Simulation 'Fluo_Diff' (Fluo_Diff.instr): running on 4 nodes (master is 're-grades-02', MPI version 3.1). Error: Could not open input file 'Pt' (Open_File) Error: Could not open input file 'Pt' (Open_File) Error: Could not open input file 'Pt' (Open_File) [Fluo_Diff] Initialize [Fluo_Diff] Initialize [Fluo_Diff] Initialize Fluo_Diff: Energy 16.99 [keV] [Fluo_Diff] Initialize PowderN: Sample: density/unit cell volume is NULL (Vc). Unactivating component. Error: Could not open input file 'Pt' (Open_File) SampleF: Material Pt mass fractions: | 1e+02 %: Z= 78 Pt 195 [g/mol] 21.4 [g/cm3] SampleF: Material Pt M=195.09 [g/mol] density=21.45 [g/cm3] rho=0.066213 [at/Angs-3] Trace ETA 1.13333 [min] % 16 Trace ETA 1.13333 [min] % 16 Trace ETA 1.15 [min] % 15 Trace ETA 1.16667 [min] % 15 20 20 20 20 30 30 30 30 40 40 40 40 50 50 50 50 60 60 60 60 70 70 70 70 80 80 80 80 90 90 90 90 *** TRACE end *** Save [Fluo_Diff] Detector: detector_diffraction_I=8.64495e+10 detector_diffraction_ERR=1.19514e+09 detector_diffraction_N=6133 "diffraction.dat" Detector: xpad_I=1.16884e+11 xpad_ERR=1.38972e+09 xpad_N=8300 "diffraction_2d.dat" Detector: detector_fluo_I=1.32341e+14 detector_fluo_ERR=4.96077e+10 detector_fluo_N=9.00048e+06 "Fluorescence_all.dat" Detector: emon_fluo_I=1.19851e+14 emon_fluo_ERR=4.44253e+10 emon_fluo_N=8.18414e+06 "Fluorescence.dat" Detector: emon_Compton_I=8.98079e+08 emon_Compton_ERR=7.22922e+06 emon_Compton_N=19350 "Compton.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-102855/data]. Time: 1.1 [min] SampleF: scattered intensity: fluo=2.99831e+13 Compton=7.18222e+10 Rayleigh=2.91602e+12 Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-102855/data]. Time: 1.1 [min] SampleF: scattered intensity: fluo=2.99628e+13 Compton=7.17886e+10 Rayleigh=2.91226e+12 Detector: emon_Rayleigh_I=1.24891e+13 emon_Rayleigh_ERR=2.20752e+10 emon_Rayleigh_N=796987 "Rayleigh.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-102855/data]. Time: 1.1 [min] SampleF: scattered intensity: fluo=2.99481e+13 Compton=7.11696e+10 Rayleigh=2.91585e+12 Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-102855/data]. Time: 1.1 [min] SampleF: scattered intensity: fluo=2.99573e+13 Compton=6.82306e+10 Rayleigh=2.92601e+12