Simulation 'Fluo_Diff' (Fluo_Diff.instr): running on 4 nodes (master is 're-grades-02', MPI version 3.1). [Fluo_Diff] Initialize [Fluo_Diff] Initialize 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: Energy 16.99 [keV] [Fluo_Diff] Initialize PowderN: Sample: density/unit cell volume is NULL (Vc). Unactivating component. 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] Error: Could not open input file 'Pt' (Open_File) Trace ETA 1.08333 [min] % 16 Trace ETA 1.08333 [min] % 16 Trace ETA 1.06667 [min] % 17 Trace ETA 1.06667 [min] % 17 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=1.26222e+11 detector_diffraction_ERR=1.43794e+09 detector_diffraction_N=8909 "diffraction.dat" Detector: xpad_I=1.75579e+11 xpad_ERR=1.70167e+09 xpad_N=12368 "diffraction_2d.dat" Detector: detector_fluo_I=1.31996e+14 detector_fluo_ERR=4.95451e+10 detector_fluo_N=8.97772e+06 "Fluorescence_all.dat" Detector: emon_fluo_I=1.19522e+14 emon_fluo_ERR=4.43622e+10 emon_fluo_N=8.16263e+06 "Fluorescence.dat" Detector: emon_Compton_I=8.86332e+08 emon_Compton_ERR=7.15886e+06 emon_Compton_N=19150 "Compton.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-105618/data]. Time: 1.06667 [min] SampleF: scattered intensity: fluo=2.99517e+13 Compton=7.0285e+10 Rayleigh=2.91161e+12 Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-105618/data]. Time: 1.06667 [min] SampleF: scattered intensity: fluo=2.99592e+13 Compton=6.86204e+10 Rayleigh=2.90554e+12 Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-105618/data]. Time: 1.06667 [min] SampleF: scattered intensity: fluo=2.99569e+13 Compton=7.06549e+10 Rayleigh=2.92417e+12 Detector: emon_Rayleigh_I=1.24723e+13 emon_Rayleigh_ERR=2.20617e+10 emon_Rayleigh_N=795936 "Rayleigh.dat" Finally [Fluo_Diff: /var/www/html/data/diffraction/Pt-farhie-20230921-105618/data]. Time: 1.06667 [min] SampleF: scattered intensity: fluo=2.99547e+13 Compton=7.08296e+10 Rayleigh=2.91041e+12