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 Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (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 [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 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) [Fluo_Diff] Initialize [Fluo_Diff] Initialize Fluo_Diff: Energy 8 [keV] [Fluo_Diff] Initialize PowderN: Sample: density/unit cell volume is NULL (Vc). Unactivating component. Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) Error: Could not open input file 'Cr' (Open_File) SampleF: Material Cr mass fractions: | 1e+02 %: Z= 24 Cr 52 [g/mol] 7.18 [g/cm3] SampleF: Material Cr M=52 [g/mol] density=7.18 [g/cm3] rho=0.0831519 [at/Angs-3] *** TRACE end *** Save [Fluo_Diff] Detector: detector_diffraction_I=4.61119e+09 detector_diffraction_ERR=4.08557e+08 detector_diffraction_N=234 "diffraction.dat" Detector: xpad_I=5.90959e+09 xpad_ERR=4.65342e+08 xpad_N=296 "diffraction_2d.dat" Detector: detector_fluo_I=2.97485e+14 detector_fluo_ERR=1.05759e+11 detector_fluo_N=8.99802e+06 "Fluorescence_all.dat" Detector: emon_fluo_I=2.93889e+14 emon_fluo_ERR=1.04517e+11 emon_fluo_N=8.89196e+06 "Fluorescence.dat" Detector: emon_Compton_I=2.26657e+09 emon_Compton_ERR=3.38912e+07 emon_Compton_N=5778 "Compton.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19468e+12 Compton=5.13733e+09 Rayleigh=1.03657e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19855e+12 Compton=5.941e+09 Rayleigh=1.04863e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.1785e+12 Compton=6.26755e+09 Rayleigh=9.95991e+10 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18483e+12 Compton=5.70838e+09 Rayleigh=1.02553e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.20571e+12 Compton=5.77236e+09 Rayleigh=1.0306e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.16034e+12 Compton=5.25847e+09 Rayleigh=1.04621e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18e+12 Compton=5.33273e+09 Rayleigh=1.03594e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19268e+12 Compton=6.10387e+09 Rayleigh=1.02439e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.17877e+12 Compton=6.20919e+09 Rayleigh=1.03314e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.1649e+12 Compton=6.04877e+09 Rayleigh=1.01934e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.17689e+12 Compton=5.94395e+09 Rayleigh=1.05344e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19222e+12 Compton=6.08244e+09 Rayleigh=1.03779e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18835e+12 Compton=6.19587e+09 Rayleigh=1.04744e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19118e+12 Compton=5.24306e+09 Rayleigh=1.01498e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19108e+12 Compton=6.55757e+09 Rayleigh=1.08158e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18923e+12 Compton=5.53961e+09 Rayleigh=1.025e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.1895e+12 Compton=6.27485e+09 Rayleigh=1.02847e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.17559e+12 Compton=6.40922e+09 Rayleigh=1.04784e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.17843e+12 Compton=6.35156e+09 Rayleigh=1.04145e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.17003e+12 Compton=5.44326e+09 Rayleigh=1.02742e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19023e+12 Compton=5.55069e+09 Rayleigh=1.00191e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18667e+12 Compton=6.70014e+09 Rayleigh=1.02845e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18156e+12 Compton=5.15864e+09 Rayleigh=1.05054e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19208e+12 Compton=6.01684e+09 Rayleigh=1.03576e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18648e+12 Compton=5.9104e+09 Rayleigh=1.02092e+11 Detector: emon_Rayleigh_I=3.59339e+12 emon_Rayleigh_ERR=1.61641e+10 emon_Rayleigh_N=100280 "Rayleigh.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18903e+12 Compton=5.90871e+09 Rayleigh=1.04852e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.1891e+12 Compton=6.81335e+09 Rayleigh=1.05122e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.16784e+12 Compton=7.34684e+09 Rayleigh=1.06954e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18907e+12 Compton=5.78444e+09 Rayleigh=1.06267e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19202e+12 Compton=5.60635e+09 Rayleigh=1.0154e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.18638e+12 Compton=6.35539e+09 Rayleigh=1.05451e+11 Finally [Fluo_Diff: /var/www/html/data/diffraction/Cr-hemmerle-20231101-225937/data]. Time: 9 [s] SampleF: scattered intensity: fluo=9.19317e+12 Compton=6.83164e+09 Rayleigh=1.02779e+11