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 Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) [Fluo_Diff] Initialize Fluo_Diff: Energy 16.99 [keV] [Fluo_Diff] Initialize PowderN: Sample: density/unit cell volume is NULL (Vc). Unactivating component. SampleF: Material SrCaMn mass fractions: | 22 %: Z= 20 Ca 40.1 [g/mol] 1.55 [g/cm3] | 30 %: Z= 25 Mn 54.9 [g/mol] 7.44 [g/cm3] | 48 %: Z= 38 Sr 87.6 [g/mol] 2.54 [g/cm3] SampleF: Material SrCaMn M=182.64 [g/mol] density=3.79672 [g/cm3] rho=0.0125188 [at/Angs-3] [Fluo_Diff] Initialize Error: Could not open input file 'SrCaMn' (Open_File) [Fluo_Diff] Initialize [Fluo_Diff] Initialize Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) [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 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Error: Could not open input file 'SrCaMn' (Open_File) Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 18 [s] % 60 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 62 Trace ETA 18 [s] % 60 Trace ETA 17 [s] % 63 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 63 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 18 [s] % 60 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 63 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 61 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 62 Trace ETA 17 [s] % 61 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 70 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 80 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 90 *** TRACE end *** Save [Fluo_Diff] Detector: detector_diffraction_I=4.50218e+11 detector_diffraction_ERR=1.39452e+09 detector_diffraction_N=117412 "diffraction.dat" Detector: xpad_I=6.12694e+11 xpad_ERR=1.62818e+09 xpad_N=159502 "diffraction_2d.dat" Detector: detector_fluo_I=3.47175e+13 detector_fluo_ERR=1.25611e+10 detector_fluo_N=8.99824e+06 "Fluorescence_all.dat" Detector: emon_fluo_I=3.41874e+13 emon_fluo_ERR=1.21574e+10 emon_fluo_N=8.89227e+06 "Fluorescence.dat" Detector: emon_Compton_I=3.95319e+08 emon_Compton_ERR=4.17047e+06 emon_Compton_N=11074 "Compton.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06963e+12 Compton=1.28892e+09 Rayleigh=1.10125e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06713e+12 Compton=1.21297e+09 Rayleigh=1.14749e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06864e+12 Compton=1.32449e+09 Rayleigh=1.13763e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06931e+12 Compton=1.34658e+09 Rayleigh=1.13066e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.068e+12 Compton=1.2159e+09 Rayleigh=1.15394e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06976e+12 Compton=1.39887e+09 Rayleigh=1.13898e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06844e+12 Compton=1.47039e+09 Rayleigh=1.12102e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.07006e+12 Compton=1.2815e+09 Rayleigh=1.10139e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06914e+12 Compton=1.32963e+09 Rayleigh=1.11572e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06888e+12 Compton=1.27637e+09 Rayleigh=1.14853e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.068e+12 Compton=1.25289e+09 Rayleigh=1.13812e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06903e+12 Compton=1.38597e+09 Rayleigh=1.13653e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06968e+12 Compton=1.33535e+09 Rayleigh=1.13686e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06714e+12 Compton=1.32155e+09 Rayleigh=1.11913e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.0683e+12 Compton=1.32206e+09 Rayleigh=1.14381e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06933e+12 Compton=1.29735e+09 Rayleigh=1.11588e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06783e+12 Compton=1.19404e+09 Rayleigh=1.14986e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06871e+12 Compton=1.29456e+09 Rayleigh=1.11112e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.0675e+12 Compton=1.38416e+09 Rayleigh=1.12111e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.07005e+12 Compton=1.24198e+09 Rayleigh=1.13775e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.07023e+12 Compton=1.41273e+09 Rayleigh=1.13101e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.0675e+12 Compton=1.25822e+09 Rayleigh=1.11247e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06834e+12 Compton=1.37268e+09 Rayleigh=1.1481e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06876e+12 Compton=1.34632e+09 Rayleigh=1.15286e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.0693e+12 Compton=1.44454e+09 Rayleigh=1.18185e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06883e+12 Compton=1.33737e+09 Rayleigh=1.13465e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.07006e+12 Compton=1.40757e+09 Rayleigh=1.14062e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.0674e+12 Compton=1.43433e+09 Rayleigh=1.16763e+10 Detector: emon_Rayleigh_I=5.29681e+11 emon_Rayleigh_ERR=3.15868e+09 emon_Rayleigh_N=94894 "Rayleigh.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06698e+12 Compton=1.32963e+09 Rayleigh=1.15349e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06808e+12 Compton=1.2624e+09 Rayleigh=1.15488e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06827e+12 Compton=1.23129e+09 Rayleigh=1.13817e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/SrCaMn-farhie-20250513-122136/data]. Time: 17 [s] SampleF: scattered intensity: fluo=1.06764e+12 Compton=1.35529e+09 Rayleigh=1.15648e+10