Compton=2.61137e+09 Rayleigh=1.52721e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43982e+11 Compton=2.62167e+09 Rayleigh=1.49107e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43833e+11 Compton=2.61357e+09 Rayleigh=1.5185e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Fe3C-tchommau-20250731-093350/data]. Time: 9 [s] SampleF: scattered intensity: fluo=5.43464e+11 Compton=2.46834e+09 Rayleigh=1.49532e+10